data_1rcs_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 1rcs _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 . . . . . 0 N--CA 1.531 3.594 0 N-CA-C 106.908 -1.516 . . . . 0.0 106.908 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.428 ' CE3' ' HG ' ' B' ' 551' ' ' LEU . 68.5 t-105 -57.23 -21.09 31.44 Favored 'General case' 0 N--CA 1.534 3.771 0 CA-C-O 118.073 -0.965 . . . . 0.0 111.76 175.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -91.29 -30.6 16.5 Favored 'General case' 0 N--CA 1.529 3.476 0 CA-C-O 118.182 -0.913 . . . . 0.0 111.861 -177.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.9 mtt180 -64.12 -26.82 68.71 Favored 'General case' 0 N--CA 1.535 3.796 0 N-CA-C 106.122 -1.807 . . . . 0.0 106.122 172.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -83.21 -32.74 26.36 Favored 'General case' 0 N--CA 1.506 2.361 0 CA-C-O 116.739 -1.6 . . . . 0.0 108.564 174.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.3 t -76.25 -25.25 16.55 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.227 0 CA-C-N 121.682 2.037 . . . . 0.0 112.885 -177.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -77.97 -43.79 28.64 Favored 'General case' 0 N--CA 1.532 3.648 0 CA-C-N 120.454 1.479 . . . . 0.0 108.83 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.4 mp -71.43 -27.2 63.12 Favored 'General case' 0 N--CA 1.53 3.557 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 176.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -67.57 -35.82 79.76 Favored 'General case' 0 N--CA 1.53 3.55 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 176.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.9 ttmt -68.66 -25.68 64.94 Favored 'General case' 0 N--CA 1.515 2.781 0 CA-C-O 118.074 -0.965 . . . . 0.0 110.931 177.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -70.39 -38.51 74.71 Favored 'General case' 0 N--CA 1.533 3.676 0 CA-C-N 119.435 1.016 . . . . 0.0 109.434 178.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -89.59 -8.85 51.71 Favored 'General case' 0 N--CA 1.499 2.02 0 CA-C-O 118.371 -0.823 . . . . 0.0 110.762 178.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -79.01 -33.82 44.55 Favored 'General case' 0 N--CA 1.53 3.526 0 CA-C-N 120.136 1.335 . . . . 0.0 108.994 179.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -65.61 -43.74 88.69 Favored 'General case' 0 N--CA 1.535 3.818 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 66.9 m-80 -88.28 -88.7 0.14 Allowed 'General case' 0 N--CA 1.513 2.704 0 N-CA-C 106.341 -1.726 . . . . 0.0 106.341 176.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.8 p30 152.9 48.46 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.039 0 C-N-CA 127.318 2.247 . . . . 0.0 108.418 177.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.6 mt -109.99 14.06 23.15 Favored 'General case' 0 N--CA 1.528 3.435 0 C-N-CA 124.493 1.117 . . . . 0.0 110.456 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 30.2 p-80 -81.43 3.65 23.81 Favored 'General case' 0 N--CA 1.518 2.939 0 C-N-CA 123.381 0.672 . . . . 0.0 109.352 175.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.413 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 22.9 mt -94.03 -51.46 0.26 Allowed Pre-proline 0 N--CA 1.507 2.382 0 CA-C-O 116.857 -1.544 . . . . 0.0 108.565 -175.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.413 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 8.2 Cg_exo -61.63 -32.61 87.36 Favored 'Trans proline' 0 C--N 1.397 3.101 0 N-CA-C 106.257 -2.247 . . . . 0.0 106.257 169.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.7 tt -60.25 -46.34 90.14 Favored 'General case' 0 N--CA 1.529 3.518 0 C-N-CA 124.598 1.159 . . . . 0.0 109.05 174.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.35 -12.26 60.48 Favored 'General case' 0 N--CA 1.533 3.7 0 CA-C-O 118.526 -0.749 . . . . 0.0 111.199 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -87.84 -19.18 27.79 Favored 'General case' 0 N--CA 1.514 2.75 0 CA-C-O 117.282 -1.342 . . . . 0.0 111.273 178.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -113.93 -23.7 9.46 Favored 'General case' 0 N--CA 1.534 3.729 0 CA-C-N 120.591 1.541 . . . . 0.0 114.038 -178.301 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 23.6 ptp -129.23 27.76 5.32 Favored 'General case' 1 N--CA 1.546 4.33 0 CA-C-N 120.6 1.545 . . . . 0.0 111.46 178.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -135.16 -68.25 0.53 Allowed 'General case' 0 N--CA 1.515 2.795 0 CA-C-O 117.922 -1.037 . . . . 0.0 109.233 177.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 25.5 p 121.47 160.59 0.0 OUTLIER Pre-proline 1 N--CA 1.571 5.624 0 C-N-CA 128.003 2.521 . . . . 0.0 109.8 -179.232 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -68.14 -28.62 34.21 Favored 'Trans proline' 0 C--N 1.394 2.942 0 C-N-CA 122.3 2.0 . . . . 0.0 109.297 175.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -66.95 -19.05 65.65 Favored 'General case' 0 N--CA 1.532 3.636 0 CA-C-O 118.407 -0.806 . . . . 0.0 110.462 176.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -75.7 -29.67 59.05 Favored 'General case' 0 N--CA 1.525 3.281 0 CA-C-O 117.853 -1.07 . . . . 0.0 109.656 178.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 12.7 ptt180 -91.35 -14.32 30.93 Favored 'General case' 0 N--CA 1.535 3.806 0 CA-C-N 119.39 0.996 . . . . 0.0 108.535 173.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -79.8 -22.81 42.64 Favored 'General case' 0 N--CA 1.518 2.953 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 173.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -93.96 -36.04 12.36 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 123.854 0.862 . . . . 0.0 109.156 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.474 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 18.1 tp -75.05 -25.5 58.71 Favored 'General case' 0 N--CA 1.533 3.699 0 N-CA-C 106.684 -1.598 . . . . 0.0 106.684 174.181 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.414 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -69.8 -70.91 1.08 Allowed Glycine 0 N--CA 1.503 3.164 0 C-N-CA 125.39 1.471 . . . . 0.0 111.492 177.615 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.5 m -71.83 -27.13 62.7 Favored 'General case' 0 N--CA 1.532 3.635 0 CA-C-O 118.008 -0.996 . . . . 0.0 113.009 -176.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 39.6 mtt180 -74.31 -45.46 47.27 Favored 'General case' 0 N--CA 1.524 3.251 0 CA-C-N 120.12 1.327 . . . . 0.0 108.195 178.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 30.9 t -64.89 -18.12 23.03 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.002 0 O-C-N 120.636 -1.29 . . . . 0.0 109.164 174.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.31 -50.73 20.55 Favored 'General case' 0 N--CA 1.531 3.602 0 CA-C-N 119.734 1.152 . . . . 0.0 111.571 177.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.75 -22.57 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.823 0 CA-C-N 120.779 1.627 . . . . 0.0 111.826 -178.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -87.54 -51.49 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.986 0 CA-C-N 120.257 1.389 . . . . 0.0 107.688 -179.014 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -61.13 -22.03 64.3 Favored 'General case' 0 N--CA 1.531 3.594 0 CA-C-O 118.782 -0.627 . . . . 0.0 110.576 177.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -95.27 -24.05 16.95 Favored 'General case' 0 N--CA 1.52 3.046 0 CA-C-O 118.089 -0.958 . . . . 0.0 110.8 178.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.3 tp -77.01 -57.29 3.93 Favored 'General case' 0 N--CA 1.535 3.787 0 CA-C-N 119.662 1.119 . . . . 0.0 108.484 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 42.5 mt -45.97 -29.82 1.58 Allowed 'General case' 1 N--CA 1.544 4.262 0 C-N-CA 124.775 1.23 . . . . 0.0 112.858 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.89 -53.23 5.23 Favored 'General case' 0 N--CA 1.519 3.02 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.11 80.29 0.82 Allowed Glycine 0 N--CA 1.512 3.704 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 179.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -138.41 -59.4 0.63 Allowed 'General case' 0 N--CA 1.526 3.327 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 87.7 mtp -149.51 76.13 1.3 Allowed 'General case' 0 N--CA 1.525 3.304 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 5.6 t -142.02 3.64 1.61 Allowed 'General case' 0 N--CA 1.524 3.271 0 N-CA-C 114.245 1.202 . . . . 0.0 114.245 -176.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -116.21 -55.29 2.41 Favored 'General case' 0 N--CA 1.526 3.333 0 CA-C-N 120.018 1.281 . . . . 0.0 112.124 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -110.63 -57.23 2.25 Favored 'General case' 0 N--CA 1.527 3.424 0 C-N-CA 123.198 0.599 . . . . 0.0 111.233 -176.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -74.11 -4.85 38.16 Favored 'General case' 0 N--CA 1.518 2.968 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 60.8 tp -76.71 -48.32 19.19 Favored 'General case' 0 N--CA 1.525 3.293 0 CA-C-N 119.91 1.232 . . . . 0.0 111.446 -178.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -35.65 -40.48 0.17 Allowed 'General case' 1 N--CA 1.541 4.102 0 N-CA-C 115.514 1.672 . . . . 0.0 115.514 -175.903 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -78.03 -40.31 39.24 Favored 'General case' 0 N--CA 1.529 3.524 0 CA-C-N 118.126 0.421 . . . . 0.0 110.811 -178.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -51.97 -35.19 45.44 Favored 'General case' 0 N--CA 1.531 3.576 0 C-N-CA 124.174 0.99 . . . . 0.0 113.149 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.3 pp -132.98 -44.94 0.86 Allowed 'General case' 0 N--CA 1.533 3.712 0 CA-C-N 118.76 0.709 . . . . 0.0 111.588 -179.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 104.93 73.96 0.93 Allowed Glycine 1 N--CA 1.528 4.803 0 CA-C-N 118.975 0.807 . . . . 0.0 112.099 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.08 -12.01 6.41 Favored 'General case' 0 N--CA 1.531 3.621 0 CA-C-N 117.886 0.843 . . . . 0.0 112.831 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 86.59 167.12 43.29 Favored Glycine 1 N--CA 1.532 5.09 0 CA-C-N 119.634 1.106 . . . . 0.0 111.128 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -87.05 -20.81 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.337 0 CA-C-N 119.483 1.641 . . . . 0.0 109.107 179.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.05 -30.87 71.06 Favored 'General case' 0 N--CA 1.525 3.317 0 CA-C-N 120.145 1.338 . . . . 0.0 111.995 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.5 p -83.53 -43.17 16.03 Favored 'General case' 1 N--CA 1.55 4.534 0 CA-C-N 120.249 1.386 . . . . 0.0 111.16 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 14.9 pt -70.8 -18.56 20.99 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.031 0 CA-C-O 117.958 -1.02 . . . . 0.0 112.98 -177.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 59.1 p -109.68 -31.91 7.29 Favored 'General case' 0 N--CA 1.516 2.871 0 CA-C-N 119.656 1.116 . . . . 0.0 110.688 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.2 ptt180 -73.22 -25.55 60.79 Favored 'General case' 0 N--CA 1.535 3.821 0 CA-C-N 119.475 1.034 . . . . 0.0 108.435 175.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -62.79 -31.35 79.97 Favored Glycine 1 N--CA 1.522 4.413 0 N-CA-C 108.991 -1.644 . . . . 0.0 108.991 175.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 18.3 m -63.1 -41.54 99.4 Favored 'General case' 0 N--CA 1.538 3.943 0 CA-C-N 118.004 0.902 . . . . 0.0 109.335 176.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -55.25 -28.01 50.41 Favored 'General case' 1 N--CA 1.547 4.423 0 C-N-CA 123.941 0.896 . . . . 0.0 111.942 178.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.4 m -65.81 -40.42 91.86 Favored 'General case' 0 N--CA 1.534 3.739 0 C-N-CA 123.193 0.597 . . . . 0.0 111.049 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.7 mt -58.92 -41.48 87.39 Favored 'General case' 0 N--CA 1.534 3.74 0 C-N-CA 124.291 1.036 . . . . 0.0 111.021 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.49 -21.02 65.18 Favored 'General case' 1 N--CA 1.54 4.025 0 CA-C-O 118.458 -0.782 . . . . 0.0 112.61 -179.636 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.59 -42.41 11.42 Favored 'General case' 0 N--CA 1.517 2.896 0 CA-C-N 118.915 0.78 . . . . 0.0 111.367 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.54 158.19 8.58 Favored Pre-proline 1 N--CA 1.542 4.165 0 CA-C-O 118.308 -0.853 . . . . 0.0 112.857 -179.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -84.66 170.2 10.33 Favored 'Trans proline' 0 C--N 1.377 2.048 0 C-N-CA 122.215 1.944 . . . . 0.0 110.401 178.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.405 ' HA ' ' HB3' ' A' ' 97' ' ' ARG . 2.9 t -90.83 -25.36 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.074 0 CA-C-O 117.912 -1.042 . . . . 0.0 111.543 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -61.91 -43.85 98.0 Favored 'General case' 0 N--CA 1.516 2.851 0 CA-C-N 119.966 1.257 . . . . 0.0 110.135 -179.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.3 mp -99.07 -16.09 18.78 Favored 'General case' 0 N--CA 1.511 2.588 0 C-N-CA 123.344 0.658 . . . . 0.0 111.704 178.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.405 ' HB3' ' HA ' ' A' ' 94' ' ' VAL . 0.2 OUTLIER -68.12 -26.25 65.71 Favored 'General case' 1 N--CA 1.541 4.084 0 N-CA-C 103.809 -2.663 . . . . 0.0 103.809 169.174 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -57.5 -40.1 77.92 Favored 'General case' 0 N--CA 1.516 2.874 0 C-N-CA 123.688 0.795 . . . . 0.0 109.519 174.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.412 ' HA ' ' HB2' ' A' ' 102' ' ' GLU . 57.2 t90 -63.93 -34.98 79.2 Favored 'General case' 0 N--CA 1.527 3.419 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 177.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.57 -38.73 60.52 Favored 'General case' 0 N--CA 1.536 3.835 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 176.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -67.61 -38.61 84.19 Favored 'General case' 1 N--CA 1.545 4.286 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 175.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.412 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 1.0 OUTLIER -59.31 -22.7 61.63 Favored 'General case' 1 N--CA 1.549 4.475 0 C-N-CA 123.633 0.773 . . . . 0.0 110.391 175.732 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -122.58 5.25 5.64 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.259 0 C-N-CA 123.468 0.707 . . . . 0.0 112.682 -177.336 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.85 -55.89 2.34 Favored 'General case' 0 N--CA 1.516 2.863 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 175.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 5.4 tt . . . . . 0 N--CA 1.534 3.762 0 C-N-CA 125.181 1.392 . . . . 0.0 110.802 178.629 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 . . . . . 0 N--CA 1.532 3.633 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 519' ' ' TRP . . . . . 0.426 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 76.2 t-105 -36.74 -29.32 0.02 OUTLIER 'General case' 1 N--CA 1.548 4.468 0 N-CA-C 116.131 1.9 . . . . 0.0 116.131 -174.72 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 520' ' ' LEU . . . . . 0.419 ' CD2' ' N ' ' B' ' 520' ' ' LEU . 2.1 mm? -98.6 -31.0 12.17 Favored 'General case' 0 N--CA 1.537 3.915 0 CA-C-O 117.98 -1.009 . . . . 0.0 113.497 -172.543 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 -62.72 -25.59 68.26 Favored 'General case' 1 N--CA 1.544 4.231 0 N-CA-C 105.639 -1.986 . . . . 0.0 105.639 171.429 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . 0.474 ' CD2' ' HG ' ' A' ' 51' ' ' LEU . 1.9 m-85 -75.29 -43.19 52.49 Favored 'General case' 0 N--CA 1.511 2.618 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 173.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 74.4 t -63.6 -18.56 22.37 Favored 'Isoleucine or valine' 1 N--CA 1.563 5.224 0 CA-C-O 117.999 -1.0 . . . . 0.0 111.334 177.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -74.66 -52.7 10.96 Favored 'General case' 0 N--CA 1.531 3.621 0 CA-C-N 119.996 1.271 . . . . 0.0 107.82 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 4.8 mp -63.33 -26.18 68.64 Favored 'General case' 0 N--CA 1.537 3.893 0 CA-C-O 119.134 -0.46 . . . . 0.0 110.165 175.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -67.52 -39.34 85.11 Favored 'General case' 0 N--CA 1.519 2.991 0 CA-C-O 118.206 -0.902 . . . . 0.0 108.602 178.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 13.7 mttt -69.17 -19.8 64.0 Favored 'General case' 0 N--CA 1.525 3.31 0 CA-C-O 118.078 -0.963 . . . . 0.0 111.262 177.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -75.25 -37.35 61.06 Favored 'General case' 0 N--CA 1.529 3.524 0 CA-C-N 119.629 1.104 . . . . 0.0 109.056 176.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 529' ' ' ALA . . . . . . . . . . . . . . . -92.81 -8.63 43.06 Favored 'General case' 0 N--CA 1.504 2.238 0 CA-C-O 118.537 -0.744 . . . . 0.0 110.475 178.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -81.53 -29.1 33.64 Favored 'General case' 0 N--CA 1.532 3.673 0 CA-C-N 119.953 1.252 . . . . 0.0 109.272 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -68.69 -43.35 76.26 Favored 'General case' 0 N--CA 1.531 3.613 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 176.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 41.5 m-80 -90.54 -91.85 0.14 Allowed 'General case' 0 N--CA 1.516 2.853 0 N-CA-C 106.625 -1.62 . . . . 0.0 106.625 176.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 3.0 p30 155.1 54.47 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.868 0 C-N-CA 127.474 2.31 . . . . 0.0 107.397 177.25 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 7.4 mt -114.64 11.6 16.99 Favored 'General case' 0 N--CA 1.53 3.531 0 C-N-CA 124.029 0.932 . . . . 0.0 111.197 -177.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 535' ' ' HIS . . . . . . . . . . . . . 42.2 p-80 -81.15 0.27 37.07 Favored 'General case' 0 N--CA 1.515 2.805 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 175.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 536' ' ' LEU . . . . . 0.408 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 35.4 mt -93.92 -51.52 0.26 Allowed Pre-proline 0 N--CA 1.506 2.37 0 CA-C-O 116.381 -1.771 . . . . 0.0 109.175 -176.166 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 537' ' ' PRO . . . . . 0.408 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 2.7 Cg_exo -64.28 -33.93 57.59 Favored 'Trans proline' 0 C--N 1.395 3.009 0 N-CA-C 107.104 -1.922 . . . . 0.0 107.104 171.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -61.94 -41.99 98.59 Favored 'General case' 0 N--CA 1.529 3.487 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 175.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 13.7 mt -70.86 -22.43 62.3 Favored 'General case' 0 N--CA 1.537 3.909 0 CA-C-O 118.419 -0.8 . . . . 0.0 111.084 177.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -76.29 -8.52 57.26 Favored 'General case' 0 N--CA 1.526 3.375 0 CA-C-N 118.934 0.788 . . . . 0.0 110.228 176.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -106.12 -46.85 3.97 Favored 'General case' 0 N--CA 1.511 2.595 0 C-N-CA 124.247 1.019 . . . . 0.0 110.238 -178.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 8.2 ptt? -94.41 -21.7 18.77 Favored 'General case' 0 N--CA 1.536 3.854 0 CA-C-O 116.85 -1.548 . . . . 0.0 114.966 -175.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 3.1 mp -119.09 -106.97 0.38 Allowed 'General case' 0 N--CA 1.534 3.752 0 CA-C-N 121.464 1.938 . . . . 0.0 113.539 -176.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 7.6 p 179.13 165.78 0.69 Allowed Pre-proline 1 N--CA 1.56 5.05 0 CA-C-N 121.381 1.901 . . . . 0.0 110.788 -176.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -69.37 -33.98 16.88 Favored 'Trans proline' 0 CA--C 1.574 2.512 0 C-N-CA 122.427 2.085 . . . . 0.0 109.031 172.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -59.94 -18.86 48.36 Favored 'General case' 0 N--CA 1.533 3.718 0 CA-C-O 118.078 -0.963 . . . . 0.0 111.633 177.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -76.74 -44.86 31.47 Favored 'General case' 0 N--CA 1.525 3.315 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 177.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 548' ' ' ARG . . . . . 0.407 ' O ' HD11 ' B' ' 551' ' ' LEU . 31.0 ptt180 -81.4 -1.85 47.19 Favored 'General case' 0 N--CA 1.533 3.707 0 CA-C-N 118.627 0.649 . . . . 0.0 110.95 176.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -84.53 -47.53 10.5 Favored 'General case' 0 N--CA 1.524 3.275 0 N-CA-C 105.07 -2.196 . . . . 0.0 105.07 174.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -75.63 -17.14 60.1 Favored 'General case' 0 N--CA 1.509 2.499 0 CA-C-O 117.414 -1.279 . . . . 0.0 111.448 177.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 551' ' ' LEU . . . . . 0.428 ' HG ' ' CE3' ' A' ' 19' ' ' TRP . 0.0 OUTLIER -74.91 -39.71 61.28 Favored 'General case' 0 N--CA 1.53 3.557 0 N-CA-C 106.35 -1.722 . . . . 0.0 106.35 175.139 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -62.79 -58.71 10.99 Favored Glycine 0 N--CA 1.495 2.577 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 -177.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.8 m -71.73 -34.59 69.69 Favored 'General case' 0 N--CA 1.537 3.904 0 CA-C-O 118.168 -0.92 . . . . 0.0 112.604 -178.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -68.25 -58.15 4.87 Favored 'General case' 1 N--CA 1.541 4.082 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 178.344 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 47.8 t -58.09 -18.9 11.77 Favored 'Isoleucine or valine' 1 N--CA 1.549 4.48 0 CA-C-O 117.621 -1.18 . . . . 0.0 110.264 175.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 13.6 mtt-85 -84.88 -32.74 23.02 Favored 'General case' 0 N--CA 1.52 3.062 0 CA-C-O 117.077 -1.439 . . . . 0.0 111.729 178.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 557' ' ' ILE . . . . . 0.411 HD11 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -77.2 -20.92 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.182 0 CA-C-N 122.049 2.204 . . . . 0.0 109.728 177.722 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 558' ' ' VAL . . . . . 0.411 ' N ' HD11 ' B' ' 557' ' ' ILE . 0.0 OUTLIER -89.44 -50.33 13.26 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.911 0 N-CA-C 106.954 -1.499 . . . . 0.0 106.954 -179.205 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -60.69 -24.78 65.89 Favored 'General case' 0 N--CA 1.531 3.607 0 CA-C-O 119.004 -0.522 . . . . 0.0 109.822 177.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -96.97 -23.74 16.15 Favored 'General case' 0 N--CA 1.522 3.13 0 CA-C-O 117.831 -1.08 . . . . 0.0 111.306 178.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 27.6 tp -75.75 -51.92 11.6 Favored 'General case' 1 N--CA 1.542 4.129 0 CA-C-N 120.108 1.322 . . . . 0.0 108.306 179.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 40.5 mt -48.24 -27.55 2.53 Favored 'General case' 1 N--CA 1.543 4.195 0 C-N-CA 124.375 1.07 . . . . 0.0 112.3 179.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.69 -51.03 13.65 Favored 'General case' 0 N--CA 1.53 3.54 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 178.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 62.78 54.91 30.15 Favored Glycine 1 N--CA 1.521 4.324 0 C-N-CA 123.975 0.797 . . . . 0.0 114.228 175.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -115.73 -56.15 2.36 Favored 'General case' 0 N--CA 1.517 2.877 0 N-CA-C 106.657 -1.608 . . . . 0.0 106.657 177.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 52.1 ttp -139.64 76.06 1.54 Allowed 'General case' 0 N--CA 1.524 3.225 0 N-CA-C 104.271 -2.492 . . . . 0.0 104.271 177.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 29.6 m -135.53 -3.28 2.38 Favored 'General case' 0 N--CA 1.522 3.173 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -173.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -98.03 -84.66 0.38 Allowed 'General case' 0 N--CA 1.52 3.029 0 CA-C-N 119.809 1.186 . . . . 0.0 110.654 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 3.9 mtt-85 -75.67 -55.91 5.2 Favored 'General case' 0 N--CA 1.527 3.386 0 CA-C-N 119.857 1.208 . . . . 0.0 111.851 -178.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -70.98 -2.4 15.17 Favored 'General case' 0 N--CA 1.523 3.21 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -174.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 34.0 tp -85.41 -47.23 10.17 Favored 'General case' 0 N--CA 1.533 3.699 0 CA-C-N 120.664 1.575 . . . . 0.0 111.773 -178.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.79 -35.88 0.55 Allowed 'General case' 1 N--CA 1.557 4.888 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -179.444 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -71.49 -39.16 71.03 Favored 'General case' 0 N--CA 1.536 3.874 0 CA-C-N 118.806 0.73 . . . . 0.0 111.02 -178.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -53.91 -59.99 3.91 Favored 'General case' 0 N--CA 1.53 3.531 0 C-N-CA 123.976 0.911 . . . . 0.0 111.743 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 5.5 mp -93.81 -64.64 1.06 Allowed 'General case' 0 N--CA 1.519 3.018 0 C-N-CA 123.224 0.61 . . . . 0.0 110.012 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 124.78 46.54 0.24 Allowed Glycine 1 N--CA 1.518 4.158 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -178.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -119.32 115.73 24.76 Favored 'General case' 0 N--CA 1.517 2.876 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -39.45 171.48 0.01 OUTLIER Glycine 1 N--CA 1.541 5.674 0 C-N-CA 125.493 1.52 . . . . 0.0 116.168 -177.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -80.24 -16.37 12.8 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.386 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -68.85 -39.45 79.9 Favored 'General case' 0 N--CA 1.527 3.379 0 CA-C-N 119.502 1.046 . . . . 0.0 109.967 176.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.5 p -77.76 -38.79 46.11 Favored 'General case' 0 N--CA 1.535 3.776 0 CA-C-N 118.888 0.767 . . . . 0.0 111.502 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 2.1 tt -67.27 -35.34 73.63 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.185 0 CA-C-O 118.849 -0.596 . . . . 0.0 112.411 -175.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 82.0 p -102.27 -25.1 13.8 Favored 'General case' 0 N--CA 1.515 2.78 0 CA-C-O 117.904 -1.046 . . . . 0.0 111.573 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -73.12 -24.86 60.66 Favored 'General case' 0 N--CA 1.538 3.953 0 CA-C-N 119.981 1.264 . . . . 0.0 108.544 174.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -62.71 -36.1 92.82 Favored Glycine 1 N--CA 1.521 4.35 0 N-CA-C 107.325 -2.31 . . . . 0.0 107.325 173.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 1.7 m -60.65 -39.74 89.41 Favored 'General case' 1 N--CA 1.541 4.106 0 C-N-CA 123.94 0.896 . . . . 0.0 110.32 176.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -59.7 -32.65 70.71 Favored 'General case' 1 N--CA 1.548 4.445 0 C-N-CA 123.539 0.736 . . . . 0.0 111.683 -179.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 4.8 m -65.29 -37.62 87.73 Favored 'General case' 0 N--CA 1.535 3.817 0 C-N-CA 123.039 0.536 . . . . 0.0 110.867 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 29.8 mt -58.31 -45.23 88.4 Favored 'General case' 0 N--CA 1.529 3.52 0 C-N-CA 124.094 0.958 . . . . 0.0 111.519 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -14.82 63.27 Favored 'General case' 0 N--CA 1.538 3.934 0 CA-C-O 118.04 -0.981 . . . . 0.0 112.926 -178.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -88.52 -43.55 11.33 Favored 'General case' 0 N--CA 1.521 3.11 0 CA-C-N 119.534 1.061 . . . . 0.0 110.849 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -57.12 163.83 2.85 Favored Pre-proline 1 N--CA 1.542 4.161 0 C-N-CA 123.647 0.779 . . . . 0.0 112.934 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -80.51 173.32 12.45 Favored 'Trans proline' 0 C--N 1.381 2.26 0 C-N-CA 121.777 1.651 . . . . 0.0 110.54 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -94.73 -25.89 4.53 Favored 'Isoleucine or valine' 0 N--CA 1.522 3.173 0 CA-C-O 117.875 -1.059 . . . . 0.0 111.579 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -62.83 -41.16 99.22 Favored 'General case' 0 N--CA 1.517 2.893 0 CA-C-N 120.02 1.282 . . . . 0.0 110.246 -179.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 7.0 mp -98.45 -15.37 19.65 Favored 'General case' 0 N--CA 1.512 2.639 0 CA-C-O 118.687 -0.673 . . . . 0.0 111.878 178.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.18 -34.37 78.22 Favored 'General case' 1 N--CA 1.544 4.231 0 N-CA-C 103.338 -2.838 . . . . 0.0 103.338 168.632 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -52.76 -40.47 63.16 Favored 'General case' 0 N--CA 1.516 2.872 0 C-N-CA 124.328 1.051 . . . . 0.0 111.001 174.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 599' ' ' TRP . . . . . 0.416 ' HA ' ' HB2' ' B' ' 602' ' ' GLU . 52.3 t90 -64.68 -37.38 87.38 Favored 'General case' 0 N--CA 1.532 3.64 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 177.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -51.71 -36.86 48.45 Favored 'General case' 1 N--CA 1.541 4.106 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 176.554 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -70.51 -39.55 74.03 Favored 'General case' 0 N--CA 1.537 3.88 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 175.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 602' ' ' GLU . . . . . 0.416 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.9 OUTLIER -57.43 -24.35 55.08 Favored 'General case' 1 N--CA 1.546 4.372 0 C-N-CA 124.045 0.938 . . . . 0.0 111.505 176.41 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -107.22 -6.3 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.358 0 CA-C-O 117.862 -1.066 . . . . 0.0 113.526 -175.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 6.7 mp -104.88 -61.12 1.51 Allowed 'General case' 0 N--CA 1.525 3.307 0 N-CA-C 106.314 -1.736 . . . . 0.0 106.314 174.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 5.4 tp . . . . . 0 N--CA 1.535 3.81 0 C-N-CA 125.507 1.523 . . . . 0.0 113.55 -179.388 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 . . . . . 0 N--CA 1.523 3.181 0 N-CA-C 105.441 -2.059 . . . . 0.0 105.441 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 75.1 t-105 -59.99 -20.09 55.82 Favored 'General case' 0 N--CA 1.537 3.909 0 CA-C-O 117.824 -1.084 . . . . 0.0 110.973 174.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -92.25 -31.42 15.42 Favored 'General case' 0 N--CA 1.52 3.039 0 C-N-CA 124.114 0.966 . . . . 0.0 110.765 -177.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.7 mtt180 -60.83 -27.48 68.11 Favored 'General case' 0 N--CA 1.534 3.743 0 N-CA-C 106.395 -1.706 . . . . 0.0 106.395 172.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -88.53 -31.55 18.63 Favored 'General case' 0 CA--C 1.595 2.695 0 CA-C-O 116.645 -1.645 . . . . 0.0 109.332 175.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 93.3 t -74.54 -62.38 1.34 Allowed 'Isoleucine or valine' 1 N--CA 1.565 5.285 0 CA-C-N 122.215 2.28 . . . . 0.0 110.425 -178.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -52.91 -36.18 59.16 Favored 'General case' 1 N--CA 1.548 4.452 0 CA-C-N 119.106 0.866 . . . . 0.0 111.62 -178.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.94 -35.32 66.96 Favored 'General case' 0 N--CA 1.533 3.699 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 177.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.03 -40.84 95.12 Favored 'General case' 0 N--CA 1.529 3.477 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 176.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -56.47 -30.46 62.96 Favored 'General case' 0 N--CA 1.531 3.609 0 C-N-CA 123.216 0.606 . . . . 0.0 111.743 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -71.67 -42.33 67.63 Favored 'General case' 0 N--CA 1.529 3.511 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.81 3.35 48.57 Favored 'General case' 0 N--CA 1.517 2.889 0 O-C-N 123.176 0.297 . . . . 0.0 110.295 177.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -87.54 -45.65 10.27 Favored 'General case' 0 N--CA 1.524 3.236 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -58.21 -39.72 79.74 Favored 'General case' 1 N--CA 1.541 4.088 0 C-N-CA 123.292 0.637 . . . . 0.0 109.3 178.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 65.5 m-80 -92.63 -83.21 0.31 Allowed 'General case' 0 N--CA 1.512 2.669 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 177.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 p30 145.51 44.16 0.0 OUTLIER 'General case' 1 N--CA 1.562 5.157 0 C-N-CA 128.444 2.698 . . . . 0.0 107.879 178.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.3 mt -98.22 12.02 35.96 Favored 'General case' 0 N--CA 1.53 3.541 0 O-C-N 121.368 -0.832 . . . . 0.0 110.693 -179.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.467 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 1.0 OUTLIER -89.86 16.39 8.21 Favored 'General case' 0 N--CA 1.515 2.799 0 C-N-CA 123.984 0.913 . . . . 0.0 109.071 174.894 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.585 ' HA ' HD22 ' A' ' 39' ' ' LEU . 23.6 mt -98.96 -51.93 0.2 Allowed Pre-proline 0 N--CA 1.503 2.198 0 C-N-CA 125.335 1.454 . . . . 0.0 107.581 -178.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.446 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 6.1 Cg_exo -70.03 -33.43 15.57 Favored 'Trans proline' 0 C--N 1.393 2.869 0 N-CA-C 107.098 -1.924 . . . . 0.0 107.098 170.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.467 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.1 OUTLIER -65.79 -42.08 91.2 Favored 'General case' 0 N--CA 1.517 2.903 0 CA-C-O 117.93 -1.033 . . . . 0.0 108.495 177.357 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.585 HD22 ' HA ' ' A' ' 36' ' ' LEU 0.268 0.1 OUTLIER -77.42 -11.08 59.8 Favored 'General case' 1 N--CA 1.552 4.649 0 CA-C-N 120.316 1.416 . . . . 0.0 110.934 176.628 . . . . . . . . 5 4 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -91.59 9.77 30.79 Favored 'General case' 0 N--CA 1.524 3.228 0 CA-C-N 119.057 0.844 . . . . 0.0 110.038 176.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.57 -50.08 1.63 Allowed 'General case' 0 N--CA 1.522 3.166 0 CA-C-N 119.407 1.003 . . . . 0.0 109.686 -178.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 7.9 ptp -93.95 -14.0 26.44 Favored 'General case' 1 N--CA 1.543 4.222 0 CA-C-O 118.273 -0.87 . . . . 0.0 113.298 -177.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.6 mp -110.88 -83.38 0.57 Allowed 'General case' 0 N--CA 1.502 2.167 0 CA-C-O 117.934 -1.031 . . . . 0.0 110.911 -177.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 150.52 166.09 0.0 OUTLIER Pre-proline 1 N--CA 1.564 5.233 0 C-N-CA 126.144 1.778 . . . . 0.0 109.1 -178.445 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -68.86 -33.86 19.35 Favored 'Trans proline' 0 CA--C 1.574 2.515 0 C-N-CA 122.304 2.003 . . . . 0.0 108.399 173.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -62.66 -19.69 64.08 Favored 'General case' 0 N--CA 1.529 3.476 0 CA-C-O 118.058 -0.972 . . . . 0.0 111.15 177.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -73.2 -32.6 64.9 Favored 'General case' 0 N--CA 1.523 3.203 0 CA-C-O 117.684 -1.15 . . . . 0.0 109.969 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.8 ptt180 -89.5 -14.27 35.62 Favored 'General case' 0 N--CA 1.538 3.956 0 CA-C-N 119.689 1.131 . . . . 0.0 108.779 173.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -79.52 -19.35 49.81 Favored 'General case' 0 N--CA 1.516 2.847 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 172.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -95.46 -38.06 10.63 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 123.932 0.893 . . . . 0.0 109.467 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.461 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 23.3 tp -75.26 -21.77 58.31 Favored 'General case' 0 N--CA 1.534 3.753 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 173.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.407 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -69.08 -71.34 0.99 Allowed Glycine 0 N--CA 1.497 2.704 0 C-N-CA 125.104 1.335 . . . . 0.0 110.553 176.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.6 m -70.33 -28.44 65.16 Favored 'General case' 0 N--CA 1.537 3.893 0 CA-C-O 117.842 -1.075 . . . . 0.0 112.991 -177.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -69.47 -51.7 33.57 Favored 'General case' 0 N--CA 1.534 3.751 0 CA-C-N 120.007 1.276 . . . . 0.0 107.848 178.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 33.2 t -61.78 -19.31 21.0 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.241 0 CA-C-O 117.683 -1.151 . . . . 0.0 109.793 175.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.5 mtp180 -77.39 -43.94 30.97 Favored 'General case' 0 N--CA 1.526 3.355 0 CA-C-N 120.371 1.441 . . . . 0.0 112.299 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.03 -21.69 19.33 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.75 0 CA-C-N 121.719 2.054 . . . . 0.0 111.011 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -89.15 -52.18 11.25 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.024 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 -178.855 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -59.61 -23.06 62.66 Favored 'General case' 0 N--CA 1.529 3.509 0 CA-C-O 119.087 -0.482 . . . . 0.0 109.984 177.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -96.34 -22.52 17.14 Favored 'General case' 0 N--CA 1.526 3.357 0 CA-C-O 117.861 -1.066 . . . . 0.0 110.97 177.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.3 mt -75.3 -54.66 6.7 Favored 'General case' 1 N--CA 1.544 4.235 0 CA-C-N 119.999 1.272 . . . . 0.0 107.903 178.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.3 -36.34 4.02 Favored 'General case' 1 N--CA 1.545 4.278 0 C-N-CA 125.346 1.458 . . . . 0.0 112.003 179.727 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.9 mmm180 -81.85 -52.6 6.93 Favored 'General case' 0 N--CA 1.527 3.397 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.06 59.73 3.31 Favored Glycine 1 N--CA 1.517 4.081 0 CA-C-O 119.349 -0.695 . . . . 0.0 111.795 178.098 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -116.05 -54.52 2.48 Favored 'General case' 0 N--CA 1.524 3.234 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 178.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 10.7 ptp -149.39 77.64 1.35 Allowed 'General case' 0 N--CA 1.526 3.351 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 178.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 5.6 t -128.97 -8.54 4.9 Favored 'General case' 0 N--CA 1.528 3.429 0 N-CA-C 114.066 1.136 . . . . 0.0 114.066 -176.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -114.97 -59.24 2.04 Favored 'General case' 0 N--CA 1.528 3.468 0 CA-C-N 120.056 1.298 . . . . 0.0 111.955 -178.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 3.2 mmt-85 -94.68 -55.12 3.24 Favored 'General case' 0 N--CA 1.528 3.432 0 CA-C-N 118.093 0.406 . . . . 0.0 111.46 -177.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -76.87 -9.3 58.59 Favored 'General case' 0 N--CA 1.524 3.273 0 N-CA-C 114.05 1.129 . . . . 0.0 114.05 -177.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 36.4 tp -77.66 -49.65 14.08 Favored 'General case' 0 N--CA 1.526 3.37 0 CA-C-N 119.973 1.26 . . . . 0.0 112.299 -177.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.45 -34.07 15.75 Favored 'General case' 0 N--CA 1.534 3.747 0 N-CA-C 114.306 1.225 . . . . 0.0 114.306 -176.135 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -68.34 -33.54 74.47 Favored 'General case' 0 N--CA 1.535 3.805 0 CA-C-O 119.051 -0.5 . . . . 0.0 111.709 -178.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -52.54 -46.42 66.76 Favored 'General case' 0 N--CA 1.531 3.611 0 C-N-CA 124.275 1.03 . . . . 0.0 112.584 -178.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -138.16 -40.56 0.53 Allowed 'General case' 0 N--CA 1.527 3.388 0 CA-C-O 118.63 -0.7 . . . . 0.0 111.852 -179.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 107.87 79.21 1.16 Allowed Glycine 1 N--CA 1.524 4.517 0 CA-C-N 119.185 0.902 . . . . 0.0 111.712 178.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -112.47 -9.78 13.78 Favored 'General case' 0 N--CA 1.526 3.367 0 C-N-CA 123.626 0.77 . . . . 0.0 111.269 177.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 87.81 162.88 38.47 Favored Glycine 0 N--CA 1.513 3.78 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 -178.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -85.33 -23.31 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.522 3.17 0 CA-C-N 118.825 1.313 . . . . 0.0 108.387 178.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.32 -29.21 70.29 Favored 'General case' 0 N--CA 1.515 2.776 0 CA-C-O 116.921 -1.514 . . . . 0.0 111.509 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.8 p -83.08 -46.91 12.25 Favored 'General case' 1 N--CA 1.545 4.296 0 CA-C-N 120.809 1.64 . . . . 0.0 110.545 178.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 15.9 pt -68.36 -16.3 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.99 0 CA-C-O 117.879 -1.058 . . . . 0.0 113.114 -177.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 62.7 p -111.19 -29.88 7.67 Favored 'General case' 0 N--CA 1.516 2.861 0 CA-C-N 120.022 1.283 . . . . 0.0 110.721 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -74.96 -21.76 58.97 Favored 'General case' 0 N--CA 1.53 3.564 0 CA-C-N 119.528 1.058 . . . . 0.0 108.309 174.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.07 -29.65 74.81 Favored Glycine 0 N--CA 1.516 3.983 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 176.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.2 t -64.37 -39.55 94.1 Favored 'General case' 0 N--CA 1.539 3.978 0 CA-C-N 118.402 1.101 . . . . 0.0 109.326 176.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -62.04 -19.1 62.52 Favored 'General case' 1 N--CA 1.543 4.187 0 CA-C-O 118.41 -0.805 . . . . 0.0 112.367 179.075 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 14.3 m -72.04 -39.93 68.74 Favored 'General case' 0 N--CA 1.535 3.79 0 CA-C-N 119.297 0.953 . . . . 0.0 110.288 179.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 54.9 mt -56.47 -49.28 75.12 Favored 'General case' 0 N--CA 1.525 3.285 0 C-N-CA 124.324 1.05 . . . . 0.0 112.525 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.66 -11.94 59.36 Favored 'General case' 1 N--CA 1.54 4.071 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -179.421 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.03 -44.72 12.79 Favored 'General case' 0 N--CA 1.519 2.997 0 CA-C-N 119.537 1.062 . . . . 0.0 110.974 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.39 161.98 5.01 Favored Pre-proline 1 N--CA 1.546 4.344 0 CA-C-O 118.249 -0.882 . . . . 0.0 112.663 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -78.22 174.61 12.19 Favored 'Trans proline' 0 C--N 1.38 2.21 0 C-N-CA 121.758 1.639 . . . . 0.0 110.43 178.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -94.56 -28.08 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.077 0 CA-C-O 117.302 -1.332 . . . . 0.0 111.721 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -64.24 -39.6 94.29 Favored 'General case' 0 N--CA 1.517 2.903 0 CA-C-N 120.37 1.441 . . . . 0.0 110.904 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.2 mp -98.9 -17.55 18.32 Favored 'General case' 0 N--CA 1.513 2.721 0 C-N-CA 123.291 0.636 . . . . 0.0 111.751 178.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.35 -32.85 74.71 Favored 'General case' 1 N--CA 1.545 4.3 0 N-CA-C 103.047 -2.946 . . . . 0.0 103.047 168.459 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -55.18 -40.28 70.53 Favored 'General case' 0 N--CA 1.515 2.808 0 C-N-CA 124.371 1.068 . . . . 0.0 110.686 174.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.416 ' HA ' ' HB2' ' A' ' 102' ' ' GLU . 54.4 t90 -62.65 -35.49 79.79 Favored 'General case' 0 N--CA 1.536 3.855 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 177.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -52.25 -39.1 59.91 Favored 'General case' 1 N--CA 1.542 4.147 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 175.905 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -68.83 -37.25 79.04 Favored 'General case' 1 N--CA 1.542 4.129 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 175.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.416 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 1.2 mm-40 -60.79 -23.39 64.99 Favored 'General case' 1 N--CA 1.546 4.362 0 C-N-CA 123.542 0.737 . . . . 0.0 110.609 175.965 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -115.49 -3.19 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.179 0 CA-C-O 118.375 -0.821 . . . . 0.0 111.921 -177.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.25 -56.24 2.53 Favored 'General case' 0 N--CA 1.516 2.842 0 N-CA-C 106.121 -1.807 . . . . 0.0 106.121 175.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.2 tt . . . . . 0 N--CA 1.535 3.777 0 C-N-CA 124.95 1.3 . . . . 0.0 110.014 178.423 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 . . . . . 0 N--CA 1.524 3.228 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.019 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 519' ' ' TRP . . . . . 0.456 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 73.6 t-105 -44.65 -27.27 0.46 Allowed 'General case' 1 N--CA 1.55 4.57 0 CA-C-N 119.961 1.255 . . . . 0.0 113.291 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 520' ' ' LEU . . . . . 0.408 ' CD2' ' N ' ' B' ' 520' ' ' LEU . 2.2 mm? -99.3 -28.08 13.48 Favored 'General case' 0 N--CA 1.529 3.491 0 CA-C-O 117.645 -1.169 . . . . 0.0 113.273 -173.339 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 18.8 ttm180 -61.33 -26.11 67.59 Favored 'General case' 1 N--CA 1.544 4.228 0 N-CA-C 105.38 -2.081 . . . . 0.0 105.38 171.278 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . 0.461 ' CD2' ' HG ' ' A' ' 51' ' ' LEU . 1.8 m-85 -77.05 -43.8 33.16 Favored 'General case' 0 N--CA 1.507 2.423 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 174.311 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 99.2 t -71.57 -17.45 19.56 Favored 'Isoleucine or valine' 1 N--CA 1.571 5.604 0 CA-C-O 117.755 -1.116 . . . . 0.0 113.203 -178.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -79.34 -48.64 13.72 Favored 'General case' 0 N--CA 1.534 3.772 0 CA-C-N 120.631 1.56 . . . . 0.0 108.45 -178.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 5.1 mp -76.95 -18.77 58.04 Favored 'General case' 0 N--CA 1.525 3.301 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 175.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 526' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' B' ' 522' ' ' PHE . 0.2 OUTLIER -69.43 -34.4 74.39 Favored 'General case' 0 N--CA 1.519 2.989 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 173.779 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 52.5 tttt -64.37 -27.7 69.19 Favored 'General case' 0 N--CA 1.519 3.003 0 CA-C-O 118.569 -0.729 . . . . 0.0 110.543 176.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -64.67 -41.62 95.96 Favored 'General case' 0 N--CA 1.536 3.873 0 CA-C-N 118.981 0.809 . . . . 0.0 109.492 177.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 529' ' ' ALA . . . . . 0.442 ' HB2' ' N ' ' B' ' 535' ' ' HIS . . . -83.33 -13.34 55.28 Favored 'General case' 0 N--CA 1.505 2.308 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.894 178.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -76.54 -31.79 57.82 Favored 'General case' 0 N--CA 1.539 3.991 0 CA-C-N 120.401 1.455 . . . . 0.0 109.62 179.393 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -64.79 -44.66 89.24 Favored 'General case' 0 N--CA 1.536 3.872 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 178.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -89.63 -90.01 0.15 Allowed 'General case' 0 N--CA 1.515 2.782 0 N-CA-C 105.779 -1.934 . . . . 0.0 105.779 176.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.3 p30 155.56 48.9 0.0 OUTLIER 'General case' 1 N--CA 1.559 4.979 0 C-N-CA 127.447 2.299 . . . . 0.0 108.021 176.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 9.4 mt -105.38 12.6 31.41 Favored 'General case' 0 N--CA 1.52 3.041 0 C-N-CA 124.531 1.132 . . . . 0.0 110.257 -178.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 535' ' ' HIS . . . . . 0.442 ' N ' ' HB2' ' B' ' 529' ' ' ALA . 30.9 p-80 -85.17 5.57 29.45 Favored 'General case' 0 N--CA 1.51 2.565 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 175.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 536' ' ' LEU . . . . . 0.439 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 31.3 mt -97.03 -51.33 0.22 Allowed Pre-proline 0 N--CA 1.501 2.11 0 CA-C-O 116.362 -1.78 . . . . 0.0 108.45 -175.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 537' ' ' PRO . . . . . 0.439 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 6.3 Cg_exo -68.44 -36.47 15.38 Favored 'Trans proline' 0 C--N 1.394 2.925 0 N-CA-C 106.999 -1.962 . . . . 0.0 106.999 171.397 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 538' ' ' LEU . . . . . 0.407 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 0.8 OUTLIER -59.87 -45.11 93.52 Favored 'General case' 0 N--CA 1.526 3.326 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 176.382 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 39.9 mt -73.43 -20.89 60.61 Favored 'General case' 0 N--CA 1.535 3.802 0 CA-C-O 118.224 -0.893 . . . . 0.0 111.456 179.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -74.2 -23.33 59.18 Favored 'General case' 0 N--CA 1.532 3.638 0 CA-C-N 119.772 1.169 . . . . 0.0 110.049 176.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -86.1 -51.83 6.07 Favored 'General case' 0 N--CA 1.514 2.757 0 C-N-CA 123.82 0.848 . . . . 0.0 109.649 -179.098 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 8.8 ptt? -99.49 17.17 21.01 Favored 'General case' 0 N--CA 1.53 3.531 0 CA-C-O 118.024 -0.989 . . . . 0.0 113.588 -177.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -134.34 -98.85 0.25 Allowed 'General case' 0 N--CA 1.535 3.798 0 CA-C-N 120.467 1.485 . . . . 0.0 113.31 178.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 158.17 175.11 0.02 OUTLIER Pre-proline 1 N--CA 1.586 6.331 0 CA-C-N 120.985 1.72 . . . . 0.0 109.511 -177.187 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -63.18 -23.81 72.85 Favored 'Trans proline' 0 N--CA 1.525 3.364 0 C-N-CA 122.135 1.89 . . . . 0.0 110.544 174.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -54.03 -22.45 10.69 Favored 'General case' 1 N--CA 1.55 4.53 0 C-N-CA 123.894 0.877 . . . . 0.0 110.751 176.067 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -45.71 -76.23 0.03 OUTLIER 'General case' 0 N--CA 1.519 3.001 0 C-N-CA 126.333 1.853 . . . . 0.0 112.19 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -93.77 -0.6 55.82 Favored 'General case' 0 N--CA 1.526 3.356 0 N-CA-C 113.634 0.975 . . . . 0.0 113.634 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -75.69 -52.46 10.44 Favored 'General case' 1 N--CA 1.544 4.243 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 173.259 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -73.88 -22.05 59.86 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 117.016 -1.469 . . . . 0.0 111.656 177.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 551' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.22 -40.24 62.56 Favored 'General case' 0 N--CA 1.533 3.701 0 CA-C-N 121.039 1.745 . . . . 0.0 107.67 176.242 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -63.46 -47.77 84.34 Favored Glycine 0 N--CA 1.507 3.378 0 N-CA-C 110.803 -0.919 . . . . 0.0 110.803 -177.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.2 m -79.52 -39.56 31.69 Favored 'General case' 0 N--CA 1.534 3.754 0 CA-C-N 118.244 1.022 . . . . 0.0 112.086 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.2 -49.05 71.22 Favored 'General case' 0 N--CA 1.539 3.994 0 CA-C-N 119.511 1.05 . . . . 0.0 108.982 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 46.2 t -67.74 -19.82 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.761 0 CA-C-O 117.484 -1.246 . . . . 0.0 109.697 177.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 34.1 mtt180 -82.97 -33.49 26.65 Favored 'General case' 0 N--CA 1.521 3.101 0 CA-C-O 116.413 -1.756 . . . . 0.0 112.574 178.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 557' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -78.19 -22.12 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.484 0 CA-C-N 122.984 2.629 . . . . 0.0 109.573 178.221 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 558' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -85.75 -52.97 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.738 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -60.87 -28.29 68.75 Favored 'General case' 0 N--CA 1.53 3.53 0 CA-C-O 118.653 -0.689 . . . . 0.0 110.659 178.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -86.52 -26.73 24.4 Favored 'General case' 0 N--CA 1.529 3.514 0 CA-C-N 118.667 0.667 . . . . 0.0 109.592 176.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 15.9 tp -65.69 -44.07 87.33 Favored 'General case' 1 N--CA 1.54 4.046 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 21.4 mt -59.65 -21.66 60.8 Favored 'General case' 0 N--CA 1.533 3.685 0 C-N-CA 123.752 0.821 . . . . 0.0 111.719 178.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 14.2 mmm180 -77.83 -53.44 7.49 Favored 'General case' 0 N--CA 1.524 3.235 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 69.04 77.1 0.42 Allowed Glycine 1 N--CA 1.523 4.458 0 CA-C-O 119.195 -0.781 . . . . 0.0 111.197 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -162.51 -52.69 0.04 OUTLIER 'General case' 0 N--CA 1.529 3.512 0 CA-C-N 117.834 0.817 . . . . 0.0 110.36 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 75.3 mtm -136.03 62.82 1.61 Allowed 'General case' 0 N--CA 1.521 3.108 0 N-CA-C 106.106 -1.813 . . . . 0.0 106.106 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 57.9 m -136.42 9.62 3.18 Favored 'General case' 0 N--CA 1.518 2.949 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.718 -176.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -112.15 -64.31 1.31 Allowed 'General case' 0 N--CA 1.517 2.907 0 CA-C-N 119.259 0.936 . . . . 0.0 110.404 -179.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -110.03 -43.53 3.96 Favored 'General case' 0 N--CA 1.519 3.01 0 C-N-CA 123.166 0.586 . . . . 0.0 110.271 -178.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -70.07 -13.12 62.06 Favored 'General case' 0 N--CA 1.514 2.767 0 CA-C-O 117.89 -1.052 . . . . 0.0 113.551 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 18.2 tp -82.4 -51.46 7.83 Favored 'General case' 0 N--CA 1.527 3.411 0 CA-C-N 120.245 1.384 . . . . 0.0 110.615 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -44.56 -30.51 0.91 Allowed 'General case' 1 N--CA 1.55 4.563 0 CA-C-N 119.125 0.875 . . . . 0.0 113.308 179.956 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -67.21 -43.59 81.71 Favored 'General case' 0 N--CA 1.535 3.806 0 C-N-CA 122.882 0.473 . . . . 0.0 110.795 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -47.68 -50.55 24.57 Favored 'General case' 0 N--CA 1.534 3.741 0 C-N-CA 124.734 1.214 . . . . 0.0 113.449 -178.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 2.0 pp -135.97 -43.86 0.65 Allowed 'General case' 0 N--CA 1.537 3.885 0 CA-C-O 118.938 -0.554 . . . . 0.0 111.604 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 113.85 82.37 1.1 Allowed Glycine 1 N--CA 1.523 4.479 0 N-CA-C 110.305 -1.118 . . . . 0.0 110.305 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -103.2 -43.04 5.57 Favored 'General case' 0 N--CA 1.526 3.352 0 C-N-CA 123.426 0.691 . . . . 0.0 109.594 178.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 108.61 157.94 18.99 Favored Glycine 0 N--CA 1.515 3.913 0 N-CA-C 109.734 -1.346 . . . . 0.0 109.734 -179.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -82.74 -15.82 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.898 0 CA-C-N 119.235 1.518 . . . . 0.0 108.265 177.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -69.4 -42.62 74.87 Favored 'General case' 0 N--CA 1.525 3.318 0 CA-C-N 120.047 1.294 . . . . 0.0 109.149 176.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.2 p -75.94 -38.68 57.35 Favored 'General case' 1 N--CA 1.542 4.142 0 CA-C-N 119.127 0.876 . . . . 0.0 112.365 179.31 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.66 -37.19 78.23 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.356 0 C-N-CA 123.347 0.659 . . . . 0.0 112.35 -175.112 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 75.6 p -101.07 -24.79 14.23 Favored 'General case' 0 N--CA 1.511 2.608 0 CA-C-O 117.897 -1.049 . . . . 0.0 111.685 -179.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 13.7 ptt180 -74.59 -23.69 58.78 Favored 'General case' 0 N--CA 1.526 3.365 0 CA-C-N 119.936 1.244 . . . . 0.0 109.004 175.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -63.02 -35.03 91.54 Favored Glycine 1 N--CA 1.528 4.781 0 N-CA-C 107.871 -2.092 . . . . 0.0 107.871 173.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 19.4 m -65.35 -34.52 78.52 Favored 'General case' 1 N--CA 1.541 4.104 0 C-N-CA 123.136 0.575 . . . . 0.0 110.403 176.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -62.85 -35.09 78.83 Favored 'General case' 1 N--CA 1.547 4.408 0 C-N-CA 123.354 0.662 . . . . 0.0 110.274 178.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.84 -35.26 76.1 Favored 'General case' 0 N--CA 1.534 3.758 0 C-N-CA 123.773 0.829 . . . . 0.0 111.133 179.337 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 24.1 mt -58.25 -42.47 86.46 Favored 'General case' 0 N--CA 1.531 3.575 0 C-N-CA 123.724 0.81 . . . . 0.0 110.731 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 3.1 mptt -60.29 -29.41 68.81 Favored 'General case' 1 N--CA 1.543 4.21 0 C-N-CA 123.205 0.602 . . . . 0.0 111.89 179.148 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -71.8 -40.88 68.87 Favored 'General case' 0 N--CA 1.517 2.884 0 CA-C-O 119.226 -0.416 . . . . 0.0 110.241 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -70.82 159.0 86.77 Favored Pre-proline 0 N--CA 1.527 3.41 0 CA-C-O 118.5 -0.762 . . . . 0.0 111.439 178.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -82.07 178.88 5.99 Favored 'Trans proline' 0 C--N 1.376 2.015 0 C-N-CA 122.013 1.809 . . . . 0.0 111.731 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.8 t -92.36 -26.97 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.906 0 CA-C-O 117.558 -1.211 . . . . 0.0 110.272 179.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -65.35 -38.14 89.18 Favored 'General case' 0 N--CA 1.515 2.819 0 CA-C-N 119.938 1.244 . . . . 0.0 110.195 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 6.8 mp -97.95 -20.92 17.14 Favored 'General case' 0 N--CA 1.513 2.676 0 C-N-CA 123.443 0.697 . . . . 0.0 110.973 178.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -27.42 66.83 Favored 'General case' 0 N--CA 1.536 3.854 0 N-CA-C 103.389 -2.819 . . . . 0.0 103.389 168.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.16 -39.88 79.98 Favored 'General case' 0 N--CA 1.523 3.224 0 C-N-CA 124.345 1.058 . . . . 0.0 109.742 173.401 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 599' ' ' TRP . . . . . 0.423 ' HA ' ' HB2' ' B' ' 602' ' ' GLU . 45.7 t90 -61.86 -35.72 79.14 Favored 'General case' 0 N--CA 1.526 3.374 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 178.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.81 -36.26 47.27 Favored 'General case' 1 N--CA 1.541 4.092 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 176.781 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -73.38 -37.28 66.07 Favored 'General case' 0 N--CA 1.533 3.716 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 175.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 602' ' ' GLU . . . . . 0.423 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.2 OUTLIER -59.65 -22.16 61.5 Favored 'General case' 1 N--CA 1.544 4.261 0 CA-C-O 118.675 -0.679 . . . . 0.0 110.912 175.513 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -112.93 3.15 8.32 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.763 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -176.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 75.6 mt -114.43 -60.26 1.91 Allowed 'General case' 0 N--CA 1.519 3.017 0 N-CA-C 106.395 -1.705 . . . . 0.0 106.395 175.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 4.1 mp . . . . . 0 N--CA 1.536 3.841 0 C-N-CA 124.467 1.107 . . . . 0.0 111.768 -179.504 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 . . . . . 0 N--CA 1.514 2.74 0 CA-C-O 118.205 -0.902 . . . . 0.0 109.265 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.431 ' HA ' HD21 ' B' ' 551' ' ' LEU . 72.6 t-105 -48.45 -38.49 19.96 Favored 'General case' 0 N--CA 1.534 3.728 0 CA-C-N 119.862 1.21 . . . . 0.0 112.148 179.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -87.37 -27.11 22.99 Favored 'General case' 0 N--CA 1.524 3.239 0 CA-C-O 117.369 -1.3 . . . . 0.0 112.891 -174.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.71 -28.4 68.63 Favored 'General case' 1 N--CA 1.54 4.059 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 173.272 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.484 ' CG ' HD22 ' B' ' 551' ' ' LEU . 0.1 OUTLIER -79.6 -39.44 31.65 Favored 'General case' 0 N--CA 1.5 2.046 0 CA-C-O 116.366 -1.778 . . . . 0.0 108.075 173.585 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 86.7 t -68.22 -21.28 26.45 Favored 'Isoleucine or valine' 1 N--CA 1.568 5.456 0 CA-C-N 121.138 1.79 . . . . 0.0 112.569 -177.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -78.19 -53.02 7.81 Favored 'General case' 0 N--CA 1.534 3.741 0 CA-C-N 120.112 1.324 . . . . 0.0 107.51 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.6 mp -70.03 -15.94 63.08 Favored 'General case' 0 N--CA 1.529 3.492 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 175.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -72.34 -37.8 68.77 Favored 'General case' 0 N--CA 1.513 2.694 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 176.305 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.59 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 11.0 tptp -69.16 -15.02 63.31 Favored 'General case' 0 N--CA 1.515 2.804 0 CA-C-O 117.924 -1.036 . . . . 0.0 111.483 176.171 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -74.16 -41.28 61.75 Favored 'General case' 0 N--CA 1.533 3.681 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 175.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.457 ' HB2' ' N ' ' A' ' 35' ' ' HIS . . . -87.62 -7.1 57.91 Favored 'General case' 0 N--CA 1.505 2.301 0 CA-C-O 118.671 -0.681 . . . . 0.0 110.364 177.216 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.59 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -82.99 -33.34 26.62 Favored 'General case' 0 N--CA 1.537 3.92 0 CA-C-N 120.071 1.305 . . . . 0.0 109.073 179.532 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -65.56 -40.12 92.47 Favored 'General case' 0 N--CA 1.532 3.649 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 176.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -90.94 -90.61 0.15 Allowed 'General case' 0 N--CA 1.514 2.736 0 N-CA-C 106.143 -1.799 . . . . 0.0 106.143 176.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 152.93 50.73 0.0 OUTLIER 'General case' 1 N--CA 1.558 4.93 0 C-N-CA 127.629 2.372 . . . . 0.0 108.474 176.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.7 mt -112.16 13.29 20.54 Favored 'General case' 0 N--CA 1.527 3.389 0 C-N-CA 124.312 1.045 . . . . 0.0 109.855 -179.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.457 ' N ' ' HB2' ' A' ' 29' ' ' ALA . 43.6 p-80 -83.07 3.61 29.74 Favored 'General case' 0 N--CA 1.506 2.341 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 175.566 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.427 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 21.2 mt -94.92 -50.95 0.25 Allowed Pre-proline 0 N--CA 1.509 2.503 0 CA-C-O 116.957 -1.497 . . . . 0.0 108.971 -175.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.427 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 3.9 Cg_exo -65.41 -30.87 52.8 Favored 'Trans proline' 0 C--N 1.396 3.036 0 N-CA-C 106.563 -2.13 . . . . 0.0 106.563 170.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.445 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.2 OUTLIER -67.32 -37.83 83.96 Favored 'General case' 0 N--CA 1.52 3.068 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 175.88 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.99 -15.98 61.08 Favored 'General case' 1 N--CA 1.543 4.186 0 CA-C-N 119.549 1.068 . . . . 0.0 110.407 175.956 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -82.58 -17.91 43.18 Favored 'General case' 0 N--CA 1.523 3.218 0 CA-C-N 119.651 1.114 . . . . 0.0 110.151 177.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 pp -99.83 -44.91 5.9 Favored 'General case' 0 N--CA 1.531 3.578 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -177.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 12.8 ptp -109.94 2.04 19.49 Favored 'General case' 1 N--CA 1.551 4.579 0 CA-C-N 118.962 0.801 . . . . 0.0 112.637 -175.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.0 mt -115.89 -65.39 1.19 Allowed 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 117.729 -1.129 . . . . 0.0 110.416 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 35.4 p 119.45 159.66 0.0 OUTLIER Pre-proline 1 N--CA 1.573 5.705 0 C-N-CA 128.32 2.648 . . . . 0.0 109.542 -178.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -67.24 -30.97 36.74 Favored 'Trans proline' 0 C--N 1.39 2.761 0 C-N-CA 122.026 1.817 . . . . 0.0 109.276 175.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -65.63 -26.42 67.81 Favored 'General case' 0 N--CA 1.531 3.604 0 CA-C-O 118.476 -0.773 . . . . 0.0 109.77 176.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -69.64 -33.35 72.5 Favored 'General case' 0 N--CA 1.524 3.275 0 CA-C-O 117.584 -1.198 . . . . 0.0 109.579 178.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 25.3 ptt180 -83.97 -18.12 38.27 Favored 'General case' 0 N--CA 1.53 3.533 0 CA-C-N 119.653 1.115 . . . . 0.0 108.906 174.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -75.23 -21.77 58.38 Favored 'General case' 0 N--CA 1.521 3.116 0 N-CA-C 107.2 -1.408 . . . . 0.0 107.2 173.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -92.91 -35.22 13.45 Favored 'General case' 0 N--CA 1.506 2.368 0 CA-C-O 118.124 -0.941 . . . . 0.0 109.05 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.445 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 25.7 tp -71.99 -21.81 61.52 Favored 'General case' 0 N--CA 1.536 3.873 0 N-CA-C 106.232 -1.766 . . . . 0.0 106.232 172.637 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.421 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -68.91 -75.55 0.52 Allowed Glycine 0 C--N 1.374 2.648 0 C-N-CA 125.585 1.564 . . . . 0.0 110.684 177.068 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.4 m -66.97 -26.08 66.64 Favored 'General case' 0 N--CA 1.534 3.757 0 CA-C-O 117.774 -1.108 . . . . 0.0 113.389 -177.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 29.2 mtm180 -72.53 -47.06 51.37 Favored 'General case' 0 N--CA 1.532 3.637 0 CA-C-N 120.105 1.321 . . . . 0.0 108.329 178.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.6 t -66.77 -18.41 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.978 0 CA-C-N 119.638 1.108 . . . . 0.0 108.839 174.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.3 mtp180 -73.49 -46.81 45.81 Favored 'General case' 0 N--CA 1.528 3.454 0 CA-C-O 117.16 -1.4 . . . . 0.0 111.792 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.24 -23.54 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.733 0 CA-C-N 121.626 2.012 . . . . 0.0 111.304 -179.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -83.46 -47.32 18.16 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.261 0 CA-C-N 120.374 1.443 . . . . 0.0 107.59 -179.529 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -63.88 -29.39 70.58 Favored 'General case' 0 N--CA 1.528 3.446 0 N-CA-C 109.435 -0.579 . . . . 0.0 109.435 177.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -88.28 -17.99 29.52 Favored 'General case' 0 N--CA 1.524 3.237 0 CA-C-O 118.084 -0.96 . . . . 0.0 110.549 177.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.7 mt -79.93 -40.97 26.99 Favored 'General case' 0 N--CA 1.531 3.58 0 CA-C-N 119.439 1.018 . . . . 0.0 108.342 178.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.2 tt -50.05 -36.94 31.06 Favored 'General case' 1 N--CA 1.543 4.184 0 C-N-CA 124.402 1.081 . . . . 0.0 110.537 178.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -80.07 -59.79 2.58 Favored 'General case' 0 N--CA 1.524 3.271 0 N-CA-C 106.824 -1.546 . . . . 0.0 106.824 177.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 57.11 67.59 2.14 Favored Glycine 1 N--CA 1.524 4.506 0 C-N-CA 124.222 0.915 . . . . 0.0 113.264 176.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -130.06 -52.17 1.12 Allowed 'General case' 0 N--CA 1.517 2.921 0 CA-C-N 117.765 0.782 . . . . 0.0 109.027 179.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 73.4 mtp -141.86 15.82 2.12 Favored 'General case' 0 N--CA 1.527 3.387 0 C-N-CA 122.895 0.478 . . . . 0.0 111.761 -179.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 5.1 t -115.67 37.37 3.62 Favored 'General case' 0 N--CA 1.531 3.603 0 CA-C-N 119.517 1.053 . . . . 0.0 111.581 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -114.92 -47.07 2.89 Favored 'General case' 0 N--CA 1.518 2.928 0 C-N-CA 124.381 1.072 . . . . 0.0 109.26 178.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -105.21 -55.6 2.3 Favored 'General case' 0 N--CA 1.526 3.342 0 C-N-CA 123.745 0.818 . . . . 0.0 109.555 -179.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -69.29 -9.2 52.15 Favored 'General case' 0 N--CA 1.52 3.055 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -178.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 22.1 tp -69.0 -46.99 66.59 Favored 'General case' 0 N--CA 1.528 3.43 0 CA-C-N 119.526 1.057 . . . . 0.0 111.229 -179.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -41.42 -41.42 2.02 Favored 'General case' 1 N--CA 1.549 4.519 0 N-CA-C 114.555 1.316 . . . . 0.0 114.555 -178.093 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -68.32 -36.14 78.85 Favored 'General case' 0 N--CA 1.538 3.943 0 C-N-CA 122.859 0.464 . . . . 0.0 111.94 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -47.61 -55.99 8.15 Favored 'General case' 0 N--CA 1.535 3.814 0 C-N-CA 124.838 1.255 . . . . 0.0 113.383 -178.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -128.81 -38.87 1.64 Allowed 'General case' 0 N--CA 1.532 3.663 0 CA-C-O 118.621 -0.705 . . . . 0.0 111.68 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 125.3 78.98 0.34 Allowed Glycine 1 N--CA 1.522 4.38 0 CA-C-N 119.181 0.9 . . . . 0.0 111.539 178.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.56 104.99 4.11 Favored 'General case' 0 N--CA 1.523 3.204 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 177.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -38.69 168.37 0.01 OUTLIER Glycine 1 N--CA 1.536 5.309 0 C-N-CA 125.576 1.56 . . . . 0.0 116.021 -176.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -80.68 -20.37 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.981 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 177.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.2 -32.49 73.9 Favored 'General case' 0 N--CA 1.522 3.171 0 CA-C-O 117.797 -1.097 . . . . 0.0 110.158 177.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 5.3 p -80.97 -50.17 10.04 Favored 'General case' 0 N--CA 1.536 3.873 0 CA-C-N 119.614 1.097 . . . . 0.0 111.962 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -65.83 -20.73 27.83 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.239 0 CA-C-O 117.831 -1.081 . . . . 0.0 112.888 -178.004 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 46.1 p -107.96 -25.68 11.06 Favored 'General case' 0 N--CA 1.514 2.763 0 CA-C-N 119.794 1.179 . . . . 0.0 111.904 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 14.4 ptt180 -79.28 -21.92 45.4 Favored 'General case' 0 N--CA 1.532 3.633 0 CA-C-N 119.722 1.147 . . . . 0.0 108.3 174.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.14 -32.67 69.13 Favored Glycine 0 N--CA 1.513 3.808 0 N-CA-C 110.259 -1.137 . . . . 0.0 110.259 177.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 51.5 p -67.88 -35.34 78.33 Favored 'General case' 1 N--CA 1.541 4.082 0 CA-C-N 118.579 1.189 . . . . 0.0 111.084 179.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -61.28 -30.53 70.53 Favored 'General case' 1 N--CA 1.541 4.114 0 C-N-CA 123.31 0.644 . . . . 0.0 110.962 179.037 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.3 m -69.0 -38.91 79.56 Favored 'General case' 0 N--CA 1.534 3.746 0 C-N-CA 123.422 0.689 . . . . 0.0 110.46 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 15.5 mt -59.54 -40.43 87.22 Favored 'General case' 0 N--CA 1.528 3.465 0 C-N-CA 124.02 0.928 . . . . 0.0 111.506 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.08 -19.72 54.6 Favored 'General case' 1 N--CA 1.541 4.112 0 CA-C-O 118.309 -0.853 . . . . 0.0 112.682 -179.322 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -96.27 -35.82 11.12 Favored 'General case' 0 N--CA 1.517 2.92 0 CA-C-N 119.179 0.9 . . . . 0.0 111.907 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -48.1 160.77 0.4 Allowed Pre-proline 1 N--CA 1.55 4.568 0 CA-C-O 118.253 -0.88 . . . . 0.0 113.259 -179.126 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -81.77 150.11 16.34 Favored 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 121.996 1.798 . . . . 0.0 109.946 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -84.11 -25.12 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.865 0 CA-C-O 117.817 -1.087 . . . . 0.0 111.24 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -62.83 -39.48 94.48 Favored 'General case' 0 N--CA 1.518 2.967 0 CA-C-N 120.16 1.346 . . . . 0.0 109.881 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.4 mp -98.08 -16.35 19.62 Favored 'General case' 0 N--CA 1.513 2.723 0 C-N-CA 123.836 0.854 . . . . 0.0 111.438 178.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -34.93 79.09 Favored 'General case' 1 N--CA 1.544 4.252 0 N-CA-C 103.458 -2.793 . . . . 0.0 103.458 169.348 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -56.17 -39.9 73.08 Favored 'General case' 0 N--CA 1.508 2.432 0 C-N-CA 124.401 1.08 . . . . 0.0 111.144 175.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.455 ' HA ' ' HB2' ' A' ' 102' ' ' GLU . 63.8 t90 -63.39 -34.67 78.23 Favored 'General case' 0 N--CA 1.53 3.548 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 177.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.16 -40.85 64.64 Favored 'General case' 0 N--CA 1.539 3.992 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 175.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -67.5 -36.79 81.76 Favored 'General case' 1 N--CA 1.54 4.045 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 175.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.455 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 3.0 mt-10 -60.75 -22.8 64.41 Favored 'General case' 1 N--CA 1.542 4.149 0 C-N-CA 123.635 0.774 . . . . 0.0 110.737 176.645 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -121.81 6.67 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.366 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -177.104 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.36 -55.4 2.52 Favored 'General case' 0 N--CA 1.513 2.715 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 176.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.9 tp . . . . . 0 N--CA 1.529 3.489 0 C-N-CA 124.861 1.264 . . . . 0.0 111.68 -179.768 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 . . . . . 0 N--CA 1.524 3.242 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 519' ' ' TRP . . . . . 0.416 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 72.1 t-105 -42.69 -29.27 0.29 Allowed 'General case' 1 N--CA 1.546 4.354 0 C-N-CA 124.373 1.069 . . . . 0.0 113.509 179.676 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 520' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -94.34 -29.15 15.17 Favored 'General case' 0 N--CA 1.529 3.476 0 CA-C-O 117.769 -1.11 . . . . 0.0 113.863 -172.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 37.0 mtm180 -64.26 -23.77 67.42 Favored 'General case' 0 N--CA 1.533 3.686 0 N-CA-C 106.266 -1.753 . . . . 0.0 106.266 171.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . 0.445 ' CD2' ' HG ' ' A' ' 51' ' ' LEU . 1.9 m-85 -77.61 -38.74 47.46 Favored 'General case' 0 N--CA 1.514 2.739 0 N-CA-C 106.7 -1.593 . . . . 0.0 106.7 173.323 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.75 -24.31 34.08 Favored 'Isoleucine or valine' 1 N--CA 1.551 4.622 0 CA-C-O 116.924 -1.512 . . . . 0.0 112.627 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -77.48 -42.14 36.88 Favored 'General case' 1 N--CA 1.542 4.136 0 CA-C-N 121.463 1.938 . . . . 0.0 108.443 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.79 -28.99 67.26 Favored 'General case' 1 N--CA 1.539 4.003 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 175.473 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -72.25 -32.78 66.99 Favored 'General case' 0 N--CA 1.524 3.243 0 CA-C-O 118.511 -0.757 . . . . 0.0 109.459 177.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 31.1 ttmt -71.6 -28.88 64.11 Favored 'General case' 0 N--CA 1.517 2.901 0 CA-C-O 118.388 -0.815 . . . . 0.0 110.641 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -71.71 -35.94 70.37 Favored 'General case' 0 N--CA 1.533 3.702 0 CA-C-N 119.052 0.842 . . . . 0.0 108.98 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 529' ' ' ALA . . . . . . . . . . . . . . . -89.44 -9.38 50.4 Favored 'General case' 0 CA--C 1.578 2.028 0 CA-C-O 118.358 -0.829 . . . . 0.0 110.209 178.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -82.07 -34.41 29.42 Favored 'General case' 0 N--CA 1.533 3.678 0 CA-C-N 120.411 1.459 . . . . 0.0 108.574 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -61.69 -41.0 96.99 Favored 'General case' 0 N--CA 1.538 3.926 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 177.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 66.2 m-80 -95.42 -88.9 0.25 Allowed 'General case' 0 N--CA 1.514 2.736 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 176.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.8 p30 153.54 49.74 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.062 0 C-N-CA 127.764 2.426 . . . . 0.0 108.228 177.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 10.0 mt -101.73 2.05 38.09 Favored 'General case' 0 N--CA 1.529 3.523 0 C-N-CA 124.561 1.144 . . . . 0.0 111.197 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 535' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -80.64 0.48 34.06 Favored 'General case' 0 N--CA 1.511 2.617 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 174.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 536' ' ' LEU . . . . . . . . . . . . . 46.7 mt -93.38 -49.62 0.28 Allowed Pre-proline 0 N--CA 1.509 2.48 0 CA-C-O 116.673 -1.632 . . . . 0.0 109.492 -176.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 537' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -63.16 -36.42 58.13 Favored 'Trans proline' 0 C--N 1.397 3.11 0 N-CA-C 106.539 -2.139 . . . . 0.0 106.539 171.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.28 -49.8 74.93 Favored 'General case' 0 N--CA 1.531 3.594 0 C-N-CA 124.21 1.004 . . . . 0.0 109.19 174.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 13.2 mt -66.17 -21.54 66.33 Favored 'General case' 1 N--CA 1.54 4.04 0 CA-C-O 118.086 -0.959 . . . . 0.0 112.599 -178.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 21.9 t30 -70.77 -12.31 61.47 Favored 'General case' 0 N--CA 1.534 3.752 0 CA-C-N 119.297 0.953 . . . . 0.0 111.514 178.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -117.29 -37.4 3.53 Favored 'General case' 0 N--CA 1.52 3.059 0 CA-C-N 119.212 0.914 . . . . 0.0 110.344 -178.662 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 6.7 ptt? -96.95 9.77 41.02 Favored 'General case' 1 N--CA 1.544 4.234 0 CA-C-N 119.618 1.099 . . . . 0.0 112.796 -179.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 1.5 tp -132.05 -93.42 0.37 Allowed 'General case' 0 N--CA 1.53 3.547 0 CA-C-N 119.898 1.226 . . . . 0.0 111.995 178.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 1.2 p 147.3 135.7 0.0 OUTLIER Pre-proline 1 N--CA 1.566 5.352 0 C-N-CA 127.101 2.161 . . . . 0.0 107.511 -178.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -60.15 -33.98 94.61 Favored 'Trans proline' 0 N--CA 1.519 3.01 0 C-N-CA 122.734 2.289 . . . . 0.0 112.137 178.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -64.47 -34.73 78.89 Favored 'General case' 0 N--CA 1.536 3.864 0 CA-C-O 118.856 -0.592 . . . . 0.0 111.651 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -75.5 -29.78 59.62 Favored 'General case' 0 N--CA 1.524 3.259 0 CA-C-O 117.46 -1.257 . . . . 0.0 111.133 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 548' ' ' ARG . . . . . 0.42 ' HB2' ' HB2' ' A' ' 19' ' ' TRP . 32.9 ptt180 -76.3 -24.44 54.37 Favored 'General case' 0 N--CA 1.532 3.627 0 CA-C-N 120.238 1.381 . . . . 0.0 109.152 175.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -64.29 -43.25 95.35 Favored 'General case' 0 N--CA 1.536 3.855 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 173.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -73.02 -21.66 60.78 Favored 'General case' 0 N--CA 1.517 2.904 0 CA-C-O 117.104 -1.427 . . . . 0.0 110.649 176.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 551' ' ' LEU . . . . . 0.484 HD22 ' CG ' ' A' ' 22' ' ' PHE . 10.9 tp -75.29 -23.39 57.38 Favored 'General case' 0 N--CA 1.521 3.095 0 CA-C-N 120.287 1.403 . . . . 0.0 107.909 174.711 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -73.71 -59.57 4.02 Favored Glycine 0 N--CA 1.499 2.889 0 N-CA-C 108.67 -1.772 . . . . 0.0 108.67 178.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 1.7 t -65.17 -26.13 68.03 Favored 'General case' 0 N--CA 1.535 3.813 0 CA-C-N 117.95 0.875 . . . . 0.0 111.363 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 45.7 mtt180 -62.2 -52.99 61.56 Favored 'General case' 1 N--CA 1.543 4.195 0 N-CA-C 107.063 -1.458 . . . . 0.0 107.063 176.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 18.0 t -71.96 -14.91 17.78 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.547 0 CA-C-O 118.15 -0.929 . . . . 0.0 110.553 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 76.1 mtt-85 -77.56 -46.76 21.29 Favored 'General case' 0 N--CA 1.527 3.382 0 CA-C-N 119.88 1.218 . . . . 0.0 110.725 178.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 557' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.15 -23.98 22.1 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.669 0 CA-C-N 119.622 1.101 . . . . 0.0 110.524 -177.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 558' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -87.1 -53.21 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.871 0 CA-C-N 119.943 1.247 . . . . 0.0 107.698 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -58.56 -24.64 61.21 Favored 'General case' 0 N--CA 1.533 3.675 0 CA-C-O 118.516 -0.754 . . . . 0.0 110.969 178.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -91.25 -27.34 18.51 Favored 'General case' 0 N--CA 1.525 3.282 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.385 178.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 1.9 mp -69.57 -43.93 71.87 Favored 'General case' 1 N--CA 1.541 4.108 0 CA-C-N 119.409 1.004 . . . . 0.0 109.156 178.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 42.7 mt -58.29 -21.62 49.6 Favored 'General case' 0 N--CA 1.537 3.897 0 C-N-CA 123.762 0.825 . . . . 0.0 112.226 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 12.3 mmm180 -80.23 -47.94 13.85 Favored 'General case' 0 N--CA 1.53 3.567 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 67.08 38.57 92.53 Favored Glycine 1 N--CA 1.525 4.613 0 CA-C-O 118.783 -1.009 . . . . 0.0 113.647 177.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -97.76 -57.36 2.25 Favored 'General case' 0 N--CA 1.517 2.908 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 178.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 16.3 ptt? -170.52 79.52 0.09 Allowed 'General case' 0 N--CA 1.536 3.839 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 178.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 75.7 m -137.4 3.67 2.59 Favored 'General case' 0 N--CA 1.516 2.826 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -176.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -88.88 -76.51 0.4 Allowed 'General case' 0 N--CA 1.524 3.247 0 CA-C-N 119.981 1.264 . . . . 0.0 111.583 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.97 -33.85 17.08 Favored 'General case' 0 N--CA 1.532 3.675 0 CA-C-N 118.995 0.816 . . . . 0.0 112.879 -177.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -83.49 -3.5 57.67 Favored 'General case' 0 N--CA 1.522 3.138 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -178.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 24.2 tp -82.5 -45.47 14.66 Favored 'General case' 0 N--CA 1.53 3.532 0 CA-C-N 119.744 1.156 . . . . 0.0 111.507 -178.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -41.43 -32.4 0.32 Allowed 'General case' 1 N--CA 1.55 4.536 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -177.796 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -73.51 -40.34 64.14 Favored 'General case' 0 N--CA 1.532 3.647 0 CA-C-N 118.454 0.57 . . . . 0.0 111.393 -177.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -51.69 -61.56 2.18 Favored 'General case' 0 N--CA 1.53 3.53 0 C-N-CA 123.989 0.916 . . . . 0.0 113.191 -178.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -114.77 -50.98 2.76 Favored 'General case' 0 N--CA 1.536 3.827 0 CA-C-N 118.718 0.69 . . . . 0.0 110.934 -179.098 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 130.91 80.3 0.21 Allowed Glycine 1 N--CA 1.518 4.154 0 N-CA-C 109.988 -1.245 . . . . 0.0 109.988 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -136.6 99.77 4.16 Favored 'General case' 0 N--CA 1.52 3.041 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 178.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -41.32 168.24 0.01 OUTLIER Glycine 1 N--CA 1.541 5.653 0 C-N-CA 124.952 1.263 . . . . 0.0 115.319 -176.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -80.51 -22.37 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.108 0 CA-C-N 118.273 1.036 . . . . 0.0 108.453 178.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -67.08 -39.86 86.87 Favored 'General case' 0 N--CA 1.53 3.561 0 CA-C-N 119.619 1.099 . . . . 0.0 110.139 177.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.33 -39.14 33.51 Favored 'General case' 1 N--CA 1.544 4.248 0 CA-C-N 118.759 0.709 . . . . 0.0 112.027 -179.832 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 2.0 tt -65.53 -36.99 78.95 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.502 0 C-N-CA 123.502 0.721 . . . . 0.0 111.597 -176.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 69.9 p -96.92 -31.75 12.4 Favored 'General case' 0 N--CA 1.512 2.672 0 CA-C-O 118.175 -0.917 . . . . 0.0 111.132 -178.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 20.9 ptt180 -70.17 -21.39 63.06 Favored 'General case' 0 N--CA 1.535 3.789 0 CA-C-N 119.613 1.097 . . . . 0.0 109.424 175.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -68.1 -35.36 83.41 Favored Glycine 1 N--CA 1.519 4.21 0 N-CA-C 108.046 -2.022 . . . . 0.0 108.046 174.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 5.5 t -61.77 -41.27 97.48 Favored 'General case' 1 N--CA 1.54 4.028 0 CA-C-N 117.701 0.75 . . . . 0.0 110.226 177.094 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -59.65 -23.2 62.84 Favored 'General case' 1 N--CA 1.541 4.099 0 C-N-CA 123.528 0.731 . . . . 0.0 112.157 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 75.3 m -62.12 -46.68 87.96 Favored 'General case' 0 N--CA 1.535 3.797 0 C-N-CA 123.535 0.734 . . . . 0.0 110.828 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 52.3 mt -59.96 -49.41 77.77 Favored 'General case' 0 N--CA 1.524 3.256 0 C-N-CA 124.206 1.002 . . . . 0.0 111.505 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -54.63 -26.31 32.18 Favored 'General case' 1 N--CA 1.547 4.397 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -178.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -86.76 -43.44 12.54 Favored 'General case' 0 N--CA 1.515 2.823 0 CA-C-N 118.395 0.543 . . . . 0.0 110.328 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -57.72 161.8 5.86 Favored Pre-proline 1 N--CA 1.54 4.066 0 CA-C-O 118.247 -0.882 . . . . 0.0 112.545 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -80.08 162.38 23.23 Favored 'Trans proline' 0 C--N 1.378 2.13 0 C-N-CA 121.918 1.745 . . . . 0.0 110.779 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -83.72 -25.87 7.6 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.894 0 CA-C-O 117.471 -1.252 . . . . 0.0 112.077 -178.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -63.6 -41.2 98.35 Favored 'General case' 0 N--CA 1.519 2.993 0 CA-C-N 120.428 1.467 . . . . 0.0 110.398 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 6.8 mp -98.83 -14.82 19.49 Favored 'General case' 0 N--CA 1.514 2.745 0 C-N-CA 123.557 0.743 . . . . 0.0 111.636 178.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -32.42 74.06 Favored 'General case' 1 N--CA 1.542 4.171 0 N-CA-C 102.807 -3.034 . . . . 0.0 102.807 166.8 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -57.12 -36.34 70.54 Favored 'General case' 0 N--CA 1.517 2.875 0 C-N-CA 124.885 1.274 . . . . 0.0 110.796 175.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 599' ' ' TRP . . . . . 0.427 ' HA ' ' HB2' ' B' ' 602' ' ' GLU . 44.2 t90 -61.13 -36.12 78.9 Favored 'General case' 0 N--CA 1.536 3.872 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 177.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 10.3 mp -56.58 -38.94 72.67 Favored 'General case' 1 N--CA 1.544 4.255 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 176.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -68.39 -29.88 68.68 Favored 'General case' 0 N--CA 1.537 3.885 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 175.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 602' ' ' GLU . . . . . 0.427 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.6 OUTLIER -69.14 -26.63 64.98 Favored 'General case' 1 N--CA 1.542 4.142 0 C-N-CA 124.411 1.084 . . . . 0.0 110.595 176.622 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.87 -14.33 8.56 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.639 0 CA-C-O 117.85 -1.071 . . . . 0.0 112.262 -175.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 7.0 mp -92.13 -57.53 2.68 Favored 'General case' 0 N--CA 1.522 3.156 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 173.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 6.1 mp . . . . . 0 N--CA 1.521 3.105 0 CA-C-O 117.693 -1.146 . . . . 0.0 108.159 177.632 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 . . . . . 0 N--CA 1.527 3.408 0 CA-C-O 118.909 -0.567 . . . . 0.0 112.289 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.433 ' CE3' HD21 ' B' ' 551' ' ' LEU . 73.0 t-105 -51.18 -43.97 61.43 Favored 'General case' 1 N--CA 1.54 4.074 0 CA-C-N 119.193 0.906 . . . . 0.0 111.215 -178.548 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -83.77 -23.29 31.58 Favored 'General case' 0 N--CA 1.517 2.893 0 CA-C-O 117.542 -1.218 . . . . 0.0 111.695 -176.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -58.4 -28.74 65.49 Favored 'General case' 0 N--CA 1.536 3.868 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 173.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.512 ' CG ' HD22 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -85.5 -36.14 20.73 Favored 'General case' 0 N--CA 1.504 2.232 0 CA-C-O 115.766 -2.064 . . . . 0.0 109.347 174.068 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 48.6 t -71.24 -27.47 29.42 Favored 'Isoleucine or valine' 1 N--CA 1.576 5.833 0 CA-C-N 121.762 2.074 . . . . 0.0 112.754 -175.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -77.39 -50.1 13.48 Favored 'General case' 0 N--CA 1.533 3.718 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 179.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.65 -25.45 68.13 Favored 'General case' 0 N--CA 1.539 3.996 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 174.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.407 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -70.06 -38.66 75.84 Favored 'General case' 0 N--CA 1.517 2.885 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 178.093 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.1 tttt -64.36 -22.57 67.0 Favored 'General case' 0 N--CA 1.527 3.388 0 CA-C-O 118.452 -0.785 . . . . 0.0 111.049 177.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -72.27 -39.66 68.19 Favored 'General case' 0 N--CA 1.53 3.564 0 CA-C-N 119.003 0.82 . . . . 0.0 108.868 176.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.429 ' HB2' ' N ' ' A' ' 35' ' ' HIS . . . -91.05 -6.33 54.02 Favored 'General case' 0 N--CA 1.506 2.332 0 CA-C-O 118.573 -0.727 . . . . 0.0 110.793 177.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.04 -33.86 26.38 Favored 'General case' 0 N--CA 1.533 3.69 0 CA-C-N 120.41 1.459 . . . . 0.0 109.005 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -65.11 -42.66 93.77 Favored 'General case' 0 N--CA 1.531 3.604 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 176.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 63.3 m-80 -86.87 -89.35 0.12 Allowed 'General case' 0 N--CA 1.516 2.864 0 N-CA-C 106.563 -1.643 . . . . 0.0 106.563 176.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 150.54 52.47 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.909 0 C-N-CA 128.013 2.525 . . . . 0.0 107.959 177.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.9 mt -114.62 11.88 17.07 Favored 'General case' 0 N--CA 1.527 3.384 0 C-N-CA 124.698 1.199 . . . . 0.0 110.245 -178.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.429 ' N ' ' HB2' ' A' ' 29' ' ' ALA . 46.8 p-80 -80.61 0.85 32.28 Favored 'General case' 0 N--CA 1.51 2.556 0 C-N-CA 123.505 0.722 . . . . 0.0 109.225 175.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.408 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 22.4 mt -93.06 -50.82 0.27 Allowed Pre-proline 0 N--CA 1.511 2.592 0 CA-C-O 116.971 -1.49 . . . . 0.0 109.207 -175.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.408 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 7.6 Cg_exo -61.34 -35.16 85.46 Favored 'Trans proline' 0 C--N 1.396 3.068 0 N-CA-C 106.425 -2.183 . . . . 0.0 106.425 170.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -64.76 -39.21 93.24 Favored 'General case' 0 N--CA 1.512 2.645 0 C-N-CA 124.057 0.943 . . . . 0.0 109.974 176.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.08 -22.53 61.35 Favored 'General case' 1 N--CA 1.546 4.372 0 CA-C-N 119.533 1.06 . . . . 0.0 111.791 -179.862 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -96.31 21.82 8.56 Favored 'General case' 1 N--CA 1.539 4.003 0 CA-C-N 119.926 1.239 . . . . 0.0 110.049 176.454 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -127.08 -45.63 1.55 Allowed 'General case' 0 N--CA 1.519 2.993 0 CA-C-O 118.056 -0.973 . . . . 0.0 109.361 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 9.9 ptt? -116.86 11.01 14.32 Favored 'General case' 1 N--CA 1.551 4.618 0 CA-C-N 119.711 1.142 . . . . 0.0 112.32 179.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.7 mp -122.86 -94.05 0.5 Allowed 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 177.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 157.31 169.28 0.02 OUTLIER Pre-proline 1 N--CA 1.566 5.358 0 C-N-CA 125.476 1.511 . . . . 0.0 110.041 178.894 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -69.0 -37.73 10.56 Favored 'Trans proline' 0 C--N 1.39 2.735 0 C-N-CA 122.066 1.844 . . . . 0.0 107.586 172.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -66.19 -18.57 65.43 Favored 'General case' 0 N--CA 1.527 3.395 0 CA-C-O 117.942 -1.027 . . . . 0.0 110.895 176.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -71.09 -37.57 72.41 Favored 'General case' 0 N--CA 1.529 3.478 0 CA-C-N 119.613 1.097 . . . . 0.0 108.613 178.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -84.91 -15.89 42.96 Favored 'General case' 0 N--CA 1.531 3.582 0 CA-C-O 118.117 -0.944 . . . . 0.0 109.826 175.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -73.07 -29.43 62.95 Favored 'General case' 0 N--CA 1.525 3.291 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 173.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -88.01 -36.28 17.1 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-O 117.918 -1.039 . . . . 0.0 109.725 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.439 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 23.1 tp -69.75 -22.8 63.33 Favored 'General case' 0 N--CA 1.537 3.879 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 173.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.47 -73.36 0.67 Allowed Glycine 0 N--CA 1.496 2.7 0 C-N-CA 125.294 1.426 . . . . 0.0 111.277 177.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.9 m -72.06 -24.56 61.54 Favored 'General case' 0 N--CA 1.536 3.86 0 CA-C-O 118.144 -0.932 . . . . 0.0 112.785 -177.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 76.9 mtm-85 -68.15 -50.27 55.63 Favored 'General case' 0 N--CA 1.531 3.593 0 CA-C-N 120.074 1.306 . . . . 0.0 107.628 177.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 11.5 t -65.98 -17.9 23.06 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.823 0 CA-C-O 118.217 -0.897 . . . . 0.0 109.88 177.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.7 mtt-85 -69.08 -56.92 6.24 Favored 'General case' 0 N--CA 1.529 3.515 0 CA-C-N 119.741 1.155 . . . . 0.0 111.444 177.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.9 -25.63 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.757 0 CA-C-N 119.825 1.193 . . . . 0.0 112.087 -177.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -83.71 -53.54 11.02 Favored 'Isoleucine or valine' 1 N--CA 1.549 4.517 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 -179.653 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -61.6 -18.73 60.58 Favored 'General case' 0 N--CA 1.527 3.392 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.063 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -96.56 -23.26 16.61 Favored 'General case' 0 N--CA 1.526 3.344 0 CA-C-O 118.174 -0.917 . . . . 0.0 110.305 176.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.6 mt -75.76 -51.74 11.99 Favored 'General case' 0 N--CA 1.534 3.758 0 CA-C-N 119.535 1.062 . . . . 0.0 108.979 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 36.1 mt -54.32 -26.4 29.4 Favored 'General case' 0 N--CA 1.538 3.953 0 C-N-CA 124.163 0.985 . . . . 0.0 113.293 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 30.1 mmm180 -77.86 -45.68 23.58 Favored 'General case' 0 N--CA 1.531 3.584 0 CA-C-N 118.755 0.707 . . . . 0.0 111.278 -178.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.15 56.51 2.41 Favored Glycine 0 N--CA 1.515 3.96 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -98.71 -40.27 8.24 Favored 'General case' 0 N--CA 1.526 3.364 0 CA-C-O 118.713 -0.66 . . . . 0.0 110.074 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 76.8 mtp 121.18 69.0 0.0 OUTLIER 'General case' 1 N--CA 1.544 4.264 0 C-N-CA 128.075 2.55 . . . . 0.0 104.997 -178.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 23.4 m -117.8 38.48 3.62 Favored 'General case' 0 N--CA 1.52 3.03 0 CA-C-N 115.109 -0.951 . . . . 0.0 110.771 -177.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -113.16 -46.38 3.09 Favored 'General case' 0 N--CA 1.521 3.107 0 C-N-CA 123.751 0.82 . . . . 0.0 110.194 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -104.49 -56.59 2.16 Favored 'General case' 0 N--CA 1.528 3.429 0 C-N-CA 123.547 0.739 . . . . 0.0 110.968 -178.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -75.28 -0.18 18.73 Favored 'General case' 0 N--CA 1.519 2.983 0 N-CA-C 114.063 1.135 . . . . 0.0 114.063 -176.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 24.6 tp -85.35 -47.06 10.38 Favored 'General case' 0 N--CA 1.527 3.392 0 CA-C-N 119.906 1.23 . . . . 0.0 112.458 -178.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -42.65 -30.58 0.38 Allowed 'General case' 1 N--CA 1.552 4.635 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 -176.739 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -71.86 -41.13 68.44 Favored 'General case' 0 N--CA 1.535 3.793 0 CA-C-N 118.829 0.74 . . . . 0.0 111.234 -178.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -47.57 -53.35 14.83 Favored 'General case' 0 N--CA 1.533 3.702 0 C-N-CA 125.078 1.351 . . . . 0.0 113.438 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.1 pp -125.06 -39.67 2.22 Favored 'General case' 0 N--CA 1.536 3.85 0 CA-C-O 118.717 -0.659 . . . . 0.0 111.938 -178.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 112.72 64.78 0.47 Allowed Glycine 1 N--CA 1.523 4.487 0 CA-C-N 118.976 0.807 . . . . 0.0 111.621 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -127.48 108.95 11.26 Favored 'General case' 0 N--CA 1.523 3.211 0 N-CA-C 106.047 -1.835 . . . . 0.0 106.047 176.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -34.65 165.37 0.01 OUTLIER Glycine 1 N--CA 1.536 5.356 0 C-N-CA 125.863 1.696 . . . . 0.0 116.658 -176.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -78.64 -23.67 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.903 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 177.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.85 -34.37 75.85 Favored 'General case' 0 N--CA 1.521 3.076 0 CA-C-O 117.689 -1.148 . . . . 0.0 109.835 177.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 17.8 p -74.89 -56.62 4.57 Favored 'General case' 0 N--CA 1.53 3.568 0 CA-C-N 119.342 0.974 . . . . 0.0 111.965 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -62.06 -24.54 34.88 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.173 0 CA-C-O 118.174 -0.917 . . . . 0.0 113.469 -176.829 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 71.9 p -101.07 -26.27 13.76 Favored 'General case' 0 N--CA 1.51 2.567 0 CA-C-O 117.955 -1.021 . . . . 0.0 110.913 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 26.2 ptt180 -75.77 -22.83 56.07 Favored 'General case' 0 N--CA 1.535 3.806 0 CA-C-N 119.82 1.191 . . . . 0.0 108.545 174.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -68.15 -32.22 76.09 Favored Glycine 0 N--CA 1.516 3.979 0 N-CA-C 109.043 -1.623 . . . . 0.0 109.043 175.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 6.6 t -63.68 -31.5 72.69 Favored 'General case' 0 N--CA 1.536 3.869 0 CA-C-N 118.18 0.99 . . . . 0.0 110.117 177.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -59.65 -33.41 71.5 Favored 'General case' 1 N--CA 1.545 4.291 0 C-N-CA 123.604 0.762 . . . . 0.0 110.311 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.15 -31.98 73.44 Favored 'General case' 0 N--CA 1.538 3.932 0 C-N-CA 123.791 0.837 . . . . 0.0 111.3 179.564 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 38.8 mt -57.26 -44.21 83.7 Favored 'General case' 0 N--CA 1.531 3.619 0 C-N-CA 123.759 0.824 . . . . 0.0 111.232 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -65.99 -20.29 66.14 Favored 'General case' 0 N--CA 1.537 3.921 0 CA-C-O 118.193 -0.908 . . . . 0.0 112.901 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.57 -32.06 18.32 Favored 'General case' 0 N--CA 1.523 3.183 0 CA-C-N 119.323 0.965 . . . . 0.0 113.133 -178.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.87 153.23 88.84 Favored Pre-proline 1 N--CA 1.54 4.07 0 CA-C-O 118.087 -0.959 . . . . 0.0 113.527 -178.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -87.41 171.59 6.29 Favored 'Trans proline' 0 C--N 1.387 2.576 0 C-N-CA 122.695 2.263 . . . . 0.0 111.084 177.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.4 t -87.76 -27.22 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.306 0 CA-C-O 117.803 -1.094 . . . . 0.0 111.216 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -62.14 -41.4 98.23 Favored 'General case' 0 N--CA 1.518 2.942 0 CA-C-N 120.187 1.358 . . . . 0.0 109.598 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.8 mp -98.84 -9.96 23.59 Favored 'General case' 0 N--CA 1.507 2.417 0 C-N-CA 123.569 0.748 . . . . 0.0 111.666 178.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -35.99 82.75 Favored 'General case' 1 N--CA 1.545 4.298 0 N-CA-C 102.528 -3.138 . . . . 0.0 102.528 166.894 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -52.6 -35.25 53.95 Favored 'General case' 0 N--CA 1.52 3.036 0 C-N-CA 124.316 1.047 . . . . 0.0 111.499 175.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 43.1 t90 -67.68 -39.26 84.49 Favored 'General case' 0 N--CA 1.53 3.563 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 177.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 10.4 mp -55.61 -30.13 60.35 Favored 'General case' 0 N--CA 1.536 3.853 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 176.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -74.3 -37.79 63.55 Favored 'General case' 0 N--CA 1.532 3.652 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 175.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.59 -21.4 65.59 Favored 'General case' 0 N--CA 1.535 3.797 0 CA-C-O 118.325 -0.845 . . . . 0.0 111.581 177.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -119.73 -8.14 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.838 0 CA-C-O 117.884 -1.055 . . . . 0.0 113.247 -176.131 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 8.2 mp -105.68 -51.31 3.02 Favored 'General case' 0 N--CA 1.531 3.602 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 176.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.0 tt . . . . . 0 N--CA 1.536 3.855 0 C-N-CA 124.141 0.976 . . . . 0.0 110.381 179.678 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 . . . . . 0 N--CA 1.524 3.259 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 519' ' ' TRP . . . . . 0.407 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 71.0 t-105 -42.81 -28.33 0.24 Allowed 'General case' 1 N--CA 1.552 4.639 0 C-N-CA 124.388 1.075 . . . . 0.0 113.685 -179.694 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 520' ' ' LEU . . . . . 0.402 ' CD2' ' N ' ' B' ' 520' ' ' LEU . 2.2 mm? -96.09 -29.92 13.83 Favored 'General case' 0 N--CA 1.527 3.392 0 CA-C-O 117.895 -1.05 . . . . 0.0 113.449 -172.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 23.3 mtp180 -62.23 -26.17 68.23 Favored 'General case' 1 N--CA 1.54 4.055 0 N-CA-C 105.485 -2.043 . . . . 0.0 105.485 171.651 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . 0.439 ' CD2' ' HG ' ' A' ' 51' ' ' LEU . 1.8 m-85 -78.11 -39.77 40.33 Favored 'General case' 0 N--CA 1.515 2.8 0 N-CA-C 107.397 -1.334 . . . . 0.0 107.397 174.253 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 37.1 t -66.55 -23.36 31.29 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.259 0 CA-C-N 119.96 1.254 . . . . 0.0 112.493 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -78.01 -52.01 9.45 Favored 'General case' 0 N--CA 1.532 3.654 0 CA-C-N 120.345 1.429 . . . . 0.0 108.19 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 1.2 tp -68.16 -23.04 64.83 Favored 'General case' 0 N--CA 1.53 3.528 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 176.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -71.23 -36.16 71.72 Favored 'General case' 0 N--CA 1.522 3.157 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 176.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 527' ' ' LYS . . . . . 0.405 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 27.3 ttmt -66.21 -21.69 66.32 Favored 'General case' 0 N--CA 1.516 2.872 0 CA-C-O 118.383 -0.818 . . . . 0.0 111.003 177.029 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -72.43 -39.41 67.87 Favored 'General case' 0 N--CA 1.53 3.566 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 529' ' ' ALA . . . . . 0.453 ' HB2' ' N ' ' B' ' 535' ' ' HIS . . . -91.63 -7.83 48.94 Favored 'General case' 0 N--CA 1.506 2.362 0 CA-C-O 118.317 -0.849 . . . . 0.0 110.802 177.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 530' ' ' TYR . . . . . 0.405 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.6 OUTLIER -81.69 -33.06 31.41 Favored 'General case' 0 N--CA 1.531 3.596 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 177.513 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -54.61 -49.31 70.76 Favored 'General case' 0 N--CA 1.536 3.833 0 C-N-CA 124.557 1.143 . . . . 0.0 108.255 176.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -93.38 -85.12 0.28 Allowed 'General case' 0 N--CA 1.515 2.816 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 177.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.9 p30 153.53 45.83 0.0 OUTLIER 'General case' 1 N--CA 1.559 4.989 0 C-N-CA 127.707 2.403 . . . . 0.0 108.44 177.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 6.3 mt -103.26 13.31 34.16 Favored 'General case' 0 N--CA 1.518 2.953 0 C-N-CA 124.854 1.262 . . . . 0.0 110.068 -179.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 535' ' ' HIS . . . . . 0.453 ' N ' ' HB2' ' B' ' 529' ' ' ALA . 37.1 p-80 -84.37 4.15 32.63 Favored 'General case' 0 N--CA 1.512 2.657 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 174.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 536' ' ' LEU . . . . . 0.421 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 26.9 mt -94.83 -50.79 0.25 Allowed Pre-proline 0 N--CA 1.502 2.128 0 CA-C-O 116.302 -1.809 . . . . 0.0 108.296 -176.205 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 537' ' ' PRO . . . . . 0.421 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 5.7 Cg_exo -67.18 -32.32 34.04 Favored 'Trans proline' 0 C--N 1.4 3.244 0 C-N-CA 122.109 1.873 . . . . 0.0 107.485 170.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 538' ' ' LEU . . . . . 0.422 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 0.3 OUTLIER -65.86 -40.21 91.47 Favored 'General case' 0 N--CA 1.528 3.448 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 174.812 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 7.7 mt -67.76 -23.14 65.2 Favored 'General case' 1 N--CA 1.54 4.067 0 CA-C-O 118.289 -0.863 . . . . 0.0 109.965 176.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -76.71 -29.03 56.09 Favored 'General case' 0 N--CA 1.523 3.202 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 177.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 5.5 tp -70.84 -43.99 67.36 Favored 'General case' 0 N--CA 1.532 3.63 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 177.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -96.96 47.95 1.05 Allowed 'General case' 0 CA--C 1.61 3.251 0 N-CA-C 101.44 -3.541 . . . . 0.0 101.44 171.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -29.34 -91.08 0.0 OUTLIER 'General case' 0 N--CA 1.534 3.766 0 C-N-CA 127.698 2.399 . . . . 0.0 116.246 -171.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 38.0 p 44.08 85.56 0.16 Allowed Pre-proline 0 N--CA 1.531 3.602 0 C-N-CA 124.988 1.315 . . . . 0.0 112.783 -178.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -67.43 -27.89 39.49 Favored 'Trans proline' 0 C--N 1.395 2.994 0 C-N-CA 122.417 2.078 . . . . 0.0 110.032 177.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -58.68 -17.45 22.68 Favored 'General case' 0 N--CA 1.538 3.939 0 CA-C-O 118.491 -0.766 . . . . 0.0 111.169 176.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -66.55 -49.69 65.62 Favored 'General case' 0 N--CA 1.527 3.423 0 CA-C-N 119.25 0.932 . . . . 0.0 108.819 178.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 24.4 ptt-85 -80.55 -11.62 59.63 Favored 'General case' 0 N--CA 1.522 3.165 0 CA-C-O 118.097 -0.954 . . . . 0.0 112.295 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -72.15 -53.58 12.3 Favored 'General case' 0 N--CA 1.534 3.729 0 N-CA-C 106.533 -1.655 . . . . 0.0 106.533 174.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -82.91 -12.33 57.45 Favored 'General case' 0 N--CA 1.508 2.459 0 CA-C-O 117.301 -1.333 . . . . 0.0 111.926 178.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 551' ' ' LEU . . . . . 0.512 HD22 ' CG ' ' A' ' 22' ' ' PHE . 18.8 tp -82.2 -31.6 30.28 Favored 'General case' 0 N--CA 1.528 3.443 0 CA-C-N 121.088 1.767 . . . . 0.0 107.69 175.173 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -72.3 -53.66 8.69 Favored Glycine 0 N--CA 1.496 2.69 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 178.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 5.3 m -71.03 -28.41 64.37 Favored 'General case' 0 N--CA 1.534 3.741 0 CA-C-O 117.96 -1.019 . . . . 0.0 111.973 -178.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -68.33 -55.24 12.76 Favored 'General case' 1 N--CA 1.543 4.205 0 N-CA-C 106.546 -1.65 . . . . 0.0 106.546 176.2 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 38.3 t -59.07 -18.61 14.02 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.999 0 CA-C-O 117.937 -1.03 . . . . 0.0 110.428 176.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 5.2 mmm180 -79.81 -44.11 21.18 Favored 'General case' 0 N--CA 1.526 3.356 0 CA-C-O 117.436 -1.269 . . . . 0.0 111.862 178.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 557' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.72 -20.63 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.569 0 CA-C-N 121.365 1.893 . . . . 0.0 110.715 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 558' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -88.92 -51.04 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.871 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -60.0 -23.58 63.77 Favored 'General case' 0 N--CA 1.53 3.569 0 CA-C-O 118.892 -0.575 . . . . 0.0 110.483 177.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -95.93 -23.15 17.0 Favored 'General case' 0 N--CA 1.523 3.191 0 CA-C-O 117.875 -1.059 . . . . 0.0 111.151 178.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 6.1 tp -80.84 -60.04 2.45 Favored 'General case' 0 N--CA 1.529 3.496 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 178.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 38.8 mt -39.11 -37.44 0.39 Allowed 'General case' 1 N--CA 1.549 4.482 0 C-N-CA 126.051 1.74 . . . . 0.0 112.415 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 29.6 mmm180 -83.47 -53.41 5.72 Favored 'General case' 0 N--CA 1.519 3.002 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 79.3 54.02 4.2 Favored Glycine 0 N--CA 1.509 3.537 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 178.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -83.15 -63.02 1.44 Allowed 'General case' 0 N--CA 1.518 2.954 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 178.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 19.0 ttm 176.75 85.29 0.01 OUTLIER 'General case' 1 N--CA 1.539 4.011 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 177.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 58.8 m -141.54 36.24 1.65 Allowed 'General case' 0 N--CA 1.518 2.944 0 C-N-CA 122.706 0.403 . . . . 0.0 111.463 -177.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -100.4 -47.75 4.8 Favored 'General case' 0 N--CA 1.522 3.157 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 177.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 1.9 mmt-85 -107.91 -31.79 7.85 Favored 'General case' 0 N--CA 1.522 3.159 0 C-N-CA 123.787 0.835 . . . . 0.0 112.059 -178.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -92.77 -13.23 29.53 Favored 'General case' 0 N--CA 1.519 2.994 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 -176.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 14.5 tp -75.1 -45.7 39.45 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-N 120.644 1.566 . . . . 0.0 111.348 -177.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.79 -33.49 16.69 Favored 'General case' 1 N--CA 1.547 4.421 0 CA-C-N 119.71 1.141 . . . . 0.0 113.208 -179.913 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -64.97 -36.06 83.19 Favored 'General case' 1 N--CA 1.541 4.082 0 C-N-CA 122.93 0.492 . . . . 0.0 111.566 -178.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -49.2 -57.55 6.54 Favored 'General case' 0 N--CA 1.53 3.546 0 C-N-CA 124.573 1.149 . . . . 0.0 113.141 -178.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -132.96 -38.91 0.97 Allowed 'General case' 0 N--CA 1.534 3.726 0 CA-C-O 118.526 -0.75 . . . . 0.0 111.848 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 130.7 63.67 0.1 OUTLIER Glycine 1 N--CA 1.52 4.271 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 179.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -114.81 98.55 6.91 Favored 'General case' 0 N--CA 1.518 2.934 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -42.16 168.82 0.01 OUTLIER Glycine 1 N--CA 1.541 5.645 0 C-N-CA 125.012 1.292 . . . . 0.0 115.493 -176.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 1.9 mt -83.66 -14.19 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.335 0 CA-C-O 117.61 -1.186 . . . . 0.0 109.002 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -69.86 -36.63 75.67 Favored 'General case' 0 N--CA 1.525 3.313 0 CA-C-N 120.091 1.314 . . . . 0.0 108.973 175.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.1 p -79.49 -36.54 38.51 Favored 'General case' 1 N--CA 1.541 4.109 0 CA-C-N 118.924 0.784 . . . . 0.0 111.825 178.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -69.66 -36.54 71.0 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.414 0 C-N-CA 123.379 0.672 . . . . 0.0 111.736 -175.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 81.4 p -99.57 -28.1 13.38 Favored 'General case' 0 N--CA 1.515 2.777 0 CA-C-O 117.974 -1.012 . . . . 0.0 111.396 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 11.1 ptt180 -75.94 -19.41 58.79 Favored 'General case' 0 N--CA 1.531 3.579 0 CA-C-N 120.081 1.309 . . . . 0.0 108.217 174.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -62.03 -36.42 92.87 Favored Glycine 1 N--CA 1.517 4.052 0 N-CA-C 108.645 -1.782 . . . . 0.0 108.645 175.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 84.3 p -63.3 -36.84 85.0 Favored 'General case' 0 N--CA 1.537 3.89 0 CA-C-N 117.976 0.888 . . . . 0.0 109.792 176.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -56.75 -32.47 65.62 Favored 'General case' 1 N--CA 1.546 4.361 0 C-N-CA 123.638 0.775 . . . . 0.0 111.535 179.094 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 8.7 m -61.39 -41.11 96.59 Favored 'General case' 1 N--CA 1.542 4.174 0 C-N-CA 123.39 0.676 . . . . 0.0 110.527 179.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 51.4 mt -58.93 -45.32 90.66 Favored 'General case' 0 N--CA 1.525 3.286 0 C-N-CA 123.907 0.883 . . . . 0.0 111.11 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? -62.0 -24.49 67.07 Favored 'General case' 1 N--CA 1.539 4.005 0 CA-C-O 118.549 -0.739 . . . . 0.0 112.038 179.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -78.16 -40.38 38.06 Favored 'General case' 0 N--CA 1.516 2.84 0 CA-C-N 118.729 0.695 . . . . 0.0 110.755 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -65.28 159.24 67.66 Favored Pre-proline 0 N--CA 1.537 3.918 0 CA-C-O 118.535 -0.745 . . . . 0.0 112.673 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -79.42 179.76 6.1 Favored 'Trans proline' 0 C--N 1.381 2.257 0 C-N-CA 122.105 1.87 . . . . 0.0 110.834 178.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.2 t -97.25 -27.03 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.083 0 CA-C-O 117.676 -1.154 . . . . 0.0 111.683 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -63.22 -40.52 97.69 Favored 'General case' 0 N--CA 1.515 2.804 0 CA-C-N 120.045 1.293 . . . . 0.0 110.559 -178.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 6.9 mp -98.76 -15.84 19.17 Favored 'General case' 0 N--CA 1.51 2.56 0 C-N-CA 123.388 0.675 . . . . 0.0 111.76 178.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -29.98 69.44 Favored 'General case' 1 N--CA 1.54 4.058 0 N-CA-C 103.328 -2.841 . . . . 0.0 103.328 168.05 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -54.62 -38.24 66.58 Favored 'General case' 0 N--CA 1.52 3.043 0 C-N-CA 124.099 0.96 . . . . 0.0 110.039 174.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 599' ' ' TRP . . . . . . . . . . . . . 45.1 t90 -63.46 -38.11 89.88 Favored 'General case' 0 N--CA 1.534 3.729 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 176.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.6 -34.87 52.88 Favored 'General case' 1 N--CA 1.541 4.077 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 177.019 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -71.69 -38.32 70.6 Favored 'General case' 1 N--CA 1.54 4.073 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 175.287 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -60.11 -23.21 63.67 Favored 'General case' 1 N--CA 1.542 4.137 0 C-N-CA 123.857 0.863 . . . . 0.0 110.815 176.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -115.81 7.11 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.466 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -176.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 73.0 mt -118.88 -61.19 1.68 Allowed 'General case' 0 N--CA 1.529 3.519 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.538 3.934 0 C-N-CA 124.691 1.197 . . . . 0.0 111.681 -178.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 . . . . . 0 N--CA 1.528 3.452 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 29.7 t-105 -46.91 -40.55 14.35 Favored 'General case' 0 N--CA 1.533 3.681 0 C-N-CA 125.081 1.353 . . . . 0.0 110.888 176.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -88.41 -26.6 22.06 Favored 'General case' 0 N--CA 1.531 3.582 0 CA-C-O 118.154 -0.927 . . . . 0.0 111.251 -179.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.2 mtt-85 -56.17 -20.78 19.27 Favored 'General case' 0 N--CA 1.537 3.89 0 CA-C-N 119.618 1.099 . . . . 0.0 108.138 173.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.407 ' HB2' HG22 ' B' ' 555' ' ' VAL . 57.4 t80 -96.3 -34.42 11.6 Favored 'General case' 0 N--CA 1.509 2.518 0 CA-C-O 116.799 -1.572 . . . . 0.0 109.2 171.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 64.5 t -70.69 -63.26 1.01 Allowed 'Isoleucine or valine' 1 N--CA 1.569 5.515 0 CA-C-N 121.713 2.052 . . . . 0.0 110.81 -177.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -55.6 -39.5 70.82 Favored 'General case' 1 N--CA 1.547 4.383 0 CA-C-N 119.006 0.821 . . . . 0.0 110.537 -179.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.84 -31.79 72.64 Favored 'General case' 1 N--CA 1.543 4.188 0 C-N-CA 123.081 0.552 . . . . 0.0 109.558 177.17 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.97 -34.8 78.93 Favored 'General case' 0 N--CA 1.53 3.545 0 CA-C-O 118.747 -0.644 . . . . 0.0 109.741 177.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 54.0 tttt -67.83 -24.67 65.3 Favored 'General case' 0 N--CA 1.526 3.334 0 CA-C-O 118.589 -0.719 . . . . 0.0 111.132 177.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -69.61 -43.38 72.86 Favored 'General case' 1 N--CA 1.541 4.083 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 176.396 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.409 ' HB2' ' N ' ' A' ' 35' ' ' HIS . . . -81.67 -9.6 59.61 Favored 'General case' 0 N--CA 1.501 2.115 0 CA-C-O 118.407 -0.806 . . . . 0.0 110.424 177.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -78.74 -34.72 45.58 Favored 'General case' 0 N--CA 1.525 3.281 0 CA-C-N 120.234 1.379 . . . . 0.0 109.448 179.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 -62.42 -41.27 98.58 Favored 'General case' 0 N--CA 1.537 3.903 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -92.31 -86.95 0.23 Allowed 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 106.927 -1.509 . . . . 0.0 106.927 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.8 p30 148.59 51.98 0.0 OUTLIER 'General case' 1 N--CA 1.561 5.124 0 C-N-CA 128.387 2.675 . . . . 0.0 107.24 177.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.4 mt -111.14 11.7 21.9 Favored 'General case' 0 N--CA 1.526 3.371 0 C-N-CA 124.649 1.179 . . . . 0.0 110.858 -177.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.409 ' N ' ' HB2' ' A' ' 29' ' ' ALA . 54.6 p-80 -84.09 3.84 32.95 Favored 'General case' 0 N--CA 1.507 2.398 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.421 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 20.0 mt -92.16 -50.75 0.29 Allowed Pre-proline 0 N--CA 1.505 2.276 0 CA-C-O 116.868 -1.539 . . . . 0.0 108.348 -176.108 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.421 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 7.3 Cg_exo -62.49 -36.24 66.72 Favored 'Trans proline' 0 C--N 1.395 2.979 0 N-CA-C 106.438 -2.178 . . . . 0.0 106.438 170.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.4 -44.02 79.89 Favored 'General case' 0 N--CA 1.528 3.428 0 C-N-CA 123.881 0.872 . . . . 0.0 110.439 175.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.68 -28.32 58.63 Favored 'General case' 1 N--CA 1.542 4.126 0 N-CA-C 113.96 1.096 . . . . 0.0 113.96 -176.176 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 30.1 p30 -88.39 6.1 39.02 Favored 'General case' 0 N--CA 1.536 3.853 0 CA-C-N 119.845 1.202 . . . . 0.0 112.36 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.85 -43.74 2.55 Favored 'General case' 0 N--CA 1.519 2.999 0 CA-C-N 118.942 0.792 . . . . 0.0 110.003 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -35.76 74.59 Favored 'General case' 0 N--CA 1.534 3.726 0 CA-C-N 119.006 0.821 . . . . 0.0 111.924 -176.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tt -135.3 -77.58 0.44 Allowed 'General case' 0 N--CA 1.504 2.271 0 CA-C-O 118.54 -0.743 . . . . 0.0 110.972 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.1 p -167.24 172.91 3.3 Favored Pre-proline 1 N--CA 1.55 4.559 0 C-N-CA 124.012 0.925 . . . . 0.0 111.284 -177.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -68.68 -18.69 42.33 Favored 'Trans proline' 0 CA--C 1.588 3.207 0 C-N-CA 121.999 1.799 . . . . 0.0 108.761 172.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -63.09 -15.39 56.51 Favored 'General case' 0 N--CA 1.529 3.493 0 CA-C-O 118.303 -0.856 . . . . 0.0 111.196 176.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -67.02 -38.62 86.27 Favored 'General case' 0 N--CA 1.53 3.572 0 CA-C-N 119.344 0.975 . . . . 0.0 108.917 177.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 19.0 ptt180 -86.26 -14.29 44.24 Favored 'General case' 0 N--CA 1.533 3.696 0 CA-C-O 118.229 -0.891 . . . . 0.0 109.775 174.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -73.38 -27.59 61.56 Favored 'General case' 0 N--CA 1.533 3.679 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 173.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.22 -46.59 8.33 Favored 'General case' 0 N--CA 1.509 2.486 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.48 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 18.9 tp -64.01 -23.65 67.41 Favored 'General case' 1 N--CA 1.54 4.054 0 CA-C-N 120.0 1.273 . . . . 0.0 107.714 174.069 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.41 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -67.46 -77.53 0.32 Allowed Glycine 0 N--CA 1.504 3.231 0 C-N-CA 125.449 1.499 . . . . 0.0 111.845 176.669 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.8 m -69.82 -26.66 64.35 Favored 'General case' 0 N--CA 1.538 3.964 0 CA-C-O 118.328 -0.844 . . . . 0.0 113.005 -176.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -70.73 -47.77 58.0 Favored 'General case' 0 N--CA 1.533 3.71 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 178.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 22.7 t -65.8 -18.73 24.45 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.168 0 CA-C-N 120.008 1.277 . . . . 0.0 109.373 174.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.9 mtp180 -72.58 -46.83 52.38 Favored 'General case' 0 N--CA 1.529 3.515 0 CA-C-O 117.555 -1.212 . . . . 0.0 111.826 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.409 ' HB ' HG23 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -74.41 -24.39 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.609 0 CA-C-N 121.147 1.794 . . . . 0.0 111.359 -178.896 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -86.26 -52.46 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.999 0 CA-C-N 120.144 1.338 . . . . 0.0 107.984 -178.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -60.2 -30.53 69.43 Favored 'General case' 0 N--CA 1.529 3.522 0 C-N-CA 123.387 0.675 . . . . 0.0 109.796 178.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -76.6 -33.53 58.42 Favored 'General case' 0 N--CA 1.529 3.501 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 176.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.7 mp -75.8 -24.84 55.96 Favored 'General case' 0 N--CA 1.529 3.514 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 176.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 22.7 mt -76.99 -26.5 53.96 Favored 'General case' 0 N--CA 1.52 3.068 0 C-N-CA 123.774 0.83 . . . . 0.0 109.482 177.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? -77.38 -44.9 27.71 Favored 'General case' 0 N--CA 1.522 3.132 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 179.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.67 52.07 6.76 Favored Glycine 1 N--CA 1.516 4.029 0 CA-C-O 119.239 -0.756 . . . . 0.0 111.607 177.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -95.19 -42.04 8.77 Favored 'General case' 0 N--CA 1.523 3.223 0 CA-C-N 117.888 0.844 . . . . 0.0 109.519 178.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 5.0 ttt 119.95 82.14 0.0 OUTLIER 'General case' 1 N--CA 1.545 4.288 0 C-N-CA 127.61 2.364 . . . . 0.0 105.309 -179.319 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 19.8 m -139.39 49.13 1.83 Allowed 'General case' 0 N--CA 1.514 2.751 0 CA-C-O 122.036 0.922 . . . . 0.0 110.135 -177.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -110.83 -49.13 3.06 Favored 'General case' 0 N--CA 1.52 3.057 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 178.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -91.35 -46.63 7.92 Favored 'General case' 0 N--CA 1.522 3.147 0 C-N-CA 123.776 0.83 . . . . 0.0 109.076 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -76.46 -10.47 59.42 Favored 'General case' 0 N--CA 1.518 2.941 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -179.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 43.0 tp -83.72 -50.94 7.67 Favored 'General case' 0 N--CA 1.531 3.587 0 CA-C-O 117.591 -1.195 . . . . 0.0 113.325 -177.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -37.9 -36.6 0.2 Allowed 'General case' 1 N--CA 1.549 4.506 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 -176.354 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -66.02 -38.32 88.14 Favored 'General case' 1 N--CA 1.542 4.139 0 CA-C-N 118.569 0.622 . . . . 0.0 111.847 -177.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -50.65 -34.09 24.97 Favored 'General case' 0 N--CA 1.532 3.66 0 C-N-CA 124.427 1.091 . . . . 0.0 113.675 -178.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 pp -151.01 -44.52 0.12 Allowed 'General case' 0 N--CA 1.53 3.558 0 CA-C-N 119.045 0.839 . . . . 0.0 112.108 -179.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 114.47 81.68 1.01 Allowed Glycine 1 N--CA 1.517 4.053 0 N-CA-C 110.895 -0.882 . . . . 0.0 110.895 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -106.14 -50.65 3.12 Favored 'General case' 0 N--CA 1.522 3.165 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 177.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 119.2 158.58 10.73 Favored Glycine 1 N--CA 1.516 4.001 0 N-CA-C 110.112 -1.195 . . . . 0.0 110.112 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -81.01 -18.53 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.984 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 177.501 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.78 -36.05 77.83 Favored 'General case' 0 N--CA 1.518 2.928 0 CA-C-O 117.658 -1.163 . . . . 0.0 110.111 177.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 10.5 p -76.77 -50.82 12.64 Favored 'General case' 0 N--CA 1.534 3.739 0 CA-C-N 119.604 1.093 . . . . 0.0 111.895 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.409 HG23 ' HB ' ' A' ' 57' ' ' ILE . 0.1 OUTLIER -64.7 -28.54 45.05 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.038 0 CA-C-O 118.102 -0.951 . . . . 0.0 113.087 -176.833 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 44.4 p -99.77 -29.13 12.8 Favored 'General case' 0 N--CA 1.515 2.81 0 CA-C-N 119.456 1.025 . . . . 0.0 111.294 -178.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.3 ptt180 -73.85 -24.73 59.8 Favored 'General case' 0 N--CA 1.535 3.815 0 CA-C-N 119.651 1.114 . . . . 0.0 108.892 175.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.62 -32.32 82.82 Favored Glycine 1 N--CA 1.519 4.196 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 175.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 6.4 t -65.77 -42.37 90.92 Favored 'General case' 1 N--CA 1.54 4.028 0 CA-C-N 117.899 0.85 . . . . 0.0 110.126 177.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -64.14 -30.29 71.36 Favored 'General case' 0 N--CA 1.537 3.913 0 C-N-CA 123.395 0.678 . . . . 0.0 111.115 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.2 m -67.57 -38.3 83.89 Favored 'General case' 0 N--CA 1.532 3.654 0 C-N-CA 123.355 0.662 . . . . 0.0 110.576 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 21.5 mt -55.73 -44.89 77.97 Favored 'General case' 0 N--CA 1.53 3.564 0 C-N-CA 124.151 0.981 . . . . 0.0 111.387 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -28.29 69.25 Favored 'General case' 1 N--CA 1.542 4.139 0 CA-C-O 118.786 -0.626 . . . . 0.0 111.442 179.868 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -69.91 -39.95 75.86 Favored 'General case' 0 N--CA 1.52 3.033 0 CA-C-N 118.426 0.557 . . . . 0.0 110.849 179.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.44 161.11 6.14 Favored Pre-proline 1 N--CA 1.542 4.127 0 CA-C-O 118.428 -0.796 . . . . 0.0 112.712 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -79.68 156.67 24.55 Favored 'Trans proline' 0 C--N 1.377 2.059 0 C-N-CA 122.077 1.851 . . . . 0.0 110.931 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.6 t -88.8 -27.79 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.096 0 CA-C-O 117.734 -1.127 . . . . 0.0 111.947 -178.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -64.06 -34.93 79.14 Favored 'General case' 0 N--CA 1.516 2.857 0 CA-C-N 120.262 1.392 . . . . 0.0 109.987 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.1 mp -96.94 -19.61 18.68 Favored 'General case' 0 N--CA 1.51 2.538 0 C-N-CA 123.85 0.86 . . . . 0.0 110.776 177.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.29 -33.58 74.93 Favored 'General case' 1 N--CA 1.547 4.387 0 N-CA-C 104.521 -2.399 . . . . 0.0 104.521 169.721 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -51.17 -42.8 61.06 Favored 'General case' 0 N--CA 1.522 3.164 0 C-N-CA 124.535 1.134 . . . . 0.0 110.803 175.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.468 ' HA ' ' HB2' ' A' ' 102' ' ' GLU . 38.3 t90 -63.18 -36.04 82.3 Favored 'General case' 0 N--CA 1.532 3.662 0 N-CA-C 107.637 -1.246 . . . . 0.0 107.637 177.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.5 tt -50.77 -40.9 56.23 Favored 'General case' 0 N--CA 1.537 3.905 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 175.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -69.17 -37.21 78.07 Favored 'General case' 1 N--CA 1.545 4.313 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 176.028 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.468 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 1.3 mm-40 -58.02 -23.23 53.34 Favored 'General case' 1 N--CA 1.545 4.276 0 C-N-CA 123.662 0.785 . . . . 0.0 110.55 175.814 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -122.39 -0.64 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.314 0 CA-C-O 118.28 -0.867 . . . . 0.0 113.007 -176.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -112.31 -59.04 2.06 Favored 'General case' 0 N--CA 1.517 2.919 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 176.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 1 N--CA 1.544 4.225 0 C-N-CA 124.776 1.23 . . . . 0.0 111.714 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 . . . . . 0 N--CA 1.524 3.256 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 519' ' ' TRP . . . . . 0.487 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 64.5 t-105 -47.02 -26.67 1.09 Allowed 'General case' 1 N--CA 1.542 4.137 0 C-N-CA 124.261 1.024 . . . . 0.0 112.588 177.056 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 520' ' ' LEU . . . . . 0.406 ' N ' ' CD2' ' B' ' 520' ' ' LEU . 2.1 mm? -96.13 -28.23 14.68 Favored 'General case' 0 N--CA 1.529 3.494 0 CA-C-O 117.558 -1.21 . . . . 0.0 113.105 -173.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 55.4 ttt180 -61.71 -25.45 67.43 Favored 'General case' 1 N--CA 1.542 4.174 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 170.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . 0.487 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.6 m-85 -77.93 -41.97 34.57 Favored 'General case' 0 N--CA 1.51 2.557 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 174.088 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 86.0 t -65.17 -18.22 23.39 Favored 'Isoleucine or valine' 1 N--CA 1.574 5.775 0 CA-C-N 120.116 1.325 . . . . 0.0 111.918 178.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -78.13 -57.06 3.99 Favored 'General case' 0 N--CA 1.534 3.726 0 CA-C-N 120.406 1.457 . . . . 0.0 107.338 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.1 -24.68 67.28 Favored 'General case' 0 N--CA 1.537 3.881 0 O-C-N 123.248 0.343 . . . . 0.0 110.287 175.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -73.06 -36.77 66.94 Favored 'General case' 0 N--CA 1.516 2.868 0 CA-C-O 118.171 -0.918 . . . . 0.0 109.452 178.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 3.5 tttt -68.42 -22.89 64.59 Favored 'General case' 0 N--CA 1.528 3.455 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.037 178.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -71.91 -44.07 64.3 Favored 'General case' 0 N--CA 1.532 3.647 0 CA-C-N 119.282 0.946 . . . . 0.0 108.809 177.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 529' ' ' ALA . . . . . . . . . . . . . . . -82.13 -13.51 57.12 Favored 'General case' 0 N--CA 1.511 2.575 0 CA-C-O 119.028 -0.51 . . . . 0.0 110.934 178.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -78.51 -30.89 47.38 Favored 'General case' 0 N--CA 1.534 3.742 0 CA-C-N 119.566 1.076 . . . . 0.0 109.65 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -66.1 -44.44 84.34 Favored 'General case' 0 N--CA 1.535 3.793 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 177.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -87.76 -90.31 0.12 Allowed 'General case' 0 N--CA 1.515 2.781 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 176.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.1 p30 156.46 50.08 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.831 0 C-N-CA 127.041 2.136 . . . . 0.0 108.667 176.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 7.8 mt -107.46 5.19 26.99 Favored 'General case' 0 N--CA 1.518 2.961 0 C-N-CA 124.901 1.28 . . . . 0.0 110.569 -178.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 535' ' ' HIS . . . . . . . . . . . . . 50.5 p-80 -77.84 3.73 13.62 Favored 'General case' 0 N--CA 1.522 3.132 0 O-C-N 121.824 -0.548 . . . . 0.0 109.6 174.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 536' ' ' LEU . . . . . 0.428 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 24.5 mt -93.21 -52.57 0.26 Allowed Pre-proline 0 N--CA 1.504 2.264 0 CA-C-O 116.783 -1.58 . . . . 0.0 108.42 -176.055 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 537' ' ' PRO . . . . . 0.428 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 4.8 Cg_exo -60.75 -33.32 93.2 Favored 'Trans proline' 0 C--N 1.397 3.124 0 C-N-CA 122.152 1.901 . . . . 0.0 107.942 171.312 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 7.5 mp -62.01 -49.06 77.54 Favored 'General case' 0 N--CA 1.536 3.865 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 174.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 29.4 mt -70.74 -11.5 60.98 Favored 'General case' 0 N--CA 1.534 3.757 0 CA-C-O 118.311 -0.852 . . . . 0.0 112.374 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -81.3 -15.74 54.54 Favored 'General case' 0 N--CA 1.52 3.072 0 CA-C-O 118.108 -0.949 . . . . 0.0 110.996 177.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -117.68 -30.3 5.5 Favored 'General case' 0 N--CA 1.525 3.325 0 CA-C-N 119.774 1.17 . . . . 0.0 112.497 -177.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 4.6 ptt? -101.64 10.87 39.76 Favored 'General case' 1 N--CA 1.544 4.254 0 CA-C-N 120.286 1.403 . . . . 0.0 112.726 -179.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 1.3 tt -128.72 -95.77 0.41 Allowed 'General case' 0 N--CA 1.528 3.459 0 CA-C-O 117.477 -1.249 . . . . 0.0 112.372 178.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 162.75 177.77 0.03 OUTLIER Pre-proline 1 N--CA 1.585 6.319 0 CA-C-N 120.916 1.689 . . . . 0.0 109.549 -176.698 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -57.09 -21.45 42.49 Favored 'Trans proline' 1 N--CA 1.538 4.104 0 C-N-CA 122.31 2.007 . . . . 0.0 111.225 173.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -64.46 -0.37 1.31 Allowed 'General case' 0 N--CA 1.532 3.632 0 C-N-CA 123.613 0.765 . . . . 0.0 111.47 175.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -55.45 -79.8 0.02 OUTLIER 'General case' 0 N--CA 1.521 3.112 0 CA-C-O 116.608 -1.663 . . . . 0.0 108.632 178.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 25.4 ptt180 -88.07 -8.95 54.76 Favored 'General case' 0 N--CA 1.523 3.198 0 CA-C-N 121.878 2.126 . . . . 0.0 111.976 177.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -68.94 -54.88 12.99 Favored 'General case' 0 N--CA 1.534 3.753 0 CA-C-N 120.569 1.532 . . . . 0.0 107.676 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -85.33 -30.24 23.85 Favored 'General case' 0 N--CA 1.513 2.713 0 CA-C-O 117.843 -1.075 . . . . 0.0 111.809 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 551' ' ' LEU . . . . . . . . . . . . . 14.0 tp -67.88 -36.38 80.16 Favored 'General case' 1 N--CA 1.542 4.171 0 CA-C-N 121.136 1.789 . . . . 0.0 109.787 178.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -74.38 -55.71 5.47 Favored Glycine 0 N--CA 1.496 2.693 0 CA-C-O 118.642 -1.088 . . . . 0.0 112.563 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.6 m -76.74 -22.59 53.62 Favored 'General case' 1 N--CA 1.543 4.22 0 CA-C-N 118.953 1.377 . . . . 0.0 113.588 -176.034 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 554' ' ' ARG . . . . . 0.4 ' O ' HD11 ' B' ' 557' ' ' ILE . 9.7 mpt_? -81.14 -41.9 21.74 Favored 'General case' 0 N--CA 1.538 3.941 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 176.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 555' ' ' VAL . . . . . 0.407 HG22 ' HB2' ' A' ' 22' ' ' PHE . 93.1 t -64.49 -18.54 23.36 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.958 0 O-C-N 121.182 -0.949 . . . . 0.0 108.684 173.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -76.47 -43.45 39.77 Favored 'General case' 0 N--CA 1.522 3.137 0 CA-C-O 116.958 -1.496 . . . . 0.0 111.657 176.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 557' ' ' ILE . . . . . 0.4 HD11 ' O ' ' B' ' 554' ' ' ARG . 0.0 OUTLIER -72.96 -24.01 20.74 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.526 0 CA-C-N 121.938 2.153 . . . . 0.0 110.555 -179.3 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 558' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -82.31 -44.24 19.52 Favored 'Isoleucine or valine' 1 N--CA 1.546 4.336 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 -179.806 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -64.02 -28.78 70.04 Favored 'General case' 0 N--CA 1.528 3.463 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -89.51 -19.34 25.16 Favored 'General case' 0 N--CA 1.525 3.291 0 CA-C-O 118.467 -0.778 . . . . 0.0 110.421 177.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 32.5 tp -76.12 -47.17 25.43 Favored 'General case' 0 N--CA 1.532 3.673 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 1.5 tt -46.98 -33.87 5.07 Favored 'General case' 1 N--CA 1.547 4.385 0 C-N-CA 125.09 1.356 . . . . 0.0 110.972 178.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 19.6 mmm180 -81.4 -58.85 2.85 Favored 'General case' 0 N--CA 1.518 2.973 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 178.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 51.67 37.83 43.05 Favored Glycine 1 N--CA 1.535 5.238 0 C-N-CA 124.322 0.963 . . . . 0.0 112.909 178.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -99.48 -51.8 3.67 Favored 'General case' 0 N--CA 1.519 2.996 0 CA-C-N 117.777 0.789 . . . . 0.0 109.148 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 8.2 ptt? -157.35 44.48 0.36 Allowed 'General case' 0 N--CA 1.53 3.531 0 CA-C-O 121.659 0.742 . . . . 0.0 109.795 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 28.1 m -135.36 37.72 2.93 Favored 'General case' 0 N--CA 1.517 2.922 0 C-N-CA 123.554 0.742 . . . . 0.0 109.793 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -109.84 -54.85 2.51 Favored 'General case' 0 N--CA 1.514 2.741 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -97.37 -43.61 7.23 Favored 'General case' 0 N--CA 1.524 3.272 0 C-N-CA 122.957 0.503 . . . . 0.0 110.998 -179.196 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -79.21 -12.59 59.97 Favored 'General case' 0 N--CA 1.523 3.203 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -177.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 17.9 tp -70.81 -44.11 67.25 Favored 'General case' 0 N--CA 1.532 3.669 0 CA-C-N 119.749 1.159 . . . . 0.0 111.493 -178.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -40.66 -29.6 0.1 Allowed 'General case' 1 N--CA 1.558 4.939 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -179.64 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -69.68 -48.7 58.79 Favored 'General case' 0 N--CA 1.538 3.958 0 CA-C-N 119.04 0.836 . . . . 0.0 109.336 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -55.3 -39.23 69.67 Favored 'General case' 0 N--CA 1.53 3.537 0 C-N-CA 124.908 1.283 . . . . 0.0 112.609 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 42.0 mt -114.34 -60.32 1.9 Allowed 'General case' 0 N--CA 1.53 3.555 0 C-N-CA 122.88 0.472 . . . . 0.0 111.457 -177.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 114.41 28.51 3.0 Favored Glycine 1 N--CA 1.522 4.412 0 CA-C-O 118.495 -1.17 . . . . 0.0 111.307 -178.406 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -101.28 115.94 31.66 Favored 'General case' 0 N--CA 1.517 2.882 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 178.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -38.5 166.26 0.01 OUTLIER Glycine 1 N--CA 1.536 5.358 0 C-N-CA 125.303 1.43 . . . . 0.0 115.414 -177.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -79.78 -17.7 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.963 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 177.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -65.62 -20.08 66.17 Favored 'General case' 0 N--CA 1.519 3.018 0 CA-C-O 116.996 -1.478 . . . . 0.0 111.192 176.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.2 p -101.59 -35.82 8.99 Favored 'General case' 1 N--CA 1.542 4.152 0 CA-C-N 120.811 1.642 . . . . 0.0 111.208 178.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 2.9 tt -66.51 -39.06 83.03 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.565 0 C-N-CA 123.32 0.648 . . . . 0.0 110.575 -177.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 77.8 p -96.08 -19.58 19.32 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 118.301 -0.857 . . . . 0.0 110.437 178.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 10.5 ttp180 -64.69 -31.3 72.47 Favored 'General case' 1 N--CA 1.549 4.503 0 N-CA-C 106.688 -1.597 . . . . 0.0 106.688 172.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -66.46 -36.96 92.27 Favored Glycine 0 N--CA 1.514 3.835 0 N-CA-C 110.215 -1.154 . . . . 0.0 110.215 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 59.7 p -61.85 -30.14 70.65 Favored 'General case' 1 N--CA 1.55 4.537 0 CA-C-N 118.614 1.207 . . . . 0.0 112.407 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -66.93 -28.8 68.59 Favored 'General case' 0 N--CA 1.539 3.977 0 CA-C-N 118.681 0.673 . . . . 0.0 110.624 178.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 14.9 m -64.04 -34.98 79.25 Favored 'General case' 0 N--CA 1.533 3.721 0 C-N-CA 123.512 0.725 . . . . 0.0 111.692 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 13.4 mt -56.36 -41.73 76.63 Favored 'General case' 0 N--CA 1.536 3.831 0 C-N-CA 123.947 0.899 . . . . 0.0 111.776 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.96 -19.57 65.24 Favored 'General case' 1 N--CA 1.543 4.205 0 CA-C-O 118.359 -0.829 . . . . 0.0 112.787 -179.23 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -108.27 -21.92 12.56 Favored 'General case' 0 N--CA 1.521 3.098 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 -178.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -66.36 160.99 62.06 Favored Pre-proline 0 N--CA 1.538 3.972 0 CA-C-N 119.598 1.09 . . . . 0.0 112.424 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -83.82 148.47 12.31 Favored 'Trans proline' 0 C--N 1.379 2.162 0 C-N-CA 122.272 1.981 . . . . 0.0 108.935 178.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -82.91 -28.03 8.12 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.948 0 CA-C-O 117.858 -1.068 . . . . 0.0 112.045 -178.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -61.88 -37.8 85.91 Favored 'General case' 0 N--CA 1.519 3.013 0 CA-C-N 120.183 1.356 . . . . 0.0 110.513 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 6.9 mp -99.84 -17.86 17.43 Favored 'General case' 0 N--CA 1.513 2.679 0 C-N-CA 123.887 0.875 . . . . 0.0 111.269 179.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.12 -36.65 82.41 Favored 'General case' 1 N--CA 1.545 4.301 0 N-CA-C 103.823 -2.658 . . . . 0.0 103.823 170.022 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -56.92 -39.3 74.21 Favored 'General case' 0 N--CA 1.513 2.714 0 C-N-CA 124.405 1.082 . . . . 0.0 111.79 175.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 599' ' ' TRP . . . . . 0.449 ' HA ' ' HB2' ' B' ' 602' ' ' GLU . 63.6 t90 -63.31 -32.76 74.26 Favored 'General case' 0 N--CA 1.531 3.604 0 CA-C-O 117.832 -1.08 . . . . 0.0 108.331 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 46.5 mt -55.3 -37.94 68.0 Favored 'General case' 1 N--CA 1.541 4.077 0 CA-C-N 119.162 0.892 . . . . 0.0 109.167 176.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -73.05 -30.31 63.63 Favored 'General case' 0 N--CA 1.529 3.48 0 O-C-N 123.935 0.772 . . . . 0.0 109.532 176.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 602' ' ' GLU . . . . . 0.449 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.6 OUTLIER -65.17 -27.4 68.68 Favored 'General case' 1 N--CA 1.542 4.137 0 C-N-CA 123.928 0.891 . . . . 0.0 110.076 175.495 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.21 -4.44 11.01 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.245 0 CA-C-O 118.08 -0.962 . . . . 0.0 112.365 -177.081 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -94.39 -59.68 1.89 Allowed 'General case' 0 N--CA 1.512 2.632 0 N-CA-C 104.349 -2.464 . . . . 0.0 104.349 175.263 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.526 3.367 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 176.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 N--CA 1.532 3.664 0 CA-C-O 118.598 -0.715 . . . . 0.0 111.95 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.609 ' HA ' HD21 ' B' ' 551' ' ' LEU . 64.8 t-105 -49.07 -42.53 39.02 Favored 'General case' 0 N--CA 1.527 3.415 0 CA-C-N 119.629 1.104 . . . . 0.0 112.919 -177.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.401 ' N ' ' CD2' ' A' ' 20' ' ' LEU . 2.3 mm? -81.2 -24.7 37.29 Favored 'General case' 0 N--CA 1.528 3.451 0 CA-C-O 117.595 -1.193 . . . . 0.0 112.859 -175.007 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -61.38 -29.53 69.97 Favored 'General case' 0 N--CA 1.532 3.675 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 173.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.407 ' CG ' HD22 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -85.24 -29.76 24.39 Favored 'General case' 0 N--CA 1.519 3.004 0 CA-C-O 116.203 -1.856 . . . . 0.0 109.723 174.913 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 86.1 t -72.79 -31.01 34.84 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.239 0 CA-C-N 121.908 2.14 . . . . 0.0 111.315 -177.289 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -73.82 -49.68 24.04 Favored 'General case' 0 N--CA 1.532 3.633 0 CA-C-N 119.335 0.97 . . . . 0.0 108.5 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.0 mp -70.15 -18.56 63.22 Favored 'General case' 0 N--CA 1.531 3.611 0 CA-C-O 119.515 -0.279 . . . . 0.0 110.323 176.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.09 -33.65 65.72 Favored 'General case' 0 N--CA 1.526 3.33 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 175.256 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -64.51 -22.49 66.98 Favored 'General case' 0 N--CA 1.521 3.084 0 CA-C-O 118.502 -0.761 . . . . 0.0 110.849 175.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -72.51 -46.03 56.56 Favored 'General case' 0 N--CA 1.534 3.757 0 CA-C-N 119.114 0.87 . . . . 0.0 108.864 177.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.93 -10.09 59.76 Favored 'General case' 0 N--CA 1.51 2.537 0 CA-C-O 118.645 -0.693 . . . . 0.0 110.988 178.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -81.01 -34.83 32.6 Favored 'General case' 0 N--CA 1.53 3.565 0 CA-C-N 119.995 1.27 . . . . 0.0 109.061 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -61.4 -40.81 95.74 Favored 'General case' 0 N--CA 1.534 3.757 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 177.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -94.38 -88.66 0.24 Allowed 'General case' 0 N--CA 1.512 2.66 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 177.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.7 p30 151.63 53.32 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.871 0 C-N-CA 127.737 2.415 . . . . 0.0 107.795 177.072 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.5 mt -112.91 9.86 18.91 Favored 'General case' 0 N--CA 1.529 3.518 0 C-N-CA 124.176 0.99 . . . . 0.0 111.246 -178.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.46 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 53.7 p-80 -82.4 4.57 23.56 Favored 'General case' 0 N--CA 1.516 2.827 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 174.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.476 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 19.7 mt -93.75 -52.13 0.25 Allowed Pre-proline 0 N--CA 1.511 2.577 0 CA-C-O 116.892 -1.527 . . . . 0.0 108.689 -176.133 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.476 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 3.5 Cg_exo -65.38 -31.07 52.86 Favored 'Trans proline' 0 C--N 1.392 2.839 0 N-CA-C 106.615 -2.11 . . . . 0.0 106.615 170.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.46 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.1 OUTLIER -65.67 -37.95 87.93 Favored 'General case' 0 N--CA 1.522 3.141 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 175.823 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.46 -19.44 60.95 Favored 'General case' 1 N--CA 1.545 4.295 0 CA-C-N 119.826 1.194 . . . . 0.0 111.083 176.708 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -88.56 9.14 24.97 Favored 'General case' 0 N--CA 1.528 3.445 0 CA-C-N 119.099 0.863 . . . . 0.0 110.785 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -127.33 -49.35 1.42 Allowed 'General case' 0 N--CA 1.522 3.14 0 CA-C-N 119.494 1.043 . . . . 0.0 111.188 -178.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.53 -18.25 27.01 Favored 'General case' 1 N--CA 1.541 4.118 0 CA-C-N 120.113 1.324 . . . . 0.0 112.182 -178.275 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.2 mp -111.86 -87.69 0.54 Allowed 'General case' 0 N--CA 1.501 2.102 0 CA-C-O 117.833 -1.079 . . . . 0.0 108.294 -179.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 160.33 166.62 0.04 OUTLIER Pre-proline 1 N--CA 1.557 4.883 0 C-N-CA 125.148 1.379 . . . . 0.0 109.452 -179.193 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -68.62 -36.64 14.16 Favored 'Trans proline' 0 N--CA 1.512 2.575 0 C-N-CA 122.322 2.015 . . . . 0.0 107.723 173.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -62.52 -23.15 66.81 Favored 'General case' 0 N--CA 1.53 3.561 0 C-N-CA 123.953 0.901 . . . . 0.0 110.533 176.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -71.88 -35.54 69.81 Favored 'General case' 0 N--CA 1.521 3.096 0 CA-C-O 117.539 -1.22 . . . . 0.0 109.772 178.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.8 ptt180 -81.04 -19.2 44.37 Favored 'General case' 1 N--CA 1.539 4.001 0 CA-C-N 119.905 1.23 . . . . 0.0 108.519 174.067 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -68.91 -30.95 69.54 Favored 'General case' 0 N--CA 1.528 3.431 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 173.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -88.57 -29.53 19.95 Favored 'General case' 0 N--CA 1.514 2.735 0 CA-C-O 117.739 -1.124 . . . . 0.0 110.74 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 26.7 tp -73.72 -21.26 60.28 Favored 'General case' 1 N--CA 1.539 4.013 0 CA-C-N 120.875 1.67 . . . . 0.0 106.69 173.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.43 -67.3 1.9 Allowed Glycine 0 N--CA 1.501 3.021 0 C-N-CA 125.26 1.41 . . . . 0.0 110.768 177.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.0 m -67.96 -27.46 66.61 Favored 'General case' 0 N--CA 1.532 3.669 0 CA-C-O 118.102 -0.952 . . . . 0.0 112.366 -178.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 17.1 mtm180 -70.52 -48.01 57.63 Favored 'General case' 0 N--CA 1.531 3.581 0 CA-C-N 119.594 1.088 . . . . 0.0 108.526 178.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.3 t -67.97 -15.71 20.06 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.074 0 O-C-N 120.742 -1.224 . . . . 0.0 109.618 174.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 66.4 mtt-85 -78.25 -42.94 29.64 Favored 'General case' 0 N--CA 1.53 3.557 0 CA-C-N 120.213 1.369 . . . . 0.0 111.565 178.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -24.32 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.6 0 CA-C-N 121.533 1.969 . . . . 0.0 110.379 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -86.94 -51.21 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.928 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 -179.549 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -58.86 -25.14 63.01 Favored 'General case' 0 N--CA 1.536 3.851 0 CA-C-O 118.96 -0.543 . . . . 0.0 110.2 177.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -96.62 -20.94 17.94 Favored 'General case' 0 N--CA 1.525 3.32 0 CA-C-O 118.1 -0.953 . . . . 0.0 111.073 178.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 5.3 mt -73.56 -55.4 6.35 Favored 'General case' 0 N--CA 1.539 3.978 0 CA-C-N 119.799 1.181 . . . . 0.0 108.232 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 42.4 mt -50.58 -30.92 14.41 Favored 'General case' 1 N--CA 1.543 4.2 0 C-N-CA 124.099 0.96 . . . . 0.0 112.434 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 28.6 mmm180 -82.97 -45.52 14.0 Favored 'General case' 0 N--CA 1.525 3.32 0 CA-C-N 118.213 0.46 . . . . 0.0 110.169 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.68 59.34 5.26 Favored Glycine 1 N--CA 1.522 4.383 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -116.36 -52.64 2.57 Favored 'General case' 0 N--CA 1.521 3.104 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 14.0 ptm -162.92 79.86 0.48 Allowed 'General case' 0 N--CA 1.529 3.516 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 96.1 p -133.87 1.62 3.32 Favored 'General case' 0 N--CA 1.518 2.956 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 -176.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -113.93 -63.99 1.37 Allowed 'General case' 0 N--CA 1.532 3.64 0 CA-C-N 120.212 1.369 . . . . 0.0 111.323 -178.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 15.5 mtt180 -103.99 -41.48 5.84 Favored 'General case' 0 N--CA 1.533 3.698 0 CA-C-N 118.525 0.602 . . . . 0.0 110.639 -178.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -74.65 -5.79 45.03 Favored 'General case' 0 N--CA 1.515 2.791 0 CA-C-O 118.389 -0.815 . . . . 0.0 112.82 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 35.2 tp -93.89 -49.5 5.78 Favored 'General case' 0 N--CA 1.527 3.398 0 CA-C-N 120.064 1.302 . . . . 0.0 113.094 -177.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -44.94 -29.46 0.83 Allowed 'General case' 1 N--CA 1.546 4.351 0 CA-C-N 120.026 1.284 . . . . 0.0 114.003 -177.54 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 15.9 t30 -80.48 -38.31 30.14 Favored 'General case' 0 N--CA 1.531 3.621 0 CA-C-O 119.02 -0.514 . . . . 0.0 112.022 -178.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -53.37 -58.83 5.71 Favored 'General case' 0 N--CA 1.532 3.655 0 N-CA-C 114.077 1.139 . . . . 0.0 114.077 -177.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.95 -39.31 2.73 Favored 'General case' 0 N--CA 1.538 3.948 0 CA-C-N 118.993 0.815 . . . . 0.0 111.808 -178.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 125.11 86.05 0.64 Allowed Glycine 1 N--CA 1.523 4.477 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -149.97 104.82 3.33 Favored 'General case' 0 N--CA 1.522 3.146 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 178.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -45.31 169.07 0.03 OUTLIER Glycine 1 N--CA 1.54 5.617 0 C-N-CA 124.268 0.937 . . . . 0.0 114.389 -177.34 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.8 mt -80.35 -13.72 12.98 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.759 0 CA-C-N 119.055 1.427 . . . . 0.0 109.613 179.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.38 -37.26 74.51 Favored 'General case' 0 N--CA 1.524 3.249 0 CA-C-N 120.025 1.284 . . . . 0.0 110.491 177.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 3.2 p -78.97 -44.88 21.49 Favored 'General case' 0 N--CA 1.535 3.809 0 CA-C-N 119.296 0.953 . . . . 0.0 111.563 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.5 pt -70.41 -14.72 18.41 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.873 0 CA-C-O 117.658 -1.163 . . . . 0.0 114.09 -176.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 66.7 p -111.68 -35.78 5.66 Favored 'General case' 0 N--CA 1.517 2.925 0 CA-C-N 120.132 1.333 . . . . 0.0 110.134 178.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -70.17 -23.92 63.06 Favored 'General case' 0 N--CA 1.529 3.515 0 CA-C-N 119.04 0.837 . . . . 0.0 109.357 176.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.26 -32.66 84.51 Favored Glycine 1 N--CA 1.522 4.38 0 N-CA-C 109.336 -1.505 . . . . 0.0 109.336 175.58 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.7 t -70.46 -34.19 72.14 Favored 'General case' 0 N--CA 1.532 3.65 0 CA-C-N 118.146 0.973 . . . . 0.0 110.467 177.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -65.83 -22.78 66.57 Favored 'General case' 0 N--CA 1.535 3.806 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.66 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.1 m -67.38 -37.18 82.76 Favored 'General case' 0 N--CA 1.531 3.624 0 CA-C-N 118.611 0.641 . . . . 0.0 110.539 179.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.0 mt -55.12 -51.79 65.32 Favored 'General case' 0 N--CA 1.525 3.31 0 C-N-CA 124.292 1.037 . . . . 0.0 112.362 -179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 6.7 ptpt -68.46 -9.28 47.68 Favored 'General case' 0 N--CA 1.536 3.84 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 -178.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.23 -44.81 10.59 Favored 'General case' 0 N--CA 1.521 3.089 0 CA-C-N 119.675 1.125 . . . . 0.0 110.262 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.69 167.03 1.11 Allowed Pre-proline 1 N--CA 1.546 4.374 0 CA-C-O 117.861 -1.066 . . . . 0.0 112.088 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -74.31 -179.93 5.23 Favored 'Trans proline' 0 C--N 1.384 2.446 0 C-N-CA 121.055 1.17 . . . . 0.0 110.951 178.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.7 t -102.23 -30.07 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.91 0 CA-C-O 117.506 -1.235 . . . . 0.0 111.683 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -63.02 -40.92 99.21 Favored 'General case' 0 N--CA 1.517 2.907 0 CA-C-N 119.952 1.251 . . . . 0.0 110.839 -177.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.0 mp -97.84 -20.08 17.73 Favored 'General case' 0 N--CA 1.512 2.649 0 C-N-CA 123.417 0.687 . . . . 0.0 111.445 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.59 -28.63 67.92 Favored 'General case' 0 N--CA 1.536 3.866 0 N-CA-C 103.798 -2.668 . . . . 0.0 103.798 169.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -56.76 -39.84 74.76 Favored 'General case' 0 N--CA 1.515 2.822 0 C-N-CA 124.179 0.991 . . . . 0.0 110.046 173.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.414 ' HA ' ' HB2' ' A' ' 102' ' ' GLU . 54.5 t90 -64.66 -34.69 78.89 Favored 'General case' 0 N--CA 1.524 3.267 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.15 -37.57 47.05 Favored 'General case' 1 N--CA 1.542 4.174 0 CA-C-N 119.279 0.945 . . . . 0.0 108.514 175.589 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -69.11 -40.34 78.41 Favored 'General case' 1 N--CA 1.539 4.021 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 175.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.414 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 2.9 mt-10 -58.78 -22.86 59.2 Favored 'General case' 1 N--CA 1.549 4.5 0 C-N-CA 123.499 0.72 . . . . 0.0 111.031 175.893 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -116.44 -2.65 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.508 0 CA-C-O 118.193 -0.908 . . . . 0.0 112.056 -176.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.31 -57.36 2.28 Favored 'General case' 0 N--CA 1.515 2.814 0 N-CA-C 104.176 -2.527 . . . . 0.0 104.176 174.645 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 47.2 mt . . . . . 0 N--CA 1.535 3.804 0 C-N-CA 124.935 1.294 . . . . 0.0 109.411 175.839 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 . . . . . 0 N--CA 1.527 3.422 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 519' ' ' TRP . . . . . 0.417 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 60.7 t-105 -44.33 -26.32 0.32 Allowed 'General case' 1 N--CA 1.551 4.603 0 C-N-CA 124.188 0.995 . . . . 0.0 113.236 178.216 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 520' ' ' LEU . . . . . 0.407 ' CD2' ' N ' ' B' ' 520' ' ' LEU . 2.4 mm? -95.39 -32.18 13.05 Favored 'General case' 0 N--CA 1.523 3.212 0 CA-C-O 117.655 -1.164 . . . . 0.0 113.815 -172.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -63.83 -23.28 67.29 Favored 'General case' 0 N--CA 1.529 3.495 0 N-CA-C 106.047 -1.834 . . . . 0.0 106.047 172.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . 0.417 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.7 m-85 -77.93 -42.06 34.33 Favored 'General case' 0 N--CA 1.505 2.302 0 N-CA-C 106.555 -1.646 . . . . 0.0 106.555 174.082 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 79.0 t -67.34 -20.27 26.41 Favored 'Isoleucine or valine' 1 N--CA 1.563 5.194 0 CA-C-O 117.665 -1.159 . . . . 0.0 112.374 179.008 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -77.15 -54.39 6.58 Favored 'General case' 0 N--CA 1.533 3.713 0 CA-C-N 120.37 1.441 . . . . 0.0 108.43 -178.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 5.1 mp -70.96 -17.42 62.66 Favored 'General case' 0 N--CA 1.527 3.416 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 175.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.08 -38.32 78.95 Favored 'General case' 0 N--CA 1.516 2.828 0 N-CA-C 107.162 -1.421 . . . . 0.0 107.162 175.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 527' ' ' LYS . . . . . 0.635 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 8.4 tptm -68.85 -19.9 64.27 Favored 'General case' 0 N--CA 1.516 2.87 0 CA-C-O 118.029 -0.986 . . . . 0.0 111.473 176.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -66.95 -38.56 86.36 Favored 'General case' 1 N--CA 1.541 4.122 0 CA-C-N 119.798 1.181 . . . . 0.0 108.325 174.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 529' ' ' ALA . . . . . 0.422 ' HB2' ' N ' ' B' ' 535' ' ' HIS . . . -89.37 -14.35 35.77 Favored 'General case' 0 N--CA 1.504 2.272 0 CA-C-O 118.52 -0.752 . . . . 0.0 111.012 177.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 530' ' ' TYR . . . . . 0.635 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.7 OUTLIER -75.9 -32.02 59.46 Favored 'General case' 0 N--CA 1.538 3.974 0 CA-C-N 120.098 1.317 . . . . 0.0 109.683 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -65.09 -44.24 89.5 Favored 'General case' 0 N--CA 1.534 3.755 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 177.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -90.63 -87.47 0.19 Allowed 'General case' 0 N--CA 1.518 2.928 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 177.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.8 p30 152.71 52.88 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.827 0 C-N-CA 127.406 2.282 . . . . 0.0 108.025 177.222 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 5.6 mt -111.45 9.38 21.37 Favored 'General case' 0 N--CA 1.529 3.485 0 C-N-CA 124.718 1.207 . . . . 0.0 110.858 -178.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 535' ' ' HIS . . . . . 0.422 ' N ' ' HB2' ' B' ' 529' ' ' ALA . 47.9 p-80 -83.82 1.66 41.98 Favored 'General case' 0 N--CA 1.517 2.879 0 C-N-CA 123.501 0.72 . . . . 0.0 109.499 175.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 536' ' ' LEU . . . . . 0.427 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 42.8 mt -95.17 -51.01 0.24 Allowed Pre-proline 0 N--CA 1.497 1.878 0 CA-C-O 116.507 -1.711 . . . . 0.0 108.488 -176.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 537' ' ' PRO . . . . . 0.427 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 4.5 Cg_exo -66.94 -33.73 31.91 Favored 'Trans proline' 0 C--N 1.394 2.943 0 N-CA-C 107.51 -1.765 . . . . 0.0 107.51 172.096 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.16 -44.14 93.04 Favored 'General case' 0 N--CA 1.522 3.165 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 175.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 43.3 mt -76.5 -11.38 59.87 Favored 'General case' 0 N--CA 1.535 3.804 0 CA-C-O 118.183 -0.913 . . . . 0.0 112.41 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -83.96 -0.66 52.41 Favored 'General case' 0 N--CA 1.526 3.343 0 CA-C-N 119.56 1.073 . . . . 0.0 109.428 174.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -114.46 -50.09 2.81 Favored 'General case' 0 N--CA 1.51 2.536 0 C-N-CA 124.979 1.312 . . . . 0.0 108.416 -179.312 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 4.7 ptm -95.85 7.55 46.02 Favored 'General case' 0 N--CA 1.534 3.738 0 CA-C-O 118.266 -0.874 . . . . 0.0 112.89 -178.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -130.39 -102.14 0.3 Allowed 'General case' 0 N--CA 1.531 3.612 0 CA-C-N 120.274 1.397 . . . . 0.0 113.187 -179.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 165.04 156.38 0.08 OUTLIER Pre-proline 1 N--CA 1.571 5.621 0 CA-C-N 121.425 1.921 . . . . 0.0 110.562 -178.118 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -74.11 -45.7 0.35 Allowed 'Trans proline' 0 C--N 1.388 2.615 0 C-N-CA 123.194 2.596 . . . . 0.0 110.076 177.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -56.33 -28.22 58.3 Favored 'General case' 1 N--CA 1.54 4.037 0 CA-C-O 118.759 -0.639 . . . . 0.0 112.025 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -75.61 -34.66 60.6 Favored 'General case' 0 N--CA 1.524 3.228 0 CA-C-O 117.766 -1.111 . . . . 0.0 110.927 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 9.5 ptt-85 -71.95 -28.55 63.53 Favored 'General case' 0 N--CA 1.534 3.768 0 CA-C-N 119.902 1.228 . . . . 0.0 109.909 177.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -64.29 -48.61 75.02 Favored 'General case' 1 N--CA 1.54 4.048 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 175.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -76.83 -8.91 58.22 Favored 'General case' 0 N--CA 1.52 3.064 0 CA-C-O 118.155 -0.926 . . . . 0.0 111.398 177.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 551' ' ' LEU . . . . . 0.609 HD21 ' HA ' ' A' ' 19' ' ' TRP . 4.2 tp -78.88 -40.38 32.54 Favored 'General case' 0 N--CA 1.519 3.02 0 CA-C-N 120.141 1.337 . . . . 0.0 108.143 176.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -73.85 -42.47 38.18 Favored Glycine 0 N--CA 1.513 3.797 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 3.3 m -71.38 -35.45 71.09 Favored 'General case' 0 N--CA 1.532 3.633 0 CA-C-N 117.612 0.706 . . . . 0.0 110.878 -178.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -67.54 -45.68 74.98 Favored 'General case' 0 N--CA 1.537 3.883 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 177.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 44.0 t -66.55 -17.87 23.22 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.059 0 CA-C-O 117.703 -1.141 . . . . 0.0 109.622 175.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -81.83 -40.08 23.03 Favored 'General case' 0 N--CA 1.519 2.985 0 CA-C-O 116.943 -1.503 . . . . 0.0 111.703 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 557' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.02 -23.82 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.31 0 CA-C-N 122.277 2.308 . . . . 0.0 109.955 179.057 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 558' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -85.56 -48.0 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.981 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -61.93 -22.46 65.63 Favored 'General case' 0 N--CA 1.532 3.626 0 CA-C-O 118.801 -0.619 . . . . 0.0 109.856 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -87.79 -29.98 20.59 Favored 'General case' 0 N--CA 1.522 3.159 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 13.5 mt -66.4 -46.58 76.1 Favored 'General case' 1 N--CA 1.542 4.144 0 CA-C-N 118.9 0.773 . . . . 0.0 109.305 178.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 33.1 mt -54.41 -27.02 33.95 Favored 'General case' 0 N--CA 1.537 3.906 0 C-N-CA 123.685 0.794 . . . . 0.0 111.762 178.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 1.9 mmm-85 -79.78 -52.07 8.39 Favored 'General case' 0 N--CA 1.526 3.348 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 59.62 72.07 0.67 Allowed Glycine 1 N--CA 1.527 4.728 0 CA-C-O 119.341 -0.699 . . . . 0.0 112.833 178.001 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -145.76 -56.31 0.3 Allowed 'General case' 0 N--CA 1.525 3.305 0 N-CA-C 108.558 -0.905 . . . . 0.0 108.558 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 46.2 mtt -144.59 61.41 1.33 Allowed 'General case' 0 N--CA 1.526 3.363 0 N-CA-C 106.174 -1.787 . . . . 0.0 106.174 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 65.0 m -131.12 4.26 4.41 Favored 'General case' 0 N--CA 1.52 3.027 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -175.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -96.03 -80.15 0.43 Allowed 'General case' 0 N--CA 1.524 3.241 0 CA-C-N 119.81 1.186 . . . . 0.0 110.28 -179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.62 -34.3 11.0 Favored 'General case' 0 N--CA 1.539 3.996 0 CA-C-N 119.578 1.081 . . . . 0.0 111.515 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -70.45 -10.1 58.25 Favored 'General case' 0 N--CA 1.518 2.971 0 CA-C-O 118.358 -0.83 . . . . 0.0 112.793 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 14.8 tp -89.6 -43.67 10.61 Favored 'General case' 0 N--CA 1.527 3.395 0 CA-C-N 119.767 1.167 . . . . 0.0 111.106 -178.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -38.48 -32.31 0.07 Allowed 'General case' 1 N--CA 1.558 4.939 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 -178.96 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -74.27 -46.95 38.08 Favored 'General case' 0 N--CA 1.529 3.507 0 CA-C-N 118.183 0.447 . . . . 0.0 110.278 -179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -46.81 -45.8 20.31 Favored 'General case' 0 N--CA 1.534 3.769 0 C-N-CA 124.94 1.296 . . . . 0.0 113.891 -178.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 1.8 pp -132.39 -44.04 0.93 Allowed 'General case' 0 N--CA 1.535 3.813 0 CA-C-N 118.68 0.673 . . . . 0.0 112.067 -178.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 109.69 81.65 1.28 Allowed Glycine 1 N--CA 1.525 4.603 0 N-CA-C 110.975 -0.85 . . . . 0.0 110.975 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -111.06 -50.99 2.9 Favored 'General case' 0 N--CA 1.522 3.161 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 114.16 163.36 14.74 Favored Glycine 1 N--CA 1.528 4.787 0 N-CA-C 110.219 -1.152 . . . . 0.0 110.219 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -82.9 -21.02 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.377 0 CA-C-N 119.54 1.67 . . . . 0.0 108.229 177.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -68.88 -54.58 14.78 Favored 'General case' 0 N--CA 1.519 2.979 0 CA-C-N 119.578 1.081 . . . . 0.0 109.57 177.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -69.26 -36.75 77.43 Favored 'General case' 1 N--CA 1.539 4.018 0 CA-C-N 118.662 0.665 . . . . 0.0 112.699 -179.026 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 2.1 tt -64.3 -38.18 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.874 0 CA-C-N 118.543 0.61 . . . . 0.0 110.682 -177.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 80.6 p -98.98 -8.75 24.97 Favored 'General case' 0 N--CA 1.509 2.499 0 CA-C-O 118.604 -0.712 . . . . 0.0 111.023 178.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 10.3 ttp180 -72.95 -36.95 67.26 Favored 'General case' 0 N--CA 1.538 3.934 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 174.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -63.32 -38.44 96.44 Favored Glycine 1 N--CA 1.52 4.288 0 N-CA-C 109.075 -1.61 . . . . 0.0 109.075 176.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 19.6 m -58.75 -41.23 86.03 Favored 'General case' 1 N--CA 1.543 4.186 0 C-N-CA 123.217 0.607 . . . . 0.0 111.196 178.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -63.39 -32.47 73.9 Favored 'General case' 1 N--CA 1.539 4.009 0 C-N-CA 123.268 0.627 . . . . 0.0 111.026 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 15.7 m -68.2 -42.05 80.46 Favored 'General case' 0 N--CA 1.534 3.735 0 C-N-CA 123.059 0.544 . . . . 0.0 109.833 178.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 22.1 mt -58.9 -41.06 86.32 Favored 'General case' 0 N--CA 1.53 3.535 0 C-N-CA 124.387 1.075 . . . . 0.0 111.601 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -65.62 -27.08 68.13 Favored 'General case' 0 N--CA 1.539 3.979 0 CA-C-O 118.575 -0.726 . . . . 0.0 112.427 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -95.49 -25.0 16.4 Favored 'General case' 0 N--CA 1.523 3.195 0 CA-C-O 118.524 -0.751 . . . . 0.0 112.606 -179.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -61.59 164.31 9.78 Favored Pre-proline 0 N--CA 1.537 3.903 0 CA-C-N 119.132 0.878 . . . . 0.0 111.758 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -77.48 146.91 24.88 Favored 'Trans proline' 0 C--N 1.381 2.26 0 C-N-CA 121.751 1.634 . . . . 0.0 108.84 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 594' ' ' VAL . . . . . 0.461 ' HA ' ' HB3' ' B' ' 597' ' ' ARG . 2.8 t -80.95 -25.55 10.78 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.826 0 CA-C-O 117.514 -1.232 . . . . 0.0 112.64 -177.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -63.74 -38.42 91.02 Favored 'General case' 0 N--CA 1.519 3.003 0 CA-C-N 120.386 1.448 . . . . 0.0 110.783 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 6.8 mp -99.68 -18.01 17.49 Favored 'General case' 0 N--CA 1.513 2.689 0 C-N-CA 123.958 0.903 . . . . 0.0 111.064 179.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . 0.461 ' HB3' ' HA ' ' B' ' 594' ' ' VAL . 0.0 OUTLIER -63.66 -32.49 73.99 Favored 'General case' 1 N--CA 1.547 4.376 0 N-CA-C 103.635 -2.728 . . . . 0.0 103.635 168.69 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -59.19 -38.77 80.65 Favored 'General case' 0 N--CA 1.521 3.116 0 C-N-CA 125.081 1.352 . . . . 0.0 110.835 174.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 599' ' ' TRP . . . . . . . . . . . . . 48.0 t90 -59.4 -34.48 72.5 Favored 'General case' 0 N--CA 1.535 3.776 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 75.6 mt -52.91 -39.86 63.1 Favored 'General case' 0 N--CA 1.539 3.998 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 177.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -70.73 -33.31 70.71 Favored 'General case' 0 N--CA 1.529 3.478 0 O-C-N 123.927 0.767 . . . . 0.0 109.399 176.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -61.71 -23.68 66.28 Favored 'General case' 1 N--CA 1.546 4.374 0 C-N-CA 123.473 0.709 . . . . 0.0 109.858 174.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -117.7 10.47 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.708 0 C-N-CA 123.766 0.826 . . . . 0.0 112.352 -177.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -115.36 -57.82 2.2 Favored 'General case' 0 N--CA 1.512 2.634 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 177.334 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 4.9 tt . . . . . 0 N--CA 1.539 3.996 0 C-N-CA 125.281 1.432 . . . . 0.0 111.689 179.991 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 . . . . . 0 N--CA 1.519 2.988 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.551 ' CE3' ' HG ' ' B' ' 551' ' ' LEU . 71.2 t-105 -52.31 -25.19 8.93 Favored 'General case' 0 N--CA 1.538 3.931 0 CA-C-O 118.083 -0.961 . . . . 0.0 111.794 177.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -90.2 -30.76 17.38 Favored 'General case' 0 N--CA 1.53 3.573 0 CA-C-O 118.253 -0.88 . . . . 0.0 112.153 -176.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.06 -27.47 68.92 Favored 'General case' 0 N--CA 1.534 3.735 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 173.452 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.538 ' HB3' HD22 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -88.28 -28.5 21.04 Favored 'General case' 0 N--CA 1.511 2.62 0 CA-C-O 116.359 -1.782 . . . . 0.0 108.245 174.968 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 69.5 t -72.15 -22.89 21.26 Favored 'Isoleucine or valine' 1 N--CA 1.567 5.393 0 CA-C-N 122.241 2.291 . . . . 0.0 111.045 179.286 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -77.93 -51.46 10.37 Favored 'General case' 0 N--CA 1.53 3.536 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 178.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.61 -27.79 69.48 Favored 'General case' 0 N--CA 1.536 3.83 0 O-C-N 123.267 0.354 . . . . 0.0 110.609 176.555 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.95 -33.25 63.84 Favored 'General case' 0 N--CA 1.524 3.274 0 CA-C-O 118.214 -0.898 . . . . 0.0 109.033 177.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -68.98 -24.09 64.19 Favored 'General case' 0 N--CA 1.524 3.261 0 CA-C-O 118.378 -0.82 . . . . 0.0 110.74 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -73.44 -43.32 60.61 Favored 'General case' 0 N--CA 1.533 3.722 0 CA-C-N 119.166 0.894 . . . . 0.0 108.893 177.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.453 ' HB2' ' N ' ' A' ' 35' ' ' HIS . . . -85.85 -8.64 57.94 Favored 'General case' 0 N--CA 1.508 2.463 0 CA-C-O 118.314 -0.85 . . . . 0.0 110.71 178.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -80.16 -27.45 39.0 Favored 'General case' 0 N--CA 1.53 3.55 0 CA-C-N 120.032 1.287 . . . . 0.0 107.672 177.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -62.53 -48.84 77.76 Favored 'General case' 0 N--CA 1.531 3.602 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 176.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -91.82 -89.92 0.18 Allowed 'General case' 0 N--CA 1.514 2.738 0 N-CA-C 106.29 -1.744 . . . . 0.0 106.29 177.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 p30 156.18 50.16 0.0 OUTLIER 'General case' 1 N--CA 1.555 4.805 0 C-N-CA 127.489 2.316 . . . . 0.0 107.809 177.493 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.7 mt -107.05 10.36 30.29 Favored 'General case' 0 N--CA 1.53 3.525 0 C-N-CA 124.644 1.178 . . . . 0.0 110.606 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.491 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 42.2 p-80 -85.06 5.14 30.8 Favored 'General case' 0 N--CA 1.507 2.38 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 175.3 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.438 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 26.5 mt -93.95 -51.47 0.26 Allowed Pre-proline 0 N--CA 1.506 2.361 0 CA-C-O 116.8 -1.572 . . . . 0.0 108.773 -176.13 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.438 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 4.0 Cg_exo -65.57 -34.5 41.96 Favored 'Trans proline' 0 C--N 1.397 3.13 0 N-CA-C 106.1 -2.308 . . . . 0.0 106.1 170.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.491 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.3 OUTLIER -63.27 -37.7 88.26 Favored 'General case' 0 N--CA 1.518 2.938 0 C-N-CA 124.078 0.951 . . . . 0.0 109.337 176.363 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.43 -25.89 62.51 Favored 'General case' 1 N--CA 1.551 4.579 0 CA-C-N 120.06 1.3 . . . . 0.0 110.186 176.945 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -72.36 -19.28 61.65 Favored 'General case' 0 N--CA 1.526 3.354 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.366 177.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.5 pp -101.48 -46.32 5.02 Favored 'General case' 0 N--CA 1.53 3.527 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 -177.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 6.2 ptp -105.23 -2.29 24.28 Favored 'General case' 1 N--CA 1.54 4.05 0 CA-C-O 117.994 -1.003 . . . . 0.0 112.332 -176.259 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.43 -87.01 0.53 Allowed 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 117.843 -1.075 . . . . 0.0 109.065 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 154.55 163.4 0.0 OUTLIER Pre-proline 1 N--CA 1.564 5.256 0 C-N-CA 125.71 1.604 . . . . 0.0 109.888 179.672 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -71.84 -36.59 6.02 Favored 'Trans proline' 0 C--N 1.383 2.36 0 C-N-CA 122.827 2.351 . . . . 0.0 108.033 173.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -70.43 -16.61 62.96 Favored 'General case' 0 N--CA 1.525 3.288 0 CA-C-O 117.928 -1.034 . . . . 0.0 110.536 176.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -71.57 -35.25 70.52 Favored 'General case' 0 N--CA 1.527 3.415 0 CA-C-N 119.629 1.104 . . . . 0.0 108.364 176.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 10.1 ptt180 -85.5 -19.23 31.51 Favored 'General case' 0 N--CA 1.527 3.405 0 CA-C-O 118.477 -0.773 . . . . 0.0 109.549 175.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -70.01 -33.0 71.45 Favored 'General case' 0 N--CA 1.534 3.727 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 174.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -88.7 -31.56 18.41 Favored 'General case' 0 N--CA 1.506 2.359 0 CA-C-O 117.719 -1.134 . . . . 0.0 110.094 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.487 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 12.3 tp -70.58 -23.28 62.56 Favored 'General case' 0 N--CA 1.535 3.818 0 CA-C-N 120.856 1.662 . . . . 0.0 107.588 175.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.97 -69.97 1.31 Allowed Glycine 0 N--CA 1.502 3.089 0 C-N-CA 124.802 1.191 . . . . 0.0 111.181 176.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.9 m -67.09 -24.7 65.97 Favored 'General case' 1 N--CA 1.542 4.145 0 CA-C-N 117.897 0.848 . . . . 0.0 112.505 -177.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 84.0 mtt180 -70.0 -50.51 40.87 Favored 'General case' 0 N--CA 1.527 3.401 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 176.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 23.1 t -63.53 -17.77 20.73 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.103 0 CA-C-O 118.073 -0.965 . . . . 0.0 110.209 175.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 57.4 mtt-85 -70.8 -56.36 6.5 Favored 'General case' 0 N--CA 1.528 3.427 0 CA-C-N 119.635 1.107 . . . . 0.0 111.09 177.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.76 -24.48 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.91 0 CA-C-N 119.871 1.214 . . . . 0.0 112.202 -177.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -83.26 -48.91 17.17 Favored 'Isoleucine or valine' 1 N--CA 1.55 4.531 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 -179.803 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -63.13 -21.78 66.42 Favored 'General case' 0 N--CA 1.528 3.458 0 CA-C-O 118.693 -0.67 . . . . 0.0 110.418 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -90.65 -23.76 20.68 Favored 'General case' 0 N--CA 1.529 3.505 0 CA-C-O 118.137 -0.935 . . . . 0.0 110.27 177.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 14.5 tp -81.57 -53.09 6.55 Favored 'General case' 0 N--CA 1.522 3.132 0 CA-C-N 119.515 1.052 . . . . 0.0 109.12 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 28.9 mt -48.12 -29.58 3.76 Favored 'General case' 1 N--CA 1.541 4.117 0 C-N-CA 124.99 1.316 . . . . 0.0 112.96 -178.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 19.5 mmm-85 -89.98 -42.24 11.28 Favored 'General case' 0 N--CA 1.528 3.447 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.07 85.37 0.76 Allowed Glycine 0 N--CA 1.513 3.783 0 N-CA-C 110.071 -1.211 . . . . 0.0 110.071 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -156.7 -57.56 0.09 Allowed 'General case' 0 N--CA 1.521 3.103 0 CA-C-N 117.398 0.599 . . . . 0.0 110.546 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 36.1 mtt -139.49 80.65 1.79 Allowed 'General case' 0 N--CA 1.513 2.675 0 CA-C-O 121.976 0.893 . . . . 0.0 108.939 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.3 t -135.53 2.92 3.0 Favored 'General case' 0 N--CA 1.525 3.299 0 CA-C-N 115.582 -0.735 . . . . 0.0 112.747 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -120.41 -77.88 0.59 Allowed 'General case' 0 N--CA 1.525 3.322 0 CA-C-N 119.912 1.233 . . . . 0.0 113.147 -178.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -103.53 -44.21 5.18 Favored 'General case' 0 N--CA 1.53 3.556 0 CA-C-N 119.336 0.971 . . . . 0.0 112.019 -176.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -71.81 -9.8 58.83 Favored 'General case' 0 N--CA 1.513 2.703 0 CA-C-O 117.761 -1.114 . . . . 0.0 112.553 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 24.4 tp -80.79 -52.24 7.74 Favored 'General case' 0 N--CA 1.523 3.223 0 CA-C-N 120.185 1.357 . . . . 0.0 112.273 -178.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -43.81 -30.87 0.72 Allowed 'General case' 1 N--CA 1.547 4.414 0 CA-C-N 119.353 0.979 . . . . 0.0 113.358 -177.809 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -82.28 -38.66 24.07 Favored 'General case' 0 N--CA 1.527 3.377 0 CA-C-O 118.795 -0.621 . . . . 0.0 111.551 -178.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -47.34 -56.77 6.21 Favored 'General case' 1 N--CA 1.539 4.004 0 C-N-CA 124.365 1.066 . . . . 0.0 113.155 -178.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -124.03 -43.35 2.1 Favored 'General case' 0 N--CA 1.534 3.747 0 CA-C-O 118.777 -0.63 . . . . 0.0 111.088 -179.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 128.9 76.8 0.19 Allowed Glycine 1 N--CA 1.521 4.31 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -140.12 114.22 9.02 Favored 'General case' 0 N--CA 1.52 3.072 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 178.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -47.06 171.43 0.03 OUTLIER Glycine 1 N--CA 1.542 5.748 0 C-N-CA 124.202 0.906 . . . . 0.0 113.781 -178.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -81.7 -18.77 11.27 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.684 0 CA-C-N 118.871 1.336 . . . . 0.0 108.404 178.473 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.39 -45.78 78.85 Favored 'General case' 0 N--CA 1.52 3.036 0 CA-C-N 119.972 1.26 . . . . 0.0 110.774 177.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -72.57 -39.31 67.53 Favored 'General case' 0 N--CA 1.536 3.83 0 CA-C-N 119.335 0.97 . . . . 0.0 112.524 -178.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.1 pt -71.33 -26.03 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.968 0 CA-C-N 119.255 0.934 . . . . 0.0 111.541 -179.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 73.1 p -102.2 -4.69 25.38 Favored 'General case' 0 N--CA 1.517 2.895 0 CA-C-N 119.125 0.875 . . . . 0.0 110.228 174.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -80.13 -33.02 38.95 Favored 'General case' 0 N--CA 1.533 3.689 0 N-CA-C 105.506 -2.035 . . . . 0.0 105.506 172.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -66.57 -28.59 73.83 Favored Glycine 1 N--CA 1.524 4.543 0 CA-C-O 118.407 -1.219 . . . . 0.0 110.634 176.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 90.7 p -64.21 -21.03 66.42 Favored 'General case' 1 N--CA 1.542 4.174 0 CA-C-N 119.015 1.407 . . . . 0.0 111.339 177.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -55.33 -23.42 23.69 Favored 'General case' 1 N--CA 1.544 4.244 0 CA-C-N 118.659 0.663 . . . . 0.0 110.549 176.055 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 78.5 p -45.33 -48.79 13.19 Favored 'General case' 1 N--CA 1.546 4.358 0 C-N-CA 125.709 1.603 . . . . 0.0 111.743 178.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.9 mt -67.69 -39.67 84.41 Favored 'General case' 0 N--CA 1.522 3.169 0 C-N-CA 124.195 0.998 . . . . 0.0 110.703 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.15 0.25 55.59 Favored 'General case' 0 N--CA 1.53 3.566 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -178.285 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -125.04 -61.88 1.26 Allowed 'General case' 0 N--CA 1.523 3.215 0 CA-C-N 120.218 1.372 . . . . 0.0 110.449 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.1 161.6 6.89 Favored Pre-proline 1 N--CA 1.54 4.066 0 C-N-CA 123.755 0.822 . . . . 0.0 113.146 -179.467 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.403 ' O ' ' HB2' ' A' ' 97' ' ' ARG . 41.3 Cg_endo -80.73 -179.14 4.92 Favored 'Trans proline' 0 C--N 1.38 2.214 0 C-N-CA 121.886 1.724 . . . . 0.0 110.437 178.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.1 t -99.67 -27.23 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.283 0 CA-C-O 117.864 -1.065 . . . . 0.0 111.65 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -61.73 -39.81 92.86 Favored 'General case' 0 N--CA 1.522 3.144 0 CA-C-N 119.989 1.268 . . . . 0.0 111.035 -178.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.6 mp -97.77 -18.11 18.98 Favored 'General case' 0 N--CA 1.511 2.624 0 C-N-CA 123.882 0.873 . . . . 0.0 110.817 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -62.37 -37.66 86.58 Favored 'General case' 1 N--CA 1.544 4.256 0 N-CA-C 103.826 -2.657 . . . . 0.0 103.826 168.725 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -53.83 -39.66 65.74 Favored 'General case' 0 N--CA 1.516 2.828 0 C-N-CA 125.102 1.361 . . . . 0.0 111.289 174.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 45.7 t90 -59.54 -36.59 76.43 Favored 'General case' 0 N--CA 1.533 3.703 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 44.3 mt -53.11 -40.2 63.98 Favored 'General case' 1 N--CA 1.546 4.35 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 176.502 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -68.85 -34.4 75.42 Favored 'General case' 0 N--CA 1.526 3.332 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 176.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -61.45 -25.42 67.22 Favored 'General case' 1 N--CA 1.548 4.433 0 C-N-CA 123.655 0.782 . . . . 0.0 110.051 174.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -116.79 6.14 7.2 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.34 0 C-N-CA 124.147 0.979 . . . . 0.0 112.093 -177.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 29.2 mt -112.68 -61.56 1.71 Allowed 'General case' 0 N--CA 1.521 3.098 0 N-CA-C 106.091 -1.818 . . . . 0.0 106.091 176.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.4 tp . . . . . 0 N--CA 1.535 3.794 0 C-N-CA 125.138 1.375 . . . . 0.0 111.787 178.811 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 . . . . . 0 N--CA 1.52 3.043 0 CA-C-O 119.145 -0.455 . . . . 0.0 110.976 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 519' ' ' TRP . . . . . . . . . . . . . 69.0 t-105 -36.37 -55.28 0.82 Allowed 'General case' 1 N--CA 1.55 4.552 0 C-N-CA 124.951 1.3 . . . . 0.0 114.033 -176.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 520' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -73.85 -24.76 59.81 Favored 'General case' 0 N--CA 1.533 3.709 0 CA-C-O 117.275 -1.345 . . . . 0.0 114.518 -175.347 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.65 -25.71 64.96 Favored 'General case' 0 N--CA 1.534 3.752 0 N-CA-C 105.626 -1.99 . . . . 0.0 105.626 172.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . 0.487 ' CD2' ' HG ' ' A' ' 51' ' ' LEU . 3.2 m-85 -76.46 -35.25 58.56 Favored 'General case' 0 N--CA 1.515 2.814 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 172.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 80.1 t -69.09 -19.24 23.58 Favored 'Isoleucine or valine' 1 N--CA 1.55 4.526 0 CA-C-O 117.599 -1.191 . . . . 0.0 111.025 176.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -73.23 -52.53 13.7 Favored 'General case' 0 N--CA 1.535 3.81 0 CA-C-N 120.614 1.552 . . . . 0.0 107.985 -179.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 5.4 mp -67.98 -23.88 65.08 Favored 'General case' 0 N--CA 1.531 3.619 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 175.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.1 -34.17 77.04 Favored 'General case' 0 N--CA 1.522 3.138 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 175.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -69.31 -26.84 64.93 Favored 'General case' 0 N--CA 1.518 2.958 0 CA-C-O 118.297 -0.858 . . . . 0.0 110.385 176.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -67.98 -37.16 81.17 Favored 'General case' 0 N--CA 1.534 3.758 0 CA-C-N 119.125 0.875 . . . . 0.0 109.16 176.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 529' ' ' ALA . . . . . 0.427 ' HB2' ' N ' ' B' ' 535' ' ' HIS . . . -91.62 -8.74 46.4 Favored 'General case' 0 CA--C 1.582 2.187 0 CA-C-O 118.369 -0.825 . . . . 0.0 110.476 178.048 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.11 -33.62 33.16 Favored 'General case' 0 N--CA 1.533 3.716 0 CA-C-N 120.468 1.486 . . . . 0.0 108.977 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -62.14 -44.43 96.65 Favored 'General case' 0 N--CA 1.535 3.808 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 177.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 -89.74 -86.72 0.19 Allowed 'General case' 0 N--CA 1.522 3.148 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 177.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.9 p30 151.7 48.79 0.0 OUTLIER 'General case' 1 N--CA 1.559 5.023 0 C-N-CA 127.426 2.291 . . . . 0.0 108.688 177.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 6.5 mt -108.45 12.54 26.13 Favored 'General case' 0 N--CA 1.524 3.273 0 C-N-CA 124.665 1.186 . . . . 0.0 110.276 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 535' ' ' HIS . . . . . 0.427 ' N ' ' HB2' ' B' ' 529' ' ' ALA . 46.9 p-80 -83.93 4.38 29.88 Favored 'General case' 0 N--CA 1.516 2.829 0 C-N-CA 123.595 0.758 . . . . 0.0 109.076 175.362 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 536' ' ' LEU . . . . . 0.433 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 35.5 mt -97.12 -49.61 0.23 Allowed Pre-proline 0 N--CA 1.506 2.365 0 CA-C-O 116.526 -1.702 . . . . 0.0 109.125 -175.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 537' ' ' PRO . . . . . 0.433 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 2.9 Cg_exo -67.69 -34.38 25.12 Favored 'Trans proline' 0 C--N 1.394 2.963 0 C-N-CA 122.386 2.057 . . . . 0.0 107.417 171.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.78 -47.12 79.3 Favored 'General case' 0 N--CA 1.523 3.185 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 176.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 76.4 mt -77.67 -6.59 54.39 Favored 'General case' 0 N--CA 1.533 3.71 0 CA-C-O 118.702 -0.666 . . . . 0.0 111.228 178.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -63.76 -30.65 71.73 Favored 'General case' 0 N--CA 1.532 3.648 0 CA-C-N 119.584 1.084 . . . . 0.0 109.52 176.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -104.31 -50.9 3.23 Favored 'General case' 0 N--CA 1.509 2.489 0 CA-C-O 118.63 -0.7 . . . . 0.0 109.942 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 9.9 ptp -82.51 17.91 1.64 Allowed 'General case' 0 N--CA 1.533 3.698 0 CA-C-N 118.938 0.79 . . . . 0.0 112.859 -177.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 7.6 tp -138.85 -73.71 0.39 Allowed 'General case' 0 N--CA 1.528 3.428 0 CA-C-N 119.674 1.124 . . . . 0.0 111.542 174.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 66.5 p 116.73 152.82 0.0 OUTLIER Pre-proline 1 N--CA 1.571 5.591 0 C-N-CA 127.947 2.499 . . . . 0.0 111.02 -179.178 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -69.57 -40.91 5.03 Favored 'Trans proline' 0 C--N 1.396 3.052 0 C-N-CA 123.027 2.485 . . . . 0.0 110.04 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -57.9 -29.47 65.11 Favored 'General case' 1 N--CA 1.543 4.195 0 C-N-CA 123.422 0.689 . . . . 0.0 110.773 178.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -75.05 -36.54 61.82 Favored 'General case' 0 N--CA 1.521 3.116 0 CA-C-O 118.279 -0.867 . . . . 0.0 108.744 177.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 35.3 ptt180 -83.26 3.7 30.13 Favored 'General case' 0 N--CA 1.531 3.623 0 CA-C-N 118.993 0.815 . . . . 0.0 111.036 174.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -85.09 -48.96 8.67 Favored 'General case' 0 N--CA 1.519 2.99 0 N-CA-C 102.663 -3.088 . . . . 0.0 102.663 170.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -77.52 -11.91 59.91 Favored 'General case' 0 N--CA 1.504 2.253 0 CA-C-O 116.947 -1.501 . . . . 0.0 112.357 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 551' ' ' LEU . . . . . 0.551 ' HG ' ' CE3' ' A' ' 19' ' ' TRP . 0.0 OUTLIER -75.32 -39.02 59.91 Favored 'General case' 1 N--CA 1.54 4.032 0 CA-C-N 121.559 1.982 . . . . 0.0 106.457 174.682 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -66.6 -56.23 14.16 Favored Glycine 0 N--CA 1.495 2.629 0 N-CA-C 109.021 -1.632 . . . . 0.0 109.021 -178.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.6 m -64.57 -30.52 71.55 Favored 'General case' 1 N--CA 1.542 4.141 0 CA-C-O 118.495 -0.764 . . . . 0.0 112.302 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -65.97 -52.93 45.17 Favored 'General case' 1 N--CA 1.545 4.306 0 N-CA-C 107.184 -1.413 . . . . 0.0 107.184 177.126 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 28.1 t -64.15 -18.51 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.738 0 CA-C-O 117.88 -1.057 . . . . 0.0 110.176 177.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -79.42 -43.6 23.04 Favored 'General case' 0 N--CA 1.529 3.498 0 CA-C-O 117.554 -1.213 . . . . 0.0 111.499 179.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 557' ' ' ILE . . . . . 0.419 HD11 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -73.46 -23.89 19.89 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.248 0 CA-C-N 121.017 1.735 . . . . 0.0 110.678 -179.701 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 558' ' ' VAL . . . . . 0.419 ' N ' HD11 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -84.33 -50.62 14.87 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.809 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -179.444 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -61.34 -23.54 65.82 Favored 'General case' 0 N--CA 1.532 3.646 0 CA-C-O 118.797 -0.621 . . . . 0.0 110.049 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -96.89 -20.35 18.2 Favored 'General case' 0 N--CA 1.525 3.321 0 CA-C-O 117.541 -1.218 . . . . 0.0 111.757 179.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 3.3 pp -88.8 -33.39 17.44 Favored 'General case' 0 N--CA 1.538 3.961 0 CA-C-N 120.59 1.541 . . . . 0.0 110.102 179.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 1.1 tt -58.54 -36.57 74.07 Favored 'General case' 0 N--CA 1.537 3.906 0 C-N-CA 124.15 0.98 . . . . 0.0 110.301 178.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 11.8 mmm-85 -74.36 -52.25 12.72 Favored 'General case' 0 N--CA 1.532 3.644 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 70.76 89.09 0.1 OUTLIER Glycine 0 N--CA 1.513 3.81 0 CA-C-O 119.512 -0.604 . . . . 0.0 112.991 176.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -148.25 -54.23 0.2 Allowed 'General case' 0 N--CA 1.525 3.303 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 14.5 ptm -148.2 61.87 1.11 Allowed 'General case' 0 N--CA 1.525 3.297 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 6.8 t -123.84 1.47 8.72 Favored 'General case' 0 N--CA 1.522 3.153 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -88.17 -71.56 0.57 Allowed 'General case' 0 N--CA 1.522 3.131 0 CA-C-N 119.754 1.161 . . . . 0.0 110.67 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.53 -19.89 12.38 Favored 'General case' 0 N--CA 1.536 3.845 0 CA-C-O 118.338 -0.839 . . . . 0.0 112.36 -179.214 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -83.98 -7.7 59.34 Favored 'General case' 0 N--CA 1.518 2.957 0 CA-C-N 119.245 0.929 . . . . 0.0 113.251 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 60.6 tp -89.69 -50.02 6.31 Favored 'General case' 0 N--CA 1.535 3.811 0 CA-C-N 120.313 1.415 . . . . 0.0 113.635 -177.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -36.18 -33.56 0.04 OUTLIER 'General case' 1 N--CA 1.548 4.475 0 N-CA-C 116.173 1.916 . . . . 0.0 116.173 -175.03 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -66.21 -44.63 83.32 Favored 'General case' 1 N--CA 1.543 4.186 0 CA-C-N 118.724 0.693 . . . . 0.0 109.816 -179.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -62.78 -43.46 98.75 Favored 'General case' 0 N--CA 1.523 3.192 0 C-N-CA 124.77 1.228 . . . . 0.0 112.282 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 51.0 mt -102.68 -64.45 1.07 Allowed 'General case' 0 N--CA 1.533 3.685 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -176.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 101.86 45.43 1.77 Allowed Glycine 0 N--CA 1.512 3.745 0 N-CA-C 108.494 -1.843 . . . . 0.0 108.494 -176.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -93.44 -37.08 12.15 Favored 'General case' 0 N--CA 1.527 3.41 0 CA-C-N 117.475 0.637 . . . . 0.0 110.329 179.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 109.48 164.56 20.01 Favored Glycine 1 N--CA 1.523 4.456 0 N-CA-C 110.0 -1.24 . . . . 0.0 110.0 -178.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 1.9 mt -84.69 -16.88 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.719 0 CA-C-N 119.227 1.514 . . . . 0.0 108.36 177.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -69.66 -39.56 76.99 Favored 'General case' 0 N--CA 1.524 3.249 0 CA-C-N 119.874 1.215 . . . . 0.0 109.159 176.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 2.6 p -74.78 -40.55 61.1 Favored 'General case' 0 N--CA 1.537 3.879 0 CA-C-N 118.449 0.568 . . . . 0.0 111.527 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 2.8 tt -66.12 -37.35 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.518 0 C-N-CA 123.243 0.617 . . . . 0.0 112.336 -175.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 80.5 p -95.92 -33.12 12.3 Favored 'General case' 0 N--CA 1.515 2.812 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.221 -178.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -71.31 -21.57 62.05 Favored 'General case' 0 N--CA 1.529 3.509 0 CA-C-N 119.188 0.904 . . . . 0.0 109.333 176.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -69.37 -33.31 72.67 Favored Glycine 1 N--CA 1.517 4.052 0 N-CA-C 108.784 -1.726 . . . . 0.0 108.784 174.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 37.5 m -63.5 -39.34 94.2 Favored 'General case' 1 N--CA 1.544 4.234 0 CA-C-N 118.376 1.088 . . . . 0.0 110.166 177.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -60.13 -27.88 67.42 Favored 'General case' 1 N--CA 1.543 4.217 0 C-N-CA 123.614 0.766 . . . . 0.0 111.314 178.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 73.7 m -58.88 -44.73 91.2 Favored 'General case' 0 N--CA 1.537 3.914 0 C-N-CA 123.771 0.828 . . . . 0.0 111.57 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 33.5 mt -57.44 -42.65 82.87 Favored 'General case' 0 N--CA 1.528 3.457 0 C-N-CA 123.862 0.865 . . . . 0.0 111.127 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.54 -26.38 68.54 Favored 'General case' 1 N--CA 1.541 4.084 0 CA-C-O 118.638 -0.696 . . . . 0.0 111.889 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -76.54 -42.84 41.56 Favored 'General case' 0 N--CA 1.518 2.949 0 CA-C-N 118.598 0.635 . . . . 0.0 110.522 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -62.64 159.54 42.38 Favored Pre-proline 0 N--CA 1.536 3.844 0 CA-C-O 118.386 -0.816 . . . . 0.0 111.863 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -78.83 -176.46 3.3 Favored 'Trans proline' 0 C--N 1.377 2.059 0 C-N-CA 121.63 1.554 . . . . 0.0 110.981 178.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.4 t -96.68 -29.86 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.95 0 CA-C-O 117.8 -1.095 . . . . 0.0 111.099 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -65.83 -38.25 88.39 Favored 'General case' 0 N--CA 1.515 2.808 0 CA-C-N 119.63 1.104 . . . . 0.0 110.03 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 6.7 mp -98.51 -18.33 18.24 Favored 'General case' 0 N--CA 1.511 2.579 0 C-N-CA 123.776 0.831 . . . . 0.0 111.27 178.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.52 -30.14 69.73 Favored 'General case' 0 N--CA 1.535 3.783 0 N-CA-C 103.124 -2.917 . . . . 0.0 103.124 167.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -55.34 -38.87 69.31 Favored 'General case' 0 N--CA 1.518 2.942 0 C-N-CA 123.859 0.863 . . . . 0.0 110.174 173.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 599' ' ' TRP . . . . . 0.427 ' HA ' ' HB2' ' B' ' 602' ' ' GLU . 50.5 t90 -62.17 -37.39 85.04 Favored 'General case' 0 N--CA 1.527 3.388 0 CA-C-O 117.75 -1.119 . . . . 0.0 108.168 178.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 11.2 mp -54.19 -38.17 65.33 Favored 'General case' 1 N--CA 1.542 4.165 0 CA-C-N 119.226 0.921 . . . . 0.0 108.638 176.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -71.1 -32.53 69.15 Favored 'General case' 0 N--CA 1.531 3.624 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 176.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 602' ' ' GLU . . . . . 0.427 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 2.2 mm-40 -64.4 -22.17 66.87 Favored 'General case' 1 N--CA 1.544 4.265 0 C-N-CA 123.687 0.795 . . . . 0.0 110.133 174.899 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -121.05 3.45 6.51 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.495 0 C-N-CA 123.807 0.843 . . . . 0.0 112.295 -177.521 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -110.91 -56.95 2.3 Favored 'General case' 0 N--CA 1.514 2.761 0 N-CA-C 105.774 -1.936 . . . . 0.0 105.774 176.307 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 2.5 tt . . . . . 0 N--CA 1.532 3.659 0 C-N-CA 124.901 1.281 . . . . 0.0 111.486 -179.977 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 . . . . . 0 N--CA 1.528 3.426 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 72.5 t-105 -52.99 -46.98 68.54 Favored 'General case' 0 N--CA 1.539 4.0 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 175.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -74.15 -27.38 60.81 Favored 'General case' 0 N--CA 1.514 2.736 0 O-C-N 125.339 1.649 . . . . 0.0 112.087 -177.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.0 ttt180 -56.95 -29.51 63.22 Favored 'General case' 1 N--CA 1.544 4.242 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 173.356 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.454 ' O ' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -83.57 -38.71 21.31 Favored 'General case' 0 CA--C 1.586 2.338 0 CA-C-O 116.387 -1.768 . . . . 0.0 109.003 173.733 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 19.2 t -70.15 -27.53 32.64 Favored 'Isoleucine or valine' 1 N--CA 1.574 5.73 0 CA-C-N 121.042 1.746 . . . . 0.0 112.985 -175.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -73.91 -50.52 19.75 Favored 'General case' 0 N--CA 1.535 3.814 0 CA-C-N 119.994 1.27 . . . . 0.0 108.258 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.2 mp -72.51 -15.62 61.79 Favored 'General case' 0 N--CA 1.528 3.447 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 175.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -70.44 -35.2 73.22 Favored 'General case' 0 N--CA 1.518 2.951 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 174.611 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.6 ttmt -64.03 -24.19 67.62 Favored 'General case' 0 N--CA 1.525 3.302 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.485 176.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -69.55 -41.23 76.17 Favored 'General case' 0 N--CA 1.534 3.766 0 CA-C-N 119.282 0.946 . . . . 0.0 108.583 176.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.43 ' HB2' ' N ' ' A' ' 35' ' ' HIS . . . -87.21 -7.99 57.34 Favored 'General case' 0 N--CA 1.504 2.263 0 CA-C-O 118.59 -0.719 . . . . 0.0 110.738 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.1 -31.83 25.06 Favored 'General case' 0 N--CA 1.534 3.743 0 CA-C-N 120.433 1.47 . . . . 0.0 109.059 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -64.5 -41.33 96.5 Favored 'General case' 0 N--CA 1.531 3.607 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 51.6 m-80 -92.75 -90.78 0.18 Allowed 'General case' 0 N--CA 1.514 2.766 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 177.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.0 p30 155.19 51.16 0.0 OUTLIER 'General case' 1 N--CA 1.555 4.782 0 C-N-CA 127.381 2.272 . . . . 0.0 108.222 177.19 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.2 mt -110.08 12.21 23.61 Favored 'General case' 0 N--CA 1.522 3.149 0 C-N-CA 124.209 1.003 . . . . 0.0 110.459 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.471 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 50.0 p-80 -84.47 5.82 25.92 Favored 'General case' 0 N--CA 1.515 2.781 0 C-N-CA 123.723 0.809 . . . . 0.0 108.854 174.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.633 ' HA ' HD22 ' A' ' 39' ' ' LEU . 31.7 mt -96.09 -52.39 0.23 Allowed Pre-proline 0 N--CA 1.502 2.151 0 CA-C-O 117.058 -1.448 . . . . 0.0 108.746 -176.199 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.425 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 6.1 Cg_exo -66.41 -32.04 41.36 Favored 'Trans proline' 0 C--N 1.391 2.799 0 N-CA-C 107.106 -1.921 . . . . 0.0 107.106 170.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.471 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 1.0 OUTLIER -65.58 -41.64 92.66 Favored 'General case' 0 N--CA 1.52 3.034 0 CA-C-O 118.212 -0.899 . . . . 0.0 108.739 176.79 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.633 HD22 ' HA ' ' A' ' 36' ' ' LEU 0.274 0.1 OUTLIER -78.28 -8.58 58.56 Favored 'General case' 1 N--CA 1.552 4.653 0 CA-C-N 119.612 1.096 . . . . 0.0 111.448 177.272 . . . . . . . . 5 4 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -90.22 8.57 32.43 Favored 'General case' 0 N--CA 1.524 3.245 0 CA-C-N 118.727 0.694 . . . . 0.0 109.618 174.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.47 -56.32 1.51 Allowed 'General case' 0 N--CA 1.513 2.723 0 C-N-CA 124.048 0.939 . . . . 0.0 109.629 -178.748 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 15.7 ptp -98.06 7.72 45.88 Favored 'General case' 0 N--CA 1.538 3.943 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -176.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.8 mp -120.63 -71.36 0.74 Allowed 'General case' 0 N--CA 1.514 2.726 0 CA-C-O 117.333 -1.318 . . . . 0.0 110.229 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.9 p 128.41 161.75 0.0 OUTLIER Pre-proline 1 N--CA 1.579 6.014 0 C-N-CA 127.533 2.333 . . . . 0.0 109.071 -179.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -68.16 -33.36 25.07 Favored 'Trans proline' 0 C--N 1.392 2.82 0 C-N-CA 121.934 1.756 . . . . 0.0 108.929 176.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -64.56 -22.78 67.06 Favored 'General case' 0 N--CA 1.532 3.644 0 CA-C-O 118.278 -0.867 . . . . 0.0 110.561 176.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -71.26 -37.11 71.93 Favored 'General case' 0 N--CA 1.524 3.245 0 CA-C-O 117.745 -1.121 . . . . 0.0 109.658 178.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.9 ptt180 -81.85 -20.31 39.21 Favored 'General case' 1 N--CA 1.541 4.113 0 CA-C-N 119.589 1.086 . . . . 0.0 108.896 174.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -71.99 -26.3 62.18 Favored 'General case' 0 N--CA 1.523 3.217 0 N-CA-C 107.559 -1.275 . . . . 0.0 107.559 174.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.02 -35.48 16.35 Favored 'General case' 0 N--CA 1.504 2.268 0 CA-C-O 117.365 -1.302 . . . . 0.0 110.114 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.464 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 29.5 tp -74.27 -19.98 60.31 Favored 'General case' 1 N--CA 1.541 4.1 0 CA-C-N 120.646 1.566 . . . . 0.0 106.94 173.689 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.01 -70.24 1.21 Allowed Glycine 0 N--CA 1.497 2.742 0 C-N-CA 125.346 1.45 . . . . 0.0 110.254 177.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.4 t -72.93 -22.14 60.77 Favored 'General case' 0 N--CA 1.526 3.368 0 CA-C-O 117.628 -1.177 . . . . 0.0 113.019 -179.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 12.2 mtt180 -70.57 -51.02 31.27 Favored 'General case' 0 N--CA 1.531 3.604 0 CA-C-N 120.073 1.306 . . . . 0.0 108.035 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 20.3 t -65.66 -18.75 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.978 0 CA-C-O 117.875 -1.059 . . . . 0.0 109.39 175.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.4 mmt180 -75.71 -45.19 38.13 Favored 'General case' 0 N--CA 1.525 3.325 0 CA-C-O 117.376 -1.297 . . . . 0.0 111.807 178.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.6 -25.62 21.05 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.261 0 CA-C-N 121.26 1.846 . . . . 0.0 111.137 -178.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -85.23 -47.16 17.08 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.108 0 CA-C-N 120.128 1.331 . . . . 0.0 107.536 -179.946 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -62.03 -24.28 66.97 Favored 'General case' 0 N--CA 1.534 3.741 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 177.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -92.73 -21.23 20.09 Favored 'General case' 0 N--CA 1.518 2.929 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.373 177.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 12.6 tp -74.75 -56.47 4.76 Favored 'General case' 0 N--CA 1.526 3.337 0 CA-C-N 120.091 1.314 . . . . 0.0 109.395 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 57.2 mt -51.15 -27.99 9.94 Favored 'General case' 1 N--CA 1.544 4.233 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -178.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.72 -57.45 2.98 Favored 'General case' 0 N--CA 1.524 3.261 0 N-CA-C 106.91 -1.515 . . . . 0.0 106.91 178.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 66.76 64.92 3.03 Favored Glycine 1 N--CA 1.517 4.094 0 C-N-CA 124.0 0.809 . . . . 0.0 112.698 178.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -115.17 -54.93 2.52 Favored 'General case' 0 N--CA 1.524 3.257 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 11.8 ptm -147.01 65.72 1.16 Allowed 'General case' 0 N--CA 1.528 3.463 0 N-CA-C 106.39 -1.707 . . . . 0.0 106.39 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 14.8 m -124.03 6.49 8.6 Favored 'General case' 0 N--CA 1.524 3.233 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -174.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -114.91 -70.09 0.82 Allowed 'General case' 0 N--CA 1.527 3.418 0 CA-C-N 119.61 1.096 . . . . 0.0 111.502 -179.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 8.6 mtt180 -91.44 -43.6 9.62 Favored 'General case' 0 N--CA 1.533 3.706 0 CA-C-N 118.591 0.632 . . . . 0.0 111.536 -177.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -77.07 -13.59 59.93 Favored 'General case' 0 N--CA 1.519 3.011 0 CA-C-O 118.321 -0.847 . . . . 0.0 112.925 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 24.4 tp -81.41 -50.46 9.43 Favored 'General case' 0 N--CA 1.523 3.198 0 CA-C-N 119.767 1.167 . . . . 0.0 111.522 -178.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.92 -31.79 1.39 Allowed 'General case' 1 N--CA 1.545 4.289 0 CA-C-N 119.57 1.077 . . . . 0.0 113.666 -179.171 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -77.86 -38.9 44.99 Favored 'General case' 0 N--CA 1.527 3.423 0 CA-C-O 119.232 -0.413 . . . . 0.0 111.217 -178.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -51.09 -59.19 4.44 Favored 'General case' 0 N--CA 1.529 3.521 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -177.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -119.08 -36.86 3.31 Favored 'General case' 0 N--CA 1.537 3.893 0 CA-C-O 118.455 -0.783 . . . . 0.0 112.075 -178.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 119.95 77.71 0.52 Allowed Glycine 1 N--CA 1.525 4.593 0 N-CA-C 110.76 -0.936 . . . . 0.0 110.76 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -146.0 100.83 3.45 Favored 'General case' 0 N--CA 1.524 3.242 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 178.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -40.18 170.48 0.01 OUTLIER Glycine 1 N--CA 1.54 5.624 0 C-N-CA 125.351 1.453 . . . . 0.0 116.094 -176.346 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -77.14 -20.81 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.04 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 178.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.94 -50.26 62.93 Favored 'General case' 0 N--CA 1.516 2.839 0 CA-C-O 117.944 -1.027 . . . . 0.0 109.302 177.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.09 -41.6 94.86 Favored 'General case' 1 N--CA 1.541 4.082 0 CA-C-O 117.875 -1.059 . . . . 0.0 113.459 -178.494 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -69.68 -32.16 51.34 Favored 'Isoleucine or valine' 1 N--CA 1.549 4.508 0 CA-C-N 120.392 1.451 . . . . 0.0 110.96 -179.616 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 71.3 p -98.9 -2.15 38.33 Favored 'General case' 0 N--CA 1.518 2.947 0 CA-C-N 119.101 0.864 . . . . 0.0 111.443 177.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -88.22 -32.87 18.34 Favored 'General case' 0 N--CA 1.529 3.478 0 N-CA-C 105.519 -2.03 . . . . 0.0 105.519 173.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.64 -29.64 72.54 Favored Glycine 1 N--CA 1.519 4.196 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 176.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 62.2 p -69.4 -35.89 76.19 Favored 'General case' 0 N--CA 1.538 3.942 0 CA-C-N 118.544 1.172 . . . . 0.0 110.259 177.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -63.16 -26.35 68.77 Favored 'General case' 0 N--CA 1.538 3.965 0 C-N-CA 123.146 0.578 . . . . 0.0 110.721 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.3 m -68.61 -38.68 80.8 Favored 'General case' 0 N--CA 1.534 3.757 0 C-N-CA 123.584 0.754 . . . . 0.0 110.375 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 13.5 mt -57.47 -37.96 73.73 Favored 'General case' 0 N--CA 1.533 3.682 0 C-N-CA 124.05 0.94 . . . . 0.0 111.468 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -68.43 -27.98 66.67 Favored 'General case' 0 N--CA 1.531 3.618 0 CA-C-O 118.563 -0.732 . . . . 0.0 111.757 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -76.42 -46.31 27.66 Favored 'General case' 0 N--CA 1.518 2.963 0 CA-C-N 118.782 0.719 . . . . 0.0 110.992 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.25 160.04 52.76 Favored Pre-proline 0 N--CA 1.538 3.955 0 CA-C-O 118.29 -0.862 . . . . 0.0 112.571 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -81.85 175.46 9.29 Favored 'Trans proline' 0 C--N 1.377 2.072 0 C-N-CA 121.737 1.625 . . . . 0.0 111.123 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 t -95.69 -25.19 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.192 0 CA-C-O 117.945 -1.026 . . . . 0.0 111.242 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -59.79 -44.94 93.69 Favored 'General case' 0 N--CA 1.516 2.85 0 CA-C-N 120.071 1.305 . . . . 0.0 109.966 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.9 mp -98.49 -9.98 24.24 Favored 'General case' 0 N--CA 1.505 2.282 0 CA-C-O 118.061 -0.971 . . . . 0.0 112.268 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.1 -33.93 76.9 Favored 'General case' 1 N--CA 1.549 4.52 0 N-CA-C 102.881 -3.007 . . . . 0.0 102.881 168.014 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -53.23 -41.26 65.22 Favored 'General case' 0 N--CA 1.519 3.007 0 C-N-CA 124.501 1.121 . . . . 0.0 110.159 174.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.422 ' HA ' ' HB2' ' A' ' 102' ' ' GLU . 51.1 t90 -64.46 -35.29 80.45 Favored 'General case' 0 N--CA 1.532 3.665 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 176.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.37 -38.56 59.14 Favored 'General case' 0 N--CA 1.537 3.901 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 176.212 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -69.97 -36.41 75.2 Favored 'General case' 0 N--CA 1.539 3.994 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 175.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.422 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 0.8 OUTLIER -59.12 -24.4 62.94 Favored 'General case' 1 N--CA 1.549 4.522 0 C-N-CA 123.419 0.688 . . . . 0.0 109.984 175.124 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -119.7 3.66 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.39 0 C-N-CA 123.615 0.766 . . . . 0.0 112.356 -177.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -98.68 -59.36 1.75 Allowed 'General case' 0 N--CA 1.517 2.909 0 N-CA-C 104.346 -2.464 . . . . 0.0 104.346 175.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 1.6 tp . . . . . 0 N--CA 1.528 3.464 0 C-N-CA 124.687 1.195 . . . . 0.0 109.602 176.826 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 . . . . . 0 N--CA 1.52 3.025 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 519' ' ' TRP . . . . . 0.44 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 67.9 t-105 -42.92 -28.15 0.24 Allowed 'General case' 1 N--CA 1.549 4.489 0 CA-C-N 119.641 1.11 . . . . 0.0 113.65 179.865 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 520' ' ' LEU . . . . . 0.41 ' CD2' ' N ' ' B' ' 520' ' ' LEU . 2.2 mm? -95.03 -29.1 14.78 Favored 'General case' 0 N--CA 1.53 3.532 0 CA-C-O 117.84 -1.076 . . . . 0.0 113.827 -172.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -27.23 68.26 Favored 'General case' 1 N--CA 1.545 4.297 0 N-CA-C 105.426 -2.064 . . . . 0.0 105.426 171.02 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . 0.464 ' CD2' ' HG ' ' A' ' 51' ' ' LEU . 0.9 OUTLIER -78.08 -40.37 38.67 Favored 'General case' 0 N--CA 1.507 2.402 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 174.77 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 37.0 t -63.02 -22.43 30.65 Favored 'Isoleucine or valine' 1 N--CA 1.569 5.48 0 CA-C-N 120.283 1.401 . . . . 0.0 111.965 178.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -76.89 -49.83 14.75 Favored 'General case' 0 N--CA 1.536 3.84 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 179.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 6.7 tt -63.45 -31.4 72.55 Favored 'General case' 0 N--CA 1.538 3.939 0 O-C-N 123.29 0.369 . . . . 0.0 110.115 176.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.65 -33.78 74.58 Favored 'General case' 0 N--CA 1.523 3.223 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 177.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 31.4 ttmt -67.66 -26.57 66.28 Favored 'General case' 0 N--CA 1.518 2.971 0 CA-C-O 118.161 -0.923 . . . . 0.0 110.853 177.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -69.58 -37.43 76.95 Favored 'General case' 0 N--CA 1.536 3.854 0 CA-C-N 119.462 1.028 . . . . 0.0 108.896 176.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 529' ' ' ALA . . . . . . . . . . . . . . . -90.98 -9.46 45.92 Favored 'General case' 0 CA--C 1.579 2.084 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.967 178.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -82.32 -32.11 29.59 Favored 'General case' 0 N--CA 1.531 3.6 0 CA-C-N 120.312 1.414 . . . . 0.0 109.328 -179.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -65.85 -43.0 89.76 Favored 'General case' 0 N--CA 1.534 3.766 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 177.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 65.6 m-80 -90.82 -90.15 0.16 Allowed 'General case' 0 N--CA 1.514 2.754 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 154.86 50.74 0.0 OUTLIER 'General case' 1 N--CA 1.559 4.977 0 C-N-CA 127.574 2.35 . . . . 0.0 107.984 177.384 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 6.9 mt -106.35 7.83 31.42 Favored 'General case' 0 N--CA 1.528 3.449 0 C-N-CA 124.297 1.039 . . . . 0.0 111.021 -178.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 535' ' ' HIS . . . . . . . . . . . . . 29.3 p-80 -80.57 0.01 35.77 Favored 'General case' 0 N--CA 1.514 2.732 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 175.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 536' ' ' LEU . . . . . . . . . . . . . 35.5 mt -94.23 -50.95 0.26 Allowed Pre-proline 0 N--CA 1.505 2.283 0 CA-C-O 116.486 -1.721 . . . . 0.0 109.263 -175.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 537' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -66.33 -35.37 31.8 Favored 'Trans proline' 0 C--N 1.394 2.966 0 N-CA-C 106.775 -2.048 . . . . 0.0 106.775 171.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.24 -41.7 98.66 Favored 'General case' 0 N--CA 1.524 3.251 0 C-N-CA 124.267 1.027 . . . . 0.0 108.334 175.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 11.5 mt -72.14 -21.76 61.42 Favored 'General case' 1 N--CA 1.54 4.057 0 CA-C-O 118.358 -0.83 . . . . 0.0 111.057 178.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -77.72 -6.18 53.11 Favored 'General case' 0 N--CA 1.524 3.234 0 CA-C-N 118.976 0.807 . . . . 0.0 110.44 177.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.88 -47.77 3.3 Favored 'General case' 0 N--CA 1.512 2.63 0 C-N-CA 124.053 0.941 . . . . 0.0 109.445 -179.092 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 12.7 ptp -89.76 -10.54 45.21 Favored 'General case' 0 N--CA 1.536 3.852 0 CA-C-O 117.407 -1.282 . . . . 0.0 113.542 -177.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 1.2 tt -128.2 -112.58 0.27 Allowed 'General case' 0 N--CA 1.53 3.563 0 CA-C-O 116.558 -1.687 . . . . 0.0 112.752 -178.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 2.2 p -174.56 161.66 2.64 Favored Pre-proline 1 N--CA 1.561 5.087 0 CA-C-N 121.505 1.957 . . . . 0.0 111.245 -178.483 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -74.81 -42.49 0.55 Allowed 'Trans proline' 0 C--N 1.388 2.621 0 C-N-CA 123.021 2.481 . . . . 0.0 109.733 176.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -58.28 -31.9 67.91 Favored 'General case' 1 N--CA 1.543 4.192 0 C-N-CA 123.707 0.803 . . . . 0.0 111.63 179.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -71.96 -34.09 68.7 Favored 'General case' 0 N--CA 1.526 3.35 0 CA-C-O 117.843 -1.075 . . . . 0.0 110.664 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 32.1 ptt180 -79.09 -23.51 44.08 Favored 'General case' 0 N--CA 1.533 3.692 0 CA-C-N 119.597 1.09 . . . . 0.0 110.133 177.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -65.16 -41.48 94.66 Favored 'General case' 0 N--CA 1.536 3.828 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 173.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -78.14 -19.95 53.01 Favored 'General case' 0 N--CA 1.508 2.448 0 CA-C-O 116.992 -1.48 . . . . 0.0 111.185 177.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 551' ' ' LEU . . . . . 0.42 HD22 ' CG ' ' A' ' 22' ' ' PHE . 18.0 tp -76.44 -28.19 56.5 Favored 'General case' 0 N--CA 1.529 3.497 0 CA-C-N 121.368 1.895 . . . . 0.0 108.52 175.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -72.23 -56.3 6.38 Favored Glycine 0 N--CA 1.501 2.993 0 N-CA-C 108.491 -1.844 . . . . 0.0 108.491 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.4 m -66.19 -28.18 68.56 Favored 'General case' 0 N--CA 1.537 3.913 0 CA-C-O 118.432 -0.794 . . . . 0.0 112.05 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 26.0 mtm-85 -69.22 -45.81 68.94 Favored 'General case' 1 N--CA 1.541 4.102 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 176.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 34.9 t -70.73 -15.47 18.93 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.66 0 CA-C-O 118.11 -0.947 . . . . 0.0 109.353 177.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -79.82 -44.35 20.72 Favored 'General case' 0 N--CA 1.523 3.222 0 CA-C-O 117.395 -1.288 . . . . 0.0 111.212 178.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 557' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.3 -25.07 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.213 0 CA-C-N 121.428 1.922 . . . . 0.0 110.107 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 558' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -84.32 -52.76 12.24 Favored 'Isoleucine or valine' 1 N--CA 1.547 4.397 0 CA-C-N 120.736 1.607 . . . . 0.0 107.541 -179.888 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -58.07 -25.69 61.59 Favored 'General case' 0 N--CA 1.529 3.507 0 CA-C-O 118.874 -0.584 . . . . 0.0 110.696 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -93.7 -24.58 17.8 Favored 'General case' 0 N--CA 1.523 3.225 0 CA-C-O 118.132 -0.937 . . . . 0.0 111.043 178.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.92 -38.71 66.76 Favored 'General case' 1 N--CA 1.541 4.092 0 CA-C-N 119.728 1.149 . . . . 0.0 108.561 177.776 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 34.7 mt -57.35 -22.32 41.63 Favored 'General case' 0 N--CA 1.536 3.857 0 C-N-CA 123.665 0.786 . . . . 0.0 111.545 177.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 24.5 mmm180 -77.77 -51.39 10.6 Favored 'General case' 0 N--CA 1.527 3.406 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 66.97 50.57 45.85 Favored Glycine 1 N--CA 1.522 4.386 0 CA-C-O 119.086 -0.841 . . . . 0.0 112.494 178.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -124.76 -54.21 1.65 Allowed 'General case' 0 N--CA 1.527 3.405 0 CA-C-N 118.362 1.081 . . . . 0.0 108.431 178.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 30.6 mtt -148.98 64.32 1.04 Allowed 'General case' 0 N--CA 1.522 3.168 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 80.0 p -130.87 -4.83 4.02 Favored 'General case' 0 N--CA 1.52 3.063 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -175.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -93.49 -78.43 0.43 Allowed 'General case' 0 N--CA 1.528 3.468 0 CA-C-N 120.164 1.347 . . . . 0.0 111.255 -179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.79 -34.86 13.02 Favored 'General case' 1 N--CA 1.541 4.086 0 CA-C-N 119.146 0.885 . . . . 0.0 112.043 -178.492 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -76.96 -11.08 59.76 Favored 'General case' 0 N--CA 1.52 3.028 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -178.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 16.8 tp -83.17 -43.65 15.93 Favored 'General case' 0 N--CA 1.532 3.639 0 CA-C-N 119.749 1.158 . . . . 0.0 112.649 -177.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -44.63 -29.21 0.7 Allowed 'General case' 1 N--CA 1.556 4.856 0 CA-C-N 120.249 1.386 . . . . 0.0 113.474 -178.591 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -66.4 -46.35 76.88 Favored 'General case' 0 N--CA 1.538 3.96 0 CA-C-N 118.698 0.681 . . . . 0.0 109.414 179.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -57.53 -51.13 70.71 Favored 'General case' 0 N--CA 1.525 3.293 0 C-N-CA 124.662 1.185 . . . . 0.0 112.413 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 61.0 mt -108.77 -61.83 1.55 Allowed 'General case' 0 N--CA 1.53 3.534 0 C-N-CA 122.988 0.515 . . . . 0.0 111.828 -177.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 122.81 20.82 2.76 Favored Glycine 1 N--CA 1.529 4.898 0 CA-C-O 118.199 -1.334 . . . . 0.0 112.619 -178.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -86.27 119.31 26.41 Favored 'General case' 0 N--CA 1.522 3.135 0 CA-C-N 119.577 1.689 . . . . 0.0 107.021 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -42.26 167.97 0.01 OUTLIER Glycine 1 N--CA 1.538 5.444 0 C-N-CA 124.616 1.103 . . . . 0.0 115.209 -177.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -80.27 -19.05 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.743 0 CA-C-O 117.632 -1.175 . . . . 0.0 108.568 178.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -69.22 -37.21 77.91 Favored 'General case' 0 N--CA 1.527 3.424 0 CA-C-N 119.879 1.218 . . . . 0.0 109.501 176.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.4 -36.65 38.81 Favored 'General case' 0 N--CA 1.536 3.831 0 CA-C-N 118.978 0.808 . . . . 0.0 111.776 178.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 3.1 tt -67.07 -38.41 81.2 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.216 0 CA-C-O 118.975 -0.535 . . . . 0.0 112.223 -175.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 69.8 p -99.11 -27.34 13.87 Favored 'General case' 0 N--CA 1.508 2.443 0 CA-C-O 117.812 -1.089 . . . . 0.0 111.837 -178.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 13.3 ptt180 -73.66 -24.87 60.04 Favored 'General case' 0 N--CA 1.531 3.584 0 CA-C-N 120.061 1.301 . . . . 0.0 109.762 176.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -68.88 -36.11 81.08 Favored Glycine 1 N--CA 1.517 4.081 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 177.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 35.2 p -78.68 -29.49 45.62 Favored 'General case' 0 N--CA 1.531 3.607 0 CA-C-N 118.05 0.925 . . . . 0.0 111.278 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -64.01 -30.89 71.93 Favored 'General case' 1 N--CA 1.544 4.233 0 CA-C-N 119.346 0.976 . . . . 0.0 110.683 179.032 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 3.8 m -59.02 -35.98 74.2 Favored 'General case' 1 N--CA 1.541 4.108 0 C-N-CA 123.276 0.63 . . . . 0.0 110.411 178.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 43.7 mt -52.56 -45.84 66.57 Favored 'General case' 0 N--CA 1.532 3.641 0 C-N-CA 124.582 1.153 . . . . 0.0 111.398 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.52 -34.85 69.54 Favored 'General case' 1 N--CA 1.543 4.222 0 C-N-CA 123.268 0.627 . . . . 0.0 111.815 -179.744 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -81.2 -34.01 32.58 Favored 'General case' 0 N--CA 1.519 2.992 0 CA-C-O 118.878 -0.582 . . . . 0.0 111.859 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -61.94 171.99 1.3 Allowed Pre-proline 1 N--CA 1.54 4.061 0 CA-C-O 118.218 -0.896 . . . . 0.0 111.707 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -83.17 140.73 10.0 Favored 'Trans proline' 0 C--N 1.377 2.033 0 C-N-CA 121.775 1.65 . . . . 0.0 109.207 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.3 t -79.64 -20.82 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.019 0 CA-C-O 117.928 -1.034 . . . . 0.0 111.027 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -63.54 -41.91 98.44 Favored 'General case' 0 N--CA 1.516 2.856 0 CA-C-N 120.101 1.319 . . . . 0.0 109.786 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 7.4 mp -97.64 -13.79 21.33 Favored 'General case' 0 N--CA 1.511 2.592 0 C-N-CA 123.683 0.793 . . . . 0.0 111.349 177.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.16 -32.18 73.1 Favored 'General case' 1 N--CA 1.541 4.081 0 N-CA-C 103.595 -2.743 . . . . 0.0 103.595 168.496 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -54.16 -38.26 65.33 Favored 'General case' 0 N--CA 1.519 3.003 0 C-N-CA 124.532 1.133 . . . . 0.0 109.693 174.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 599' ' ' TRP . . . . . 0.421 ' HA ' ' HB2' ' B' ' 602' ' ' GLU . 49.7 t90 -63.25 -37.16 86.15 Favored 'General case' 0 N--CA 1.528 3.432 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 176.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -51.34 -39.03 56.16 Favored 'General case' 1 N--CA 1.543 4.204 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 175.869 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -69.64 -37.15 76.67 Favored 'General case' 1 N--CA 1.543 4.177 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 175.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 602' ' ' GLU . . . . . 0.421 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 2.9 mt-10 -59.35 -23.25 62.37 Favored 'General case' 1 N--CA 1.547 4.41 0 C-N-CA 123.424 0.69 . . . . 0.0 110.141 175.101 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -120.77 3.49 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.323 0 C-N-CA 123.566 0.747 . . . . 0.0 112.468 -177.399 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -111.68 -61.49 1.7 Allowed 'General case' 0 N--CA 1.509 2.508 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 176.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.535 3.792 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 177.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 . . . . . 0 N--CA 1.528 3.445 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.41 ' CE3' ' CD2' ' B' ' 551' ' ' LEU . 61.6 t-105 -54.65 -38.26 66.67 Favored 'General case' 0 N--CA 1.531 3.598 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 173.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -80.03 -27.27 39.5 Favored 'General case' 0 N--CA 1.517 2.881 0 CA-C-O 117.263 -1.351 . . . . 0.0 112.279 -175.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 mmt180 -57.9 -31.54 66.86 Favored 'General case' 1 N--CA 1.549 4.508 0 N-CA-C 105.335 -2.098 . . . . 0.0 105.335 172.138 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.5 ' CG ' HD22 ' B' ' 551' ' ' LEU . 0.1 OUTLIER -76.59 -41.98 44.23 Favored 'General case' 0 N--CA 1.503 2.2 0 CA-C-O 116.718 -1.61 . . . . 0.0 109.382 173.628 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 26.8 t -69.91 -25.04 27.24 Favored 'Isoleucine or valine' 1 N--CA 1.566 5.349 0 CA-C-N 120.566 1.53 . . . . 0.0 113.981 -174.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -76.29 -51.56 11.74 Favored 'General case' 0 N--CA 1.535 3.815 0 CA-C-N 120.392 1.451 . . . . 0.0 108.276 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.5 mp -74.68 -12.33 60.4 Favored 'General case' 0 N--CA 1.52 3.059 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 175.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.468 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -70.76 -36.92 73.33 Favored 'General case' 0 N--CA 1.521 3.097 0 N-CA-C 106.495 -1.669 . . . . 0.0 106.495 173.22 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -62.79 -22.15 66.4 Favored 'General case' 0 N--CA 1.525 3.276 0 CA-C-O 118.495 -0.764 . . . . 0.0 111.006 176.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -70.36 -45.53 65.89 Favored 'General case' 0 N--CA 1.538 3.927 0 N-CA-C 108.307 -0.998 . . . . 0.0 108.307 176.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.494 ' HB2' ' N ' ' A' ' 35' ' ' HIS . . . -81.67 -9.37 59.67 Favored 'General case' 0 N--CA 1.508 2.455 0 CA-C-O 118.695 -0.669 . . . . 0.0 110.841 177.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.4 -36.15 29.88 Favored 'General case' 0 N--CA 1.533 3.707 0 CA-C-N 120.251 1.387 . . . . 0.0 109.066 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -59.99 -42.43 94.18 Favored 'General case' 0 N--CA 1.536 3.863 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 177.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 61.3 m-80 -90.15 -85.59 0.21 Allowed 'General case' 0 N--CA 1.513 2.717 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 176.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 147.94 50.96 0.0 OUTLIER 'General case' 1 N--CA 1.555 4.792 0 C-N-CA 128.042 2.537 . . . . 0.0 108.422 177.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.7 mt -111.63 12.38 21.2 Favored 'General case' 0 N--CA 1.526 3.339 0 C-N-CA 124.822 1.249 . . . . 0.0 110.021 -179.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.494 ' N ' ' HB2' ' A' ' 29' ' ' ALA . 51.6 p-80 -83.91 6.66 20.88 Favored 'General case' 0 N--CA 1.507 2.41 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 175.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.434 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 18.6 mt -96.37 -52.04 0.23 Allowed Pre-proline 0 N--CA 1.509 2.505 0 CA-C-O 116.794 -1.574 . . . . 0.0 108.828 -175.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.434 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 5.7 Cg_exo -66.02 -32.27 44.59 Favored 'Trans proline' 0 C--N 1.396 3.04 0 N-CA-C 106.489 -2.158 . . . . 0.0 106.489 170.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.48 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.9 OUTLIER -64.14 -39.22 93.57 Favored 'General case' 0 N--CA 1.517 2.9 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 175.679 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.35 -21.5 62.03 Favored 'General case' 1 N--CA 1.543 4.196 0 CA-C-N 119.324 0.966 . . . . 0.0 109.978 176.547 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -85.73 -3.19 58.83 Favored 'General case' 0 N--CA 1.527 3.42 0 CA-C-N 119.106 0.866 . . . . 0.0 111.131 177.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -112.96 -36.09 5.23 Favored 'General case' 0 N--CA 1.53 3.548 0 CA-C-N 119.698 1.135 . . . . 0.0 111.558 -178.26 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.9 ptt? -126.81 27.18 6.07 Favored 'General case' 1 N--CA 1.554 4.725 0 CA-C-N 120.249 1.386 . . . . 0.0 111.674 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.3 tp -134.1 -61.89 0.77 Allowed 'General case' 0 N--CA 1.516 2.867 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.9 p 118.5 158.8 0.0 OUTLIER Pre-proline 1 N--CA 1.566 5.345 0 C-N-CA 128.348 2.659 . . . . 0.0 109.495 -178.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -69.26 -31.26 23.1 Favored 'Trans proline' 0 C--N 1.392 2.864 0 C-N-CA 122.163 1.908 . . . . 0.0 109.058 175.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -67.17 -21.07 65.81 Favored 'General case' 0 N--CA 1.528 3.441 0 CA-C-O 118.131 -0.937 . . . . 0.0 110.243 176.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -75.46 -29.74 59.74 Favored 'General case' 0 N--CA 1.521 3.086 0 CA-C-O 117.599 -1.191 . . . . 0.0 109.853 178.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -87.18 -22.03 25.54 Favored 'General case' 0 N--CA 1.539 3.995 0 CA-C-N 119.933 1.242 . . . . 0.0 109.026 174.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -71.58 -27.94 63.49 Favored 'General case' 0 N--CA 1.527 3.423 0 N-CA-C 106.433 -1.692 . . . . 0.0 106.433 172.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.48 -27.24 20.48 Favored 'General case' 0 N--CA 1.503 2.177 0 CA-C-O 117.432 -1.27 . . . . 0.0 110.405 178.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 27.6 tp -75.55 -21.74 57.64 Favored 'General case' 0 N--CA 1.537 3.915 0 N-CA-C 106.249 -1.76 . . . . 0.0 106.249 173.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.421 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -67.85 -72.42 0.8 Allowed Glycine 0 C--N 1.376 2.802 0 N-CA-C 109.198 -1.561 . . . . 0.0 109.198 176.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.7 m -66.08 -22.38 66.41 Favored 'General case' 0 N--CA 1.535 3.82 0 CA-C-O 117.468 -1.253 . . . . 0.0 113.204 -179.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.3 mtm180 -71.27 -52.66 17.71 Favored 'General case' 0 N--CA 1.538 3.933 0 CA-C-N 120.498 1.499 . . . . 0.0 107.464 177.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.3 t -67.63 -16.2 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.903 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.84 176.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -76.09 -46.66 27.85 Favored 'General case' 0 N--CA 1.531 3.59 0 CA-C-N 120.052 1.296 . . . . 0.0 111.172 178.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.2 -23.04 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.376 0 CA-C-N 120.563 1.529 . . . . 0.0 111.573 -178.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -88.79 -53.31 9.75 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.765 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -57.39 -22.61 44.03 Favored 'General case' 0 N--CA 1.531 3.609 0 CA-C-O 118.454 -0.784 . . . . 0.0 110.755 178.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -95.33 -29.01 14.69 Favored 'General case' 0 N--CA 1.522 3.132 0 CA-C-O 118.148 -0.929 . . . . 0.0 110.365 177.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 45.6 tp -67.6 -56.33 9.83 Favored 'General case' 1 N--CA 1.539 4.007 0 CA-C-N 119.598 1.09 . . . . 0.0 110.073 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 54.9 mt -54.02 -24.64 17.68 Favored 'General case' 1 N--CA 1.541 4.09 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 -179.26 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -79.22 -48.83 13.51 Favored 'General case' 0 N--CA 1.53 3.531 0 CA-C-N 118.669 0.668 . . . . 0.0 110.045 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 74.61 81.14 0.48 Allowed Glycine 1 N--CA 1.521 4.344 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 179.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -158.57 -57.17 0.07 Allowed 'General case' 0 N--CA 1.53 3.528 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 44.1 mtt -138.61 76.56 1.58 Allowed 'General case' 0 N--CA 1.522 3.156 0 N-CA-C 104.344 -2.465 . . . . 0.0 104.344 177.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.5 m -128.5 -33.17 2.12 Favored 'General case' 0 N--CA 1.525 3.324 0 N-CA-C 114.104 1.15 . . . . 0.0 114.104 -172.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -105.91 -65.65 1.05 Allowed 'General case' 0 N--CA 1.526 3.343 0 CA-C-N 118.727 0.694 . . . . 0.0 111.933 -176.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 10.7 mtt180 -97.24 -45.59 6.45 Favored 'General case' 0 N--CA 1.526 3.361 0 CA-C-N 118.485 0.584 . . . . 0.0 111.419 -177.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -71.81 -14.87 62.1 Favored 'General case' 0 N--CA 1.521 3.083 0 CA-C-O 118.439 -0.791 . . . . 0.0 112.297 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 24.1 tp -79.14 -54.9 5.53 Favored 'General case' 0 N--CA 1.525 3.298 0 CA-C-N 119.484 1.038 . . . . 0.0 111.62 -178.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -41.77 -36.55 1.03 Allowed 'General case' 1 N--CA 1.549 4.511 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -178.174 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 14.1 t30 -74.12 -39.97 62.99 Favored 'General case' 0 N--CA 1.532 3.642 0 CA-C-N 118.112 0.415 . . . . 0.0 111.035 -178.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -46.3 -54.38 9.04 Favored 'General case' 0 N--CA 1.537 3.886 0 C-N-CA 124.824 1.25 . . . . 0.0 113.409 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -133.23 -39.88 0.92 Allowed 'General case' 0 N--CA 1.533 3.683 0 CA-C-O 118.63 -0.7 . . . . 0.0 111.835 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 117.77 86.79 1.17 Allowed Glycine 1 N--CA 1.523 4.486 0 N-CA-C 110.51 -1.036 . . . . 0.0 110.51 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -115.92 -47.1 2.8 Favored 'General case' 0 N--CA 1.522 3.152 0 C-N-CA 123.613 0.765 . . . . 0.0 109.397 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.99 161.67 22.84 Favored Glycine 1 N--CA 1.525 4.629 0 N-CA-C 109.771 -1.331 . . . . 0.0 109.771 -179.039 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -83.11 -14.98 11.76 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.858 0 CA-C-N 119.439 1.619 . . . . 0.0 108.133 177.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.94 -30.72 67.11 Favored 'General case' 0 N--CA 1.518 2.949 0 CA-C-O 117.463 -1.256 . . . . 0.0 111.239 177.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.9 p -93.4 -36.38 12.52 Favored 'General case' 1 N--CA 1.545 4.316 0 CA-C-N 120.45 1.477 . . . . 0.0 112.133 -179.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -73.93 -25.38 20.24 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.056 0 CA-C-O 118.101 -0.952 . . . . 0.0 111.898 -179.122 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.5 p -103.95 -29.67 10.79 Favored 'General case' 0 N--CA 1.513 2.697 0 CA-C-O 117.954 -1.022 . . . . 0.0 110.554 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.0 ptt180 -73.28 -25.59 60.74 Favored 'General case' 1 N--CA 1.545 4.287 0 CA-C-N 120.042 1.292 . . . . 0.0 108.154 173.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -64.71 -27.58 72.18 Favored Glycine 1 N--CA 1.524 4.543 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 174.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 20.1 m -70.33 -35.47 73.63 Favored 'General case' 0 N--CA 1.535 3.795 0 CA-C-N 117.973 0.886 . . . . 0.0 108.753 176.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -60.92 -30.69 70.35 Favored 'General case' 1 N--CA 1.542 4.143 0 C-N-CA 123.457 0.703 . . . . 0.0 110.096 177.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.6 m -64.76 -38.14 89.98 Favored 'General case' 0 N--CA 1.533 3.711 0 C-N-CA 123.509 0.723 . . . . 0.0 110.716 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.8 mt -53.39 -37.91 62.9 Favored 'General case' 0 N--CA 1.538 3.935 0 C-N-CA 123.734 0.813 . . . . 0.0 111.135 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -68.27 -36.3 79.19 Favored 'General case' 0 N--CA 1.534 3.755 0 C-N-CA 123.096 0.558 . . . . 0.0 111.174 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.67 -36.77 81.32 Favored 'General case' 0 N--CA 1.525 3.276 0 C-N-CA 123.216 0.607 . . . . 0.0 111.905 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.35 158.41 88.06 Favored Pre-proline 0 N--CA 1.526 3.363 0 CA-C-O 118.535 -0.745 . . . . 0.0 111.851 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -86.46 -178.54 2.75 Favored 'Trans proline' 0 CA--C 1.563 1.972 0 C-N-CA 122.331 2.021 . . . . 0.0 111.189 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.404 ' HA ' ' HB3' ' A' ' 97' ' ' ARG . 3.1 t -97.04 -28.76 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.101 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.773 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -59.78 -45.22 92.94 Favored 'General case' 0 N--CA 1.514 2.762 0 CA-C-N 119.666 1.121 . . . . 0.0 110.009 -178.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.6 mp -100.02 -11.63 20.42 Favored 'General case' 0 N--CA 1.511 2.591 0 CA-C-O 118.307 -0.854 . . . . 0.0 112.706 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.404 ' HB3' ' HA ' ' A' ' 94' ' ' VAL . 0.2 OUTLIER -67.56 -30.84 70.58 Favored 'General case' 1 N--CA 1.544 4.269 0 N-CA-C 102.368 -3.197 . . . . 0.0 102.368 167.849 . . . . . . . . 4 4 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -56.67 -38.54 72.37 Favored 'General case' 0 N--CA 1.515 2.823 0 C-N-CA 124.134 0.973 . . . . 0.0 110.277 175.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 53.5 t90 -66.45 -34.22 77.45 Favored 'General case' 0 N--CA 1.538 3.963 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 176.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.52 -37.15 62.53 Favored 'General case' 0 N--CA 1.535 3.775 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 176.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -68.06 -38.94 83.0 Favored 'General case' 1 N--CA 1.541 4.089 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 175.341 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.51 -23.8 58.99 Favored 'General case' 1 N--CA 1.544 4.247 0 C-N-CA 123.459 0.704 . . . . 0.0 110.643 175.734 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -120.88 2.73 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.493 0 C-N-CA 123.375 0.67 . . . . 0.0 112.617 -177.143 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -109.57 -56.95 2.24 Favored 'General case' 0 N--CA 1.518 2.935 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 177.117 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.3 tp . . . . . 0 N--CA 1.531 3.591 0 C-N-CA 125.149 1.38 . . . . 0.0 111.491 179.325 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 . . . . . 0 N--CA 1.52 3.047 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 519' ' ' TRP . . . . . . . . . . . . . 63.1 t-105 -42.54 -26.43 0.12 Allowed 'General case' 1 N--CA 1.552 4.64 0 C-N-CA 124.558 1.143 . . . . 0.0 113.753 178.523 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 520' ' ' LEU . . . . . 0.408 ' CD2' ' N ' ' B' ' 520' ' ' LEU . 2.4 mm? -93.88 -34.29 13.18 Favored 'General case' 0 N--CA 1.526 3.369 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -172.299 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.58 -25.02 68.04 Favored 'General case' 0 N--CA 1.534 3.755 0 N-CA-C 106.291 -1.744 . . . . 0.0 106.291 172.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . 0.421 ' CE2' ' HA2' ' A' ' 52' ' ' GLY . 2.2 m-85 -78.74 -37.33 41.56 Favored 'General case' 0 N--CA 1.513 2.716 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 173.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 25.4 t -66.4 -23.35 31.46 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.232 0 CA-C-N 120.169 1.349 . . . . 0.0 111.646 179.103 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -75.19 -49.38 19.61 Favored 'General case' 0 N--CA 1.536 3.849 0 CA-C-N 120.063 1.301 . . . . 0.0 108.345 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 1.8 tp -65.5 -29.31 69.94 Favored 'General case' 1 N--CA 1.54 4.05 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 176.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.41 -33.05 73.54 Favored 'General case' 0 N--CA 1.522 3.171 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 177.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 31.0 ttmt -65.89 -25.52 67.21 Favored 'General case' 0 N--CA 1.519 3.01 0 CA-C-O 118.387 -0.816 . . . . 0.0 111.144 177.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -69.22 -39.94 78.28 Favored 'General case' 0 N--CA 1.536 3.829 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 176.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 529' ' ' ALA . . . . . . . . . . . . . . . -88.63 -9.5 51.93 Favored 'General case' 0 N--CA 1.506 2.367 0 CA-C-O 118.417 -0.802 . . . . 0.0 111.295 178.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -81.61 -32.9 31.79 Favored 'General case' 0 N--CA 1.532 3.625 0 CA-C-N 120.439 1.472 . . . . 0.0 108.733 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -61.6 -44.43 97.02 Favored 'General case' 0 N--CA 1.538 3.944 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 176.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 61.4 m-80 -91.56 -86.45 0.22 Allowed 'General case' 0 N--CA 1.517 2.878 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 177.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 150.72 52.41 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.855 0 C-N-CA 128.027 2.531 . . . . 0.0 107.818 178.179 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 4.8 mt -111.08 10.65 22.02 Favored 'General case' 0 N--CA 1.528 3.429 0 C-N-CA 124.558 1.143 . . . . 0.0 110.831 -178.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 535' ' ' HIS . . . . . . . . . . . . . 39.9 p-80 -82.43 -0.32 45.67 Favored 'General case' 0 N--CA 1.517 2.888 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 174.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 536' ' ' LEU . . . . . 0.429 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 34.6 mt -93.96 -51.63 0.26 Allowed Pre-proline 0 N--CA 1.504 2.266 0 CA-C-O 116.728 -1.606 . . . . 0.0 108.952 -175.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 537' ' ' PRO . . . . . 0.429 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 6.3 Cg_exo -66.19 -33.86 38.43 Favored 'Trans proline' 0 C--N 1.394 2.941 0 C-N-CA 122.158 1.906 . . . . 0.0 107.235 171.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.07 -45.69 87.6 Favored 'General case' 0 N--CA 1.521 3.108 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 176.292 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . 0.262 2.2 pp -81.89 -2.86 52.67 Favored 'General case' 1 N--CA 1.542 4.161 0 CA-C-N 118.824 0.738 . . . . 0.0 111.9 178.392 . . . . . . . . 3 2 . 1 . 009 nuclear orig core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -81.51 -12.01 58.99 Favored 'General case' 0 N--CA 1.518 2.946 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 172.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -108.3 -45.05 3.99 Favored 'General case' 0 N--CA 1.512 2.635 0 C-N-CA 124.476 1.11 . . . . 0.0 109.639 -178.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 12.2 ptp -84.51 -28.28 26.81 Favored 'General case' 1 N--CA 1.546 4.326 0 CA-C-O 117.61 -1.186 . . . . 0.0 111.988 -178.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 5.7 mp -107.35 -99.14 0.36 Allowed 'General case' 0 N--CA 1.527 3.392 0 CA-C-O 117.111 -1.423 . . . . 0.0 112.759 -176.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 3.1 t 153.77 147.48 0.0 OUTLIER Pre-proline 1 N--CA 1.574 5.774 0 C-N-CA 126.224 1.809 . . . . 0.0 109.023 -177.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -58.67 -34.33 98.84 Favored 'Trans proline' 0 N--CA 1.524 3.301 0 C-N-CA 123.32 2.68 . . . . 0.0 113.502 -179.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -57.79 -30.02 65.35 Favored 'General case' 1 N--CA 1.542 4.135 0 CA-C-N 118.508 0.594 . . . . 0.0 111.479 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -67.86 -38.5 83.19 Favored 'General case' 0 N--CA 1.526 3.33 0 CA-C-O 118.307 -0.854 . . . . 0.0 110.6 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 4.2 ptt180 -76.44 -20.85 56.64 Favored 'General case' 0 N--CA 1.529 3.492 0 CA-C-O 118.135 -0.936 . . . . 0.0 111.289 178.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -65.57 -49.37 69.08 Favored 'General case' 0 N--CA 1.537 3.908 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 174.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -77.58 -13.88 59.8 Favored 'General case' 0 N--CA 1.511 2.598 0 CA-C-O 117.073 -1.441 . . . . 0.0 111.817 178.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 551' ' ' LEU . . . . . 0.5 HD22 ' CG ' ' A' ' 22' ' ' PHE . 11.7 tp -79.13 -30.39 43.66 Favored 'General case' 0 N--CA 1.53 3.529 0 CA-C-N 120.817 1.644 . . . . 0.0 107.73 175.028 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -71.15 -56.9 6.56 Favored Glycine 0 N--CA 1.498 2.783 0 N-CA-C 108.949 -1.661 . . . . 0.0 108.949 178.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 3.1 m -64.43 -31.29 72.44 Favored 'General case' 1 N--CA 1.541 4.092 0 CA-C-O 118.337 -0.839 . . . . 0.0 112.059 -179.169 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -65.5 -50.6 64.69 Favored 'General case' 1 N--CA 1.546 4.369 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 176.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 32.0 t -66.05 -15.98 19.87 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.849 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.03 177.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 18.6 mmt180 -79.82 -44.32 20.79 Favored 'General case' 0 N--CA 1.526 3.363 0 CA-C-O 117.327 -1.321 . . . . 0.0 111.319 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 557' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -24.58 21.41 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.186 0 CA-C-N 121.425 1.921 . . . . 0.0 110.406 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 558' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -86.22 -53.47 10.3 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.073 0 CA-C-N 119.997 1.271 . . . . 0.0 107.635 -179.739 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -61.36 -22.04 64.58 Favored 'General case' 0 N--CA 1.532 3.636 0 CA-C-O 118.497 -0.763 . . . . 0.0 110.971 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -93.81 -24.78 17.65 Favored 'General case' 0 N--CA 1.523 3.183 0 CA-C-O 118.081 -0.961 . . . . 0.0 110.07 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 14.3 tp -71.01 -53.77 13.6 Favored 'General case' 0 N--CA 1.535 3.813 0 CA-C-N 119.708 1.14 . . . . 0.0 108.255 178.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 36.5 mt -48.62 -30.1 5.04 Favored 'General case' 1 N--CA 1.543 4.218 0 C-N-CA 124.157 0.983 . . . . 0.0 112.583 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 20.5 mmm180 -79.68 -49.89 11.44 Favored 'General case' 0 N--CA 1.53 3.546 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 72.11 89.19 0.13 Allowed Glycine 1 N--CA 1.52 4.274 0 CA-C-O 119.346 -0.697 . . . . 0.0 111.822 178.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -155.87 -55.82 0.09 Allowed 'General case' 0 N--CA 1.528 3.428 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 2.1 ptt? -147.84 66.34 1.11 Allowed 'General case' 0 N--CA 1.527 3.388 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 178.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 7.6 t -125.55 -15.41 6.09 Favored 'General case' 0 N--CA 1.519 3.001 0 CA-C-O 117.484 -1.246 . . . . 0.0 114.05 -176.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -98.81 -55.43 2.72 Favored 'General case' 0 N--CA 1.533 3.703 0 CA-C-N 120.803 1.638 . . . . 0.0 111.582 -178.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -107.49 -38.48 5.91 Favored 'General case' 0 N--CA 1.532 3.641 0 C-N-CA 123.433 0.693 . . . . 0.0 111.728 -177.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -81.52 -8.71 59.76 Favored 'General case' 0 N--CA 1.518 2.966 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -176.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 26.1 tp -85.85 -48.6 8.61 Favored 'General case' 0 N--CA 1.535 3.783 0 CA-C-N 120.306 1.412 . . . . 0.0 112.973 -177.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -45.57 -29.54 1.22 Allowed 'General case' 1 N--CA 1.555 4.784 0 CA-C-N 120.23 1.377 . . . . 0.0 113.866 -177.517 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -67.09 -41.53 86.15 Favored 'General case' 1 N--CA 1.54 4.034 0 CA-C-N 118.819 0.736 . . . . 0.0 110.26 -179.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -48.41 -62.22 1.61 Allowed 'General case' 0 N--CA 1.529 3.5 0 C-N-CA 125.167 1.387 . . . . 0.0 113.157 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 3.4 pp -119.09 -39.76 2.89 Favored 'General case' 0 N--CA 1.532 3.666 0 CA-C-N 118.736 0.698 . . . . 0.0 111.705 -179.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 120.62 37.24 0.74 Allowed Glycine 1 N--CA 1.527 4.729 0 CA-C-O 118.572 -1.127 . . . . 0.0 111.953 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -89.23 108.52 19.66 Favored 'General case' 0 N--CA 1.521 3.109 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 177.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -43.13 170.33 0.01 OUTLIER Glycine 1 N--CA 1.53 4.903 0 C-N-CA 125.095 1.331 . . . . 0.0 115.685 -177.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -84.14 -15.57 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.642 0 CA-C-O 117.549 -1.215 . . . . 0.0 108.724 177.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -70.09 -38.65 75.72 Favored 'General case' 0 N--CA 1.523 3.217 0 CA-C-N 120.213 1.37 . . . . 0.0 108.951 176.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -79.66 -36.3 37.93 Favored 'General case' 0 N--CA 1.539 3.996 0 CA-C-N 118.609 0.641 . . . . 0.0 112.247 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 1.6 tt -71.01 -37.67 68.69 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.212 0 C-N-CA 122.9 0.48 . . . . 0.0 111.601 -175.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 65.0 p -98.25 -23.56 15.61 Favored 'General case' 0 N--CA 1.512 2.633 0 CA-C-O 117.968 -1.015 . . . . 0.0 111.746 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 13.8 ptt180 -79.7 -22.06 43.85 Favored 'General case' 0 N--CA 1.531 3.622 0 CA-C-N 120.164 1.347 . . . . 0.0 108.355 173.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -65.36 -33.63 87.14 Favored Glycine 1 N--CA 1.519 4.214 0 N-CA-C 108.975 -1.65 . . . . 0.0 108.975 175.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 83.0 p -64.1 -32.79 74.48 Favored 'General case' 0 N--CA 1.537 3.9 0 CA-C-N 118.224 1.012 . . . . 0.0 109.97 176.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -62.1 -31.53 71.99 Favored 'General case' 0 N--CA 1.538 3.962 0 C-N-CA 123.501 0.72 . . . . 0.0 110.826 178.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 50.3 m -63.17 -43.19 98.95 Favored 'General case' 1 N--CA 1.541 4.096 0 C-N-CA 123.379 0.672 . . . . 0.0 110.318 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 36.1 mt -54.86 -44.74 74.27 Favored 'General case' 0 N--CA 1.527 3.38 0 C-N-CA 124.015 0.926 . . . . 0.0 110.96 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -29.08 66.67 Favored 'General case' 0 N--CA 1.537 3.876 0 CA-C-O 118.76 -0.638 . . . . 0.0 111.135 178.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -64.84 -42.9 94.54 Favored 'General case' 0 N--CA 1.528 3.47 0 CA-C-N 118.737 0.699 . . . . 0.0 110.957 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -65.44 162.7 39.41 Favored Pre-proline 0 N--CA 1.534 3.767 0 CA-C-O 118.426 -0.797 . . . . 0.0 112.165 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -79.23 179.77 6.13 Favored 'Trans proline' 0 C--N 1.38 2.185 0 C-N-CA 122.02 1.813 . . . . 0.0 111.081 178.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -94.27 -26.36 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.306 0 CA-C-O 118.01 -0.995 . . . . 0.0 111.495 -178.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -61.39 -45.1 95.77 Favored 'General case' 0 N--CA 1.517 2.898 0 CA-C-N 119.837 1.198 . . . . 0.0 109.47 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 6.9 mp -97.06 -9.09 28.78 Favored 'General case' 0 N--CA 1.508 2.466 0 C-N-CA 123.233 0.613 . . . . 0.0 111.843 179.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.68 -39.18 93.22 Favored 'General case' 1 N--CA 1.548 4.464 0 N-CA-C 102.516 -3.142 . . . . 0.0 102.516 167.456 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -49.84 -36.77 27.96 Favored 'General case' 0 N--CA 1.519 2.985 0 C-N-CA 124.311 1.044 . . . . 0.0 111.676 174.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 599' ' ' TRP . . . . . 0.458 ' HA ' ' HB2' ' B' ' 602' ' ' GLU . 39.0 t90 -64.5 -40.67 96.09 Favored 'General case' 0 N--CA 1.528 3.468 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 178.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 10.6 mp -54.17 -32.83 56.55 Favored 'General case' 1 N--CA 1.544 4.228 0 CA-C-N 118.92 0.782 . . . . 0.0 109.226 176.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -74.96 -34.56 62.05 Favored 'General case' 0 N--CA 1.528 3.468 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 176.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 602' ' ' GLU . . . . . 0.458 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.5 OUTLIER -63.99 -22.77 67.07 Favored 'General case' 1 N--CA 1.549 4.501 0 C-N-CA 124.903 1.281 . . . . 0.0 111.405 175.969 . . . . . . . . 4 4 . 1 . 009 nuclear orig core ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -108.8 -20.77 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.611 0 CA-C-O 118.01 -0.995 . . . . 0.0 112.231 -175.067 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 7.2 mp -88.78 -58.68 2.46 Favored 'General case' 0 N--CA 1.523 3.193 0 N-CA-C 105.499 -2.038 . . . . 0.0 105.499 175.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.528 3.457 0 C-N-CA 123.636 0.774 . . . . 0.0 110.658 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 . . . . . 0 N--CA 1.521 3.092 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.476 ' HA ' HD21 ' B' ' 551' ' ' LEU . 74.4 t-105 -50.62 -39.5 50.37 Favored 'General case' 0 N--CA 1.538 3.945 0 CA-C-N 119.572 1.078 . . . . 0.0 110.969 178.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -81.18 -27.7 35.28 Favored 'General case' 0 N--CA 1.524 3.271 0 CA-C-O 117.792 -1.099 . . . . 0.0 112.387 -174.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.31 -28.12 66.51 Favored 'General case' 1 N--CA 1.54 4.072 0 N-CA-C 106.306 -1.738 . . . . 0.0 106.306 172.338 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.457 ' CG ' HD22 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -82.52 -37.46 25.21 Favored 'General case' 0 N--CA 1.503 2.215 0 CA-C-O 116.755 -1.593 . . . . 0.0 108.822 173.778 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.9 t -67.06 -25.37 34.01 Favored 'Isoleucine or valine' 1 N--CA 1.563 5.215 0 CA-C-N 121.283 1.856 . . . . 0.0 112.444 -176.255 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -78.03 -51.46 10.29 Favored 'General case' 0 N--CA 1.534 3.736 0 CA-C-N 119.901 1.228 . . . . 0.0 107.916 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.94 -19.83 65.79 Favored 'General case' 0 N--CA 1.537 3.889 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 176.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.36 -40.4 67.35 Favored 'General case' 0 N--CA 1.515 2.797 0 CA-C-O 117.873 -1.06 . . . . 0.0 108.153 177.465 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -59.77 -20.96 59.9 Favored 'General case' 0 N--CA 1.531 3.603 0 CA-C-O 118.3 -0.857 . . . . 0.0 111.42 176.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -73.6 -43.63 59.2 Favored 'General case' 0 N--CA 1.531 3.603 0 CA-C-N 119.273 0.942 . . . . 0.0 108.684 176.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.404 ' HB2' ' N ' ' A' ' 35' ' ' HIS . . . -89.5 -1.53 58.07 Favored 'General case' 0 N--CA 1.511 2.6 0 CA-C-O 118.818 -0.61 . . . . 0.0 110.843 177.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -89.03 -34.64 16.73 Favored 'General case' 0 N--CA 1.533 3.683 0 CA-C-N 120.003 1.274 . . . . 0.0 108.594 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -65.04 -40.58 94.98 Favored 'General case' 0 N--CA 1.532 3.635 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 176.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 -89.99 -89.46 0.16 Allowed 'General case' 0 N--CA 1.513 2.709 0 N-CA-C 106.766 -1.568 . . . . 0.0 106.766 176.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 p30 153.11 44.64 0.0 OUTLIER 'General case' 1 N--CA 1.561 5.103 0 C-N-CA 127.504 2.322 . . . . 0.0 109.034 177.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.1 mt -103.08 15.14 30.16 Favored 'General case' 0 N--CA 1.524 3.268 0 C-N-CA 123.966 0.907 . . . . 0.0 110.901 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.511 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 54.5 p-80 -84.91 5.5 28.71 Favored 'General case' 0 CA--C 1.594 2.648 0 C-N-CA 123.38 0.672 . . . . 0.0 109.22 174.844 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.417 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 18.9 mt -95.53 -49.58 0.25 Allowed Pre-proline 0 N--CA 1.508 2.466 0 C-N-CA 125.792 1.637 . . . . 0.0 109.031 -175.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.417 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 4.4 Cg_exo -67.21 -37.32 18.64 Favored 'Trans proline' 0 C--N 1.388 2.64 0 N-CA-C 106.053 -2.326 . . . . 0.0 106.053 169.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.511 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 1.9 tm? -60.64 -36.75 79.42 Favored 'General case' 0 N--CA 1.53 3.565 0 C-N-CA 124.058 0.943 . . . . 0.0 108.839 175.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.18 -49.43 77.9 Favored 'General case' 1 N--CA 1.553 4.71 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 176.134 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.5 t30 -59.28 -15.59 16.63 Favored 'General case' 0 N--CA 1.536 3.832 0 CA-C-O 118.113 -0.946 . . . . 0.0 113.52 -178.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -103.72 -46.77 4.42 Favored 'General case' 0 N--CA 1.522 3.133 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 -177.178 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.3 ptt? -122.04 14.87 10.71 Favored 'General case' 1 N--CA 1.554 4.748 0 CA-C-N 120.014 1.279 . . . . 0.0 113.016 -174.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.7 mp -123.06 -48.97 1.97 Allowed 'General case' 0 N--CA 1.494 1.725 0 CA-C-O 117.702 -1.142 . . . . 0.0 110.432 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 77.5 p 107.27 158.94 0.0 OUTLIER Pre-proline 1 N--CA 1.566 5.333 0 C-N-CA 127.642 2.377 . . . . 0.0 110.919 -179.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo -71.86 -32.14 11.8 Favored 'Trans proline' 0 C--N 1.391 2.789 0 C-N-CA 122.145 1.897 . . . . 0.0 107.371 172.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -69.03 -14.79 63.24 Favored 'General case' 0 N--CA 1.521 3.114 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.695 176.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -77.94 -40.74 38.54 Favored 'General case' 0 N--CA 1.514 2.744 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 177.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.9 ptt-85 -83.36 -11.5 57.56 Favored 'General case' 0 N--CA 1.532 3.662 0 CA-C-N 119.253 0.933 . . . . 0.0 109.933 175.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -74.12 -39.44 63.34 Favored 'General case' 0 N--CA 1.525 3.302 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 174.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -84.24 -31.4 25.02 Favored 'General case' 0 N--CA 1.501 2.102 0 CA-C-O 117.432 -1.271 . . . . 0.0 110.357 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 17.9 tp -70.35 -25.53 63.32 Favored 'General case' 1 N--CA 1.545 4.28 0 CA-C-N 120.961 1.71 . . . . 0.0 106.82 173.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.402 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -65.28 -73.45 0.59 Allowed Glycine 0 N--CA 1.507 3.382 0 C-N-CA 125.56 1.552 . . . . 0.0 111.295 176.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 m -69.66 -25.56 63.96 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-O 117.736 -1.126 . . . . 0.0 113.159 -177.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 36.7 mtm180 -71.54 -48.34 49.29 Favored 'General case' 0 N--CA 1.53 3.529 0 CA-C-N 120.101 1.319 . . . . 0.0 107.849 178.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.6 t -67.06 -18.07 23.64 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.042 0 CA-C-N 119.543 1.065 . . . . 0.0 109.684 175.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.82 -48.46 31.16 Favored 'General case' 0 N--CA 1.529 3.52 0 CA-C-N 119.828 1.195 . . . . 0.0 111.559 178.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.93 -24.84 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.555 0 CA-C-N 120.619 1.554 . . . . 0.0 111.378 -178.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -85.01 -49.33 15.79 Favored 'Isoleucine or valine' 1 N--CA 1.546 4.354 0 CA-C-N 120.419 1.463 . . . . 0.0 107.666 -179.228 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -62.04 -27.33 68.81 Favored 'General case' 0 N--CA 1.528 3.441 0 CA-C-O 118.917 -0.563 . . . . 0.0 109.961 178.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -91.21 -19.62 22.84 Favored 'General case' 0 N--CA 1.521 3.106 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.683 177.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.2 mt -76.68 -47.09 23.16 Favored 'General case' 0 N--CA 1.537 3.91 0 CA-C-N 119.71 1.141 . . . . 0.0 108.55 178.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 47.4 mt -52.6 -27.6 17.59 Favored 'General case' 0 N--CA 1.539 3.986 0 C-N-CA 124.366 1.066 . . . . 0.0 112.319 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 27.9 mmm180 -92.31 -48.61 6.58 Favored 'General case' 0 N--CA 1.526 3.333 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.4 79.3 0.46 Allowed Glycine 1 N--CA 1.52 4.241 0 CA-C-O 119.433 -0.648 . . . . 0.0 111.933 178.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -143.74 -59.44 0.4 Allowed 'General case' 0 N--CA 1.524 3.265 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 38.5 mtt -137.0 70.62 1.4 Allowed 'General case' 0 N--CA 1.522 3.149 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 178.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 9.7 t -128.77 -25.39 2.84 Favored 'General case' 0 N--CA 1.524 3.237 0 CA-C-O 117.573 -1.203 . . . . 0.0 113.634 -176.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -104.48 -59.89 1.67 Allowed 'General case' 0 N--CA 1.531 3.589 0 CA-C-N 120.166 1.348 . . . . 0.0 112.352 -176.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.79 -62.83 1.37 Allowed 'General case' 0 N--CA 1.527 3.421 0 C-N-CA 122.916 0.486 . . . . 0.0 111.741 -176.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -73.7 -3.54 28.91 Favored 'General case' 0 N--CA 1.52 3.033 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -176.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 46.2 tp -78.51 -51.38 10.06 Favored 'General case' 0 N--CA 1.525 3.308 0 CA-C-N 120.35 1.432 . . . . 0.0 112.683 -178.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -44.65 -31.29 1.11 Allowed 'General case' 1 N--CA 1.547 4.418 0 CA-C-N 119.612 1.096 . . . . 0.0 113.787 -176.538 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 25.2 t30 -71.67 -41.09 69.14 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-N 118.389 0.54 . . . . 0.0 110.459 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -62.97 -56.43 17.21 Favored 'General case' 0 N--CA 1.524 3.235 0 C-N-CA 124.076 0.95 . . . . 0.0 112.667 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 42.7 mt -99.54 -53.44 3.2 Favored 'General case' 0 N--CA 1.531 3.599 0 C-N-CA 123.013 0.525 . . . . 0.0 111.6 -177.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 117.23 25.49 3.22 Favored Glycine 1 N--CA 1.525 4.619 0 CA-C-O 118.392 -1.226 . . . . 0.0 111.186 -177.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -93.51 119.93 33.17 Favored 'General case' 0 N--CA 1.515 2.804 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 178.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -45.24 171.3 0.01 OUTLIER Glycine 1 N--CA 1.533 5.103 0 C-N-CA 124.253 0.93 . . . . 0.0 115.07 -178.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -80.21 -17.1 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.907 0 CA-C-O 117.9 -1.047 . . . . 0.0 108.594 178.126 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.33 -36.12 76.61 Favored 'General case' 0 N--CA 1.524 3.234 0 CA-C-N 119.584 1.083 . . . . 0.0 110.747 178.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.7 p -80.21 -42.16 23.82 Favored 'General case' 0 N--CA 1.536 3.864 0 CA-C-N 119.315 0.961 . . . . 0.0 111.526 -179.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.8 pt -71.68 -17.32 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.903 0 CA-C-O 117.597 -1.192 . . . . 0.0 113.632 -177.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 63.3 p -111.85 -28.89 7.88 Favored 'General case' 0 N--CA 1.515 2.821 0 CA-C-N 120.039 1.29 . . . . 0.0 110.833 178.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.6 ptt180 -76.4 -22.01 55.27 Favored 'General case' 0 N--CA 1.524 3.274 0 CA-C-N 119.605 1.093 . . . . 0.0 108.175 174.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -62.13 -36.07 92.42 Favored Glycine 1 N--CA 1.516 4.023 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 177.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 74.5 p -66.5 -33.09 74.92 Favored 'General case' 0 N--CA 1.535 3.783 0 CA-C-N 118.27 1.035 . . . . 0.0 109.971 176.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -61.21 -32.74 72.51 Favored 'General case' 1 N--CA 1.543 4.179 0 C-N-CA 123.474 0.71 . . . . 0.0 111.307 178.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.1 m -58.79 -38.51 78.72 Favored 'General case' 1 N--CA 1.545 4.321 0 C-N-CA 123.5 0.72 . . . . 0.0 111.179 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 12.8 mt -58.86 -41.49 87.12 Favored 'General case' 0 N--CA 1.532 3.647 0 C-N-CA 124.303 1.041 . . . . 0.0 111.084 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.7 -20.54 65.8 Favored 'General case' 1 N--CA 1.539 4.013 0 CA-C-O 118.439 -0.791 . . . . 0.0 112.416 -179.669 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -86.54 -43.7 12.51 Favored 'General case' 0 N--CA 1.514 2.735 0 CA-C-N 118.876 0.762 . . . . 0.0 110.196 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.11 163.9 9.37 Favored Pre-proline 1 N--CA 1.543 4.192 0 CA-C-O 118.09 -0.957 . . . . 0.0 112.508 179.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -84.41 166.74 12.18 Favored 'Trans proline' 0 C--N 1.381 2.268 0 C-N-CA 121.886 1.724 . . . . 0.0 111.131 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 t -91.59 -23.08 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.075 0 CA-C-O 117.663 -1.161 . . . . 0.0 111.374 -179.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -61.15 -42.82 99.24 Favored 'General case' 0 N--CA 1.518 2.955 0 CA-C-N 120.316 1.416 . . . . 0.0 109.894 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.2 mp -98.08 -13.17 21.15 Favored 'General case' 0 N--CA 1.512 2.647 0 C-N-CA 123.527 0.731 . . . . 0.0 111.851 178.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -32.35 73.68 Favored 'General case' 1 N--CA 1.541 4.081 0 N-CA-C 103.397 -2.816 . . . . 0.0 103.397 167.732 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -53.93 -38.53 65.0 Favored 'General case' 0 N--CA 1.515 2.818 0 C-N-CA 124.735 1.214 . . . . 0.0 110.384 174.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.426 ' HA ' ' HB2' ' A' ' 102' ' ' GLU . 48.6 t90 -65.32 -37.94 88.63 Favored 'General case' 0 N--CA 1.53 3.542 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 176.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.35 -36.2 52.95 Favored 'General case' 1 N--CA 1.541 4.125 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 176.402 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -70.69 -38.42 73.71 Favored 'General case' 0 N--CA 1.539 3.989 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 175.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.426 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 2.6 mt-10 -58.62 -22.77 57.4 Favored 'General case' 1 N--CA 1.544 4.226 0 C-N-CA 123.938 0.895 . . . . 0.0 110.926 175.473 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -110.16 -2.68 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.332 0 CA-C-O 117.968 -1.015 . . . . 0.0 113.482 -175.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 7.0 mp -114.04 -61.37 1.75 Allowed 'General case' 0 N--CA 1.523 3.188 0 N-CA-C 106.419 -1.697 . . . . 0.0 106.419 174.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.5 tt . . . . . 1 N--CA 1.546 4.37 0 C-N-CA 125.056 1.343 . . . . 0.0 112.875 -178.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 . . . . . 0 N--CA 1.525 3.324 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 519' ' ' TRP . . . . . 0.466 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 63.4 t-105 -42.8 -27.58 0.19 Allowed 'General case' 1 N--CA 1.543 4.198 0 C-N-CA 124.213 1.005 . . . . 0.0 113.667 178.828 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 520' ' ' LEU . . . . . 0.416 ' CD2' ' N ' ' B' ' 520' ' ' LEU . 2.3 mm? -91.83 -33.38 14.98 Favored 'General case' 0 N--CA 1.523 3.221 0 CA-C-O 117.613 -1.184 . . . . 0.0 113.738 -171.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 16.0 ttp180 -64.79 -23.08 67.13 Favored 'General case' 0 N--CA 1.531 3.594 0 N-CA-C 106.125 -1.806 . . . . 0.0 106.125 171.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . 0.466 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.1 m-85 -78.04 -37.88 45.84 Favored 'General case' 0 N--CA 1.512 2.665 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 173.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 44.9 t -67.2 -20.09 26.34 Favored 'Isoleucine or valine' 1 N--CA 1.559 4.992 0 CA-C-O 117.799 -1.096 . . . . 0.0 111.352 177.366 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -76.52 -53.2 8.42 Favored 'General case' 0 N--CA 1.531 3.621 0 CA-C-N 120.337 1.426 . . . . 0.0 108.058 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 6.2 mp -67.57 -21.5 65.44 Favored 'General case' 0 N--CA 1.533 3.685 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 175.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -69.78 -36.06 75.41 Favored 'General case' 0 N--CA 1.519 3.02 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 176.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 9.6 tttt -67.31 -23.29 65.63 Favored 'General case' 0 N--CA 1.521 3.08 0 CA-C-O 118.409 -0.805 . . . . 0.0 110.905 176.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -72.21 -40.87 67.5 Favored 'General case' 0 N--CA 1.533 3.7 0 CA-C-N 119.151 0.887 . . . . 0.0 109.59 178.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 529' ' ' ALA . . . . . . . . . . . . . . . -86.79 -13.75 44.24 Favored 'General case' 0 N--CA 1.509 2.49 0 CA-C-O 118.719 -0.658 . . . . 0.0 110.517 178.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -74.99 -29.69 60.95 Favored 'General case' 0 N--CA 1.536 3.838 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 177.696 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -61.94 -49.62 75.39 Favored 'General case' 0 N--CA 1.532 3.659 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 177.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -91.95 -87.93 0.21 Allowed 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 177.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.6 p30 155.8 51.77 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.84 0 C-N-CA 127.325 2.25 . . . . 0.0 107.54 177.479 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 7.1 mt -109.95 11.33 24.12 Favored 'General case' 0 N--CA 1.529 3.523 0 C-N-CA 124.54 1.136 . . . . 0.0 110.988 -178.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 535' ' ' HIS . . . . . 0.404 ' HA ' ' HB3' ' B' ' 538' ' ' LEU . 40.7 p-80 -82.9 2.53 34.0 Favored 'General case' 0 N--CA 1.515 2.792 0 C-N-CA 123.419 0.688 . . . . 0.0 109.235 175.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 536' ' ' LEU . . . . . 0.409 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 36.4 mt -97.15 -50.69 0.23 Allowed Pre-proline 0 N--CA 1.509 2.507 0 CA-C-O 116.854 -1.546 . . . . 0.0 109.22 -175.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 537' ' ' PRO . . . . . 0.409 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 3.9 Cg_exo -68.68 -29.93 28.78 Favored 'Trans proline' 0 C--N 1.391 2.795 0 N-CA-C 106.79 -2.042 . . . . 0.0 106.79 171.086 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 538' ' ' LEU . . . . . 0.404 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 0.6 OUTLIER -65.28 -45.32 84.94 Favored 'General case' 0 N--CA 1.512 2.658 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 175.36 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 1.1 pp -76.52 -7.97 56.24 Favored 'General case' 0 N--CA 1.536 3.861 0 CA-C-N 118.992 0.814 . . . . 0.0 111.828 177.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -84.78 -0.69 54.66 Favored 'General case' 0 N--CA 1.525 3.303 0 CA-C-N 119.195 0.907 . . . . 0.0 109.635 175.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -118.72 -48.37 2.48 Favored 'General case' 0 N--CA 1.512 2.671 0 C-N-CA 125.039 1.336 . . . . 0.0 108.724 -178.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 4.0 ptm -101.3 11.86 38.51 Favored 'General case' 0 N--CA 1.538 3.932 0 CA-C-O 118.584 -0.722 . . . . 0.0 112.83 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -129.58 -86.24 0.54 Allowed 'General case' 0 N--CA 1.526 3.348 0 CA-C-O 117.322 -1.323 . . . . 0.0 112.182 -179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 7.8 p 137.08 137.39 0.0 OUTLIER Pre-proline 1 N--CA 1.569 5.515 0 C-N-CA 127.8 2.44 . . . . 0.0 107.289 -178.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -62.55 -29.65 78.57 Favored 'Trans proline' 0 N--CA 1.516 2.835 0 C-N-CA 122.839 2.359 . . . . 0.0 112.964 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -62.8 -28.5 70.04 Favored 'General case' 1 N--CA 1.54 4.069 0 CA-C-N 118.744 0.702 . . . . 0.0 111.282 179.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -70.72 -41.87 71.32 Favored 'General case' 0 N--CA 1.525 3.322 0 CA-C-O 118.712 -0.661 . . . . 0.0 109.918 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -72.9 -21.97 60.82 Favored 'General case' 0 N--CA 1.529 3.494 0 CA-C-O 118.273 -0.87 . . . . 0.0 111.276 177.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -66.36 -50.88 62.03 Favored 'General case' 1 N--CA 1.54 4.062 0 N-CA-C 106.614 -1.625 . . . . 0.0 106.614 175.634 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -76.55 -9.86 58.97 Favored 'General case' 0 N--CA 1.508 2.465 0 CA-C-O 117.363 -1.303 . . . . 0.0 111.026 177.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 551' ' ' LEU . . . . . 0.476 HD21 ' HA ' ' A' ' 19' ' ' TRP . 5.8 tp -79.88 -31.5 40.35 Favored 'General case' 0 N--CA 1.516 2.827 0 CA-C-N 120.158 1.344 . . . . 0.0 107.68 174.224 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -70.49 -56.17 7.88 Favored Glycine 0 N--CA 1.51 3.577 0 N-CA-C 108.68 -1.768 . . . . 0.0 108.68 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.5 m -64.88 -27.98 69.23 Favored 'General case' 0 N--CA 1.537 3.882 0 CA-C-O 118.043 -0.979 . . . . 0.0 112.042 -179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 6.5 mtm180 -69.26 -49.84 52.48 Favored 'General case' 1 N--CA 1.543 4.188 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 176.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 23.6 t -65.71 -16.89 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.679 0 CA-C-O 118.067 -0.968 . . . . 0.0 109.532 176.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 11.7 mtt180 -78.16 -47.29 18.45 Favored 'General case' 0 N--CA 1.521 3.113 0 CA-C-O 117.43 -1.271 . . . . 0.0 111.257 178.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 557' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.75 -22.66 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.527 0 CA-C-N 121.456 1.934 . . . . 0.0 110.918 -179.297 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 558' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -85.8 -51.05 13.84 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.002 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 179.979 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -57.26 -26.17 60.37 Favored 'General case' 0 N--CA 1.536 3.835 0 CA-C-O 118.543 -0.742 . . . . 0.0 110.178 177.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -90.39 -28.35 18.73 Favored 'General case' 0 N--CA 1.529 3.512 0 CA-C-O 118.586 -0.721 . . . . 0.0 109.749 177.412 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 6.8 mt -66.37 -44.01 84.34 Favored 'General case' 1 N--CA 1.546 4.342 0 CA-C-N 118.96 0.8 . . . . 0.0 109.552 178.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 14.7 mt -60.7 -22.91 64.44 Favored 'General case' 0 N--CA 1.534 3.761 0 C-N-CA 124.159 0.984 . . . . 0.0 111.795 179.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -82.62 -48.36 11.03 Favored 'General case' 0 N--CA 1.525 3.307 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 66.4 79.56 0.2 Allowed Glycine 1 N--CA 1.526 4.641 0 CA-C-O 119.318 -0.712 . . . . 0.0 111.663 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -155.8 -51.57 0.08 Allowed 'General case' 0 N--CA 1.527 3.388 0 CA-C-N 117.463 0.632 . . . . 0.0 109.56 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 10.5 ptt? -152.99 63.33 0.78 Allowed 'General case' 0 N--CA 1.527 3.419 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 78.6 p -130.63 3.19 4.54 Favored 'General case' 0 N--CA 1.522 3.131 0 CA-C-N 115.166 -0.924 . . . . 0.0 113.257 -176.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 42.4 mm-40 -110.02 -55.16 2.48 Favored 'General case' 0 N--CA 1.522 3.157 0 CA-C-N 119.579 1.081 . . . . 0.0 111.873 -178.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.94 -58.87 1.8 Allowed 'General case' 0 N--CA 1.529 3.52 0 CA-C-N 118.125 0.42 . . . . 0.0 111.875 -177.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -73.64 0.44 12.76 Favored 'General case' 0 N--CA 1.517 2.904 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -176.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 15.7 tp -77.67 -45.59 24.48 Favored 'General case' 0 N--CA 1.524 3.227 0 CA-C-N 120.299 1.409 . . . . 0.0 110.515 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.65 -37.01 65.17 Favored 'General case' 1 N--CA 1.544 4.233 0 CA-C-N 120.002 1.274 . . . . 0.0 110.889 178.303 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 31.0 t30 -61.71 -38.54 88.24 Favored 'General case' 0 N--CA 1.535 3.788 0 C-N-CA 123.154 0.581 . . . . 0.0 110.109 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -65.01 -64.01 0.97 Allowed 'General case' 0 N--CA 1.518 2.93 0 C-N-CA 124.078 0.951 . . . . 0.0 110.663 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 5.5 mp -97.81 -68.2 0.81 Allowed 'General case' 0 N--CA 1.522 3.13 0 C-N-CA 123.374 0.67 . . . . 0.0 111.044 -179.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 133.05 50.16 0.09 OUTLIER Glycine 1 N--CA 1.517 4.083 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 -178.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -111.18 114.72 28.16 Favored 'General case' 0 N--CA 1.52 3.067 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 178.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -41.88 167.34 0.01 OUTLIER Glycine 1 N--CA 1.535 5.267 0 C-N-CA 124.819 1.2 . . . . 0.0 115.914 -176.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 1.1 mp -81.86 -16.94 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.094 0 CA-C-O 117.643 -1.17 . . . . 0.0 108.438 176.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -68.74 -37.92 79.78 Favored 'General case' 0 N--CA 1.526 3.371 0 CA-C-N 120.047 1.294 . . . . 0.0 108.87 176.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.1 p -79.7 -37.24 36.14 Favored 'General case' 0 N--CA 1.534 3.733 0 C-N-CA 123.191 0.597 . . . . 0.0 112.544 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -70.86 -37.73 69.62 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.35 0 C-N-CA 123.336 0.654 . . . . 0.0 111.343 -175.096 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 82.3 p -95.22 -28.78 14.85 Favored 'General case' 0 N--CA 1.513 2.699 0 CA-C-O 117.987 -1.006 . . . . 0.0 111.003 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 14.2 ptt180 -74.65 -21.58 59.35 Favored 'General case' 0 N--CA 1.528 3.469 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 173.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -69.11 -26.49 74.62 Favored Glycine 1 N--CA 1.517 4.071 0 N-CA-C 108.464 -1.854 . . . . 0.0 108.464 173.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 16.4 m -68.41 -36.78 79.58 Favored 'General case' 1 N--CA 1.539 4.01 0 CA-C-N 118.293 1.046 . . . . 0.0 108.862 176.365 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -62.19 -22.35 65.84 Favored 'General case' 0 N--CA 1.539 3.977 0 C-N-CA 123.182 0.593 . . . . 0.0 110.478 176.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 62.4 m -47.63 -47.54 29.05 Favored 'General case' 1 N--CA 1.544 4.226 0 C-N-CA 124.97 1.308 . . . . 0.0 111.091 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 28.0 mt -69.58 -41.14 76.19 Favored 'General case' 0 N--CA 1.519 2.986 0 C-N-CA 123.655 0.782 . . . . 0.0 109.974 178.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 12.1 mmpt? -55.3 -29.11 57.57 Favored 'General case' 1 N--CA 1.545 4.297 0 C-N-CA 123.684 0.794 . . . . 0.0 112.361 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -82.81 -44.8 15.1 Favored 'General case' 0 N--CA 1.515 2.792 0 C-N-CA 123.104 0.562 . . . . 0.0 110.586 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -70.08 158.9 86.26 Favored Pre-proline 0 N--CA 1.53 3.544 0 CA-C-O 118.518 -0.753 . . . . 0.0 112.496 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -81.2 176.29 8.94 Favored 'Trans proline' 0 C--N 1.379 2.142 0 C-N-CA 122.273 1.982 . . . . 0.0 111.064 178.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.1 t -89.81 -26.71 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.522 3.149 0 CA-C-O 117.708 -1.139 . . . . 0.0 111.609 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -62.75 -39.17 93.29 Favored 'General case' 0 N--CA 1.516 2.852 0 CA-C-N 120.159 1.345 . . . . 0.0 109.872 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 6.7 mp -100.26 -11.04 20.7 Favored 'General case' 0 N--CA 1.514 2.74 0 C-N-CA 123.564 0.746 . . . . 0.0 112.103 177.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -33.3 75.36 Favored 'General case' 1 N--CA 1.543 4.207 0 N-CA-C 102.344 -3.206 . . . . 0.0 102.344 165.996 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -56.63 -36.57 69.64 Favored 'General case' 0 N--CA 1.52 3.043 0 C-N-CA 124.712 1.205 . . . . 0.0 110.465 174.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 599' ' ' TRP . . . . . 0.404 ' HA ' ' HB2' ' B' ' 602' ' ' GLU . 35.4 t90 -63.25 -37.06 85.75 Favored 'General case' 1 N--CA 1.54 4.053 0 N-CA-C 107.092 -1.447 . . . . 0.0 107.092 176.439 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.79 -35.89 57.35 Favored 'General case' 0 N--CA 1.538 3.957 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 176.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -71.28 -37.0 71.89 Favored 'General case' 1 N--CA 1.541 4.111 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 175.366 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 602' ' ' GLU . . . . . 0.404 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 2.7 mt-10 -60.34 -22.87 63.74 Favored 'General case' 1 N--CA 1.544 4.247 0 C-N-CA 123.5 0.72 . . . . 0.0 109.861 174.656 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -115.48 1.65 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.407 0 CA-C-O 118.423 -0.798 . . . . 0.0 112.471 -177.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 42.8 mt -108.28 -64.85 1.18 Allowed 'General case' 0 N--CA 1.523 3.212 0 N-CA-C 104.666 -2.346 . . . . 0.0 104.666 174.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 6.4 tp . . . . . 0 N--CA 1.537 3.875 0 C-N-CA 125.442 1.497 . . . . 0.0 111.912 178.461 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 . . . . . 0 N--CA 1.52 3.064 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.425 ' CZ3' HD23 ' B' ' 551' ' ' LEU . 76.4 t-105 -51.03 -42.35 60.41 Favored 'General case' 0 N--CA 1.532 3.625 0 C-N-CA 123.359 0.664 . . . . 0.0 110.085 176.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -77.77 -28.18 50.49 Favored 'General case' 0 N--CA 1.516 2.833 0 O-C-N 124.925 1.391 . . . . 0.0 112.112 -176.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 27.7 tpt180 -57.9 -27.76 63.6 Favored 'General case' 1 N--CA 1.539 4.005 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 173.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.499 ' CG ' HD22 ' B' ' 551' ' ' LEU . 0.1 OUTLIER -81.6 -39.56 24.33 Favored 'General case' 0 N--CA 1.509 2.495 0 CA-C-O 117.092 -1.432 . . . . 0.0 108.829 172.876 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 26.3 t -66.97 -38.67 81.83 Favored 'Isoleucine or valine' 1 N--CA 1.561 5.085 0 CA-C-N 120.207 1.367 . . . . 0.0 113.478 -174.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -67.79 -50.87 54.61 Favored 'General case' 1 N--CA 1.542 4.135 0 CA-C-N 120.027 1.285 . . . . 0.0 109.349 -178.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.1 mp -69.86 -17.47 63.37 Favored 'General case' 0 N--CA 1.533 3.709 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 175.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.08 -37.82 84.64 Favored 'General case' 0 N--CA 1.519 3.004 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 175.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.9 ttmt -63.44 -23.48 67.42 Favored 'General case' 0 N--CA 1.526 3.348 0 CA-C-O 118.303 -0.856 . . . . 0.0 111.385 177.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -70.88 -41.89 70.74 Favored 'General case' 0 N--CA 1.534 3.751 0 CA-C-N 119.221 0.919 . . . . 0.0 108.525 176.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.459 ' HB2' ' N ' ' A' ' 35' ' ' HIS . . . -89.24 -3.28 58.61 Favored 'General case' 0 CA--C 1.581 2.153 0 CA-C-O 118.446 -0.788 . . . . 0.0 110.672 177.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -86.5 -36.72 18.84 Favored 'General case' 0 N--CA 1.534 3.739 0 CA-C-N 120.513 1.506 . . . . 0.0 108.832 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -59.78 -44.33 93.97 Favored 'General case' 0 N--CA 1.536 3.853 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 177.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -87.44 -86.47 0.16 Allowed 'General case' 0 N--CA 1.514 2.741 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 176.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 p30 149.31 45.15 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.912 0 C-N-CA 127.656 2.382 . . . . 0.0 109.109 177.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.7 mt -104.79 15.33 28.07 Favored 'General case' 0 N--CA 1.528 3.436 0 C-N-CA 124.177 0.991 . . . . 0.0 110.25 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.497 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 48.9 p-80 -84.7 6.64 23.42 Favored 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 175.115 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.488 ' HA ' HD22 ' A' ' 39' ' ' LEU . 26.7 mt -95.58 -52.29 0.23 Allowed Pre-proline 0 N--CA 1.501 2.097 0 CA-C-O 116.942 -1.504 . . . . 0.0 108.633 -175.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.452 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 4.3 Cg_exo -67.16 -33.5 31.06 Favored 'Trans proline' 0 C--N 1.39 2.726 0 N-CA-C 106.64 -2.1 . . . . 0.0 106.64 170.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.497 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.6 OUTLIER -63.45 -40.64 97.68 Favored 'General case' 0 N--CA 1.517 2.884 0 CA-C-O 118.01 -0.995 . . . . 0.0 109.203 176.887 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.488 HD22 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -75.91 -18.45 59.37 Favored 'General case' 1 N--CA 1.544 4.231 0 CA-C-N 119.921 1.237 . . . . 0.0 110.46 177.333 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -80.09 -7.39 58.86 Favored 'General case' 0 N--CA 1.525 3.325 0 CA-C-N 119.45 1.023 . . . . 0.0 110.062 175.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -106.46 -60.26 1.68 Allowed 'General case' 0 N--CA 1.521 3.112 0 C-N-CA 124.019 0.927 . . . . 0.0 111.58 -178.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 13.5 ptt? -93.47 3.76 55.05 Favored 'General case' 1 N--CA 1.546 4.353 0 CA-C-N 119.442 1.019 . . . . 0.0 113.504 -177.056 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.1 mp -120.73 -94.63 0.5 Allowed 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 178.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 156.55 169.82 0.01 OUTLIER Pre-proline 1 N--CA 1.575 5.801 0 C-N-CA 125.747 1.619 . . . . 0.0 109.685 179.706 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -68.29 -37.37 14.02 Favored 'Trans proline' 0 C--N 1.392 2.841 0 C-N-CA 121.918 1.745 . . . . 0.0 108.099 174.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -64.25 -22.33 66.91 Favored 'General case' 0 N--CA 1.527 3.404 0 C-N-CA 123.518 0.727 . . . . 0.0 110.418 176.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -70.22 -38.45 75.25 Favored 'General case' 0 N--CA 1.524 3.257 0 CA-C-O 117.438 -1.267 . . . . 0.0 109.867 178.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 26.1 ptt180 -80.91 -17.34 50.92 Favored 'General case' 0 N--CA 1.539 3.986 0 CA-C-N 119.992 1.269 . . . . 0.0 108.32 173.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -74.47 -18.63 60.6 Favored 'General case' 0 N--CA 1.52 3.045 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 172.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.14 -46.81 8.21 Favored 'General case' 0 N--CA 1.504 2.264 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 178.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.475 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 23.6 tp -66.81 -21.12 66.04 Favored 'General case' 1 N--CA 1.546 4.357 0 CA-C-N 120.613 1.551 . . . . 0.0 108.005 173.966 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.406 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -71.04 -72.21 0.93 Allowed Glycine 0 N--CA 1.502 3.089 0 C-N-CA 125.707 1.623 . . . . 0.0 111.421 177.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.9 m -70.18 -25.21 63.32 Favored 'General case' 0 N--CA 1.532 3.659 0 CA-C-O 117.639 -1.172 . . . . 0.0 112.526 -177.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -73.61 -51.8 15.59 Favored 'General case' 0 N--CA 1.53 3.539 0 CA-C-N 120.213 1.37 . . . . 0.0 107.545 177.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.2 t -62.23 -18.41 19.97 Favored 'Isoleucine or valine' 1 N--CA 1.545 4.309 0 CA-C-N 119.472 1.033 . . . . 0.0 109.853 175.067 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.6 mmm180 -75.86 -48.48 21.3 Favored 'General case' 0 N--CA 1.517 2.897 0 CA-C-O 117.343 -1.313 . . . . 0.0 111.903 178.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -71.32 -21.63 21.89 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.439 0 CA-C-N 121.171 1.805 . . . . 0.0 111.303 -178.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -87.69 -52.01 11.97 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.011 0 CA-C-N 119.96 1.255 . . . . 0.0 107.869 -178.91 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -62.73 -21.6 65.92 Favored 'General case' 0 N--CA 1.528 3.474 0 CA-C-O 118.58 -0.724 . . . . 0.0 110.202 177.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -91.86 -23.96 19.49 Favored 'General case' 0 N--CA 1.526 3.338 0 CA-C-O 118.082 -0.961 . . . . 0.0 110.273 177.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.6 mt -77.62 -61.86 1.85 Allowed 'General case' 0 N--CA 1.535 3.801 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 178.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.3 tt -43.4 -37.85 2.51 Favored 'General case' 1 N--CA 1.545 4.321 0 C-N-CA 125.98 1.712 . . . . 0.0 112.798 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -87.99 -62.64 1.45 Allowed 'General case' 0 N--CA 1.524 3.269 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.17 83.29 1.43 Allowed Glycine 0 N--CA 1.513 3.821 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 179.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -131.21 -58.3 1.0 Allowed 'General case' 0 N--CA 1.521 3.12 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 15.1 ptt? -154.4 82.32 1.12 Allowed 'General case' 0 N--CA 1.522 3.159 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 178.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 3.8 t -130.0 -9.52 4.35 Favored 'General case' 0 N--CA 1.523 3.214 0 CA-C-O 117.993 -1.003 . . . . 0.0 113.464 -176.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -106.75 -65.27 1.1 Allowed 'General case' 0 N--CA 1.533 3.71 0 CA-C-N 120.437 1.472 . . . . 0.0 111.54 -177.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.4 mtt180 -104.71 -45.88 4.48 Favored 'General case' 0 N--CA 1.53 3.533 0 C-N-CA 123.148 0.579 . . . . 0.0 109.843 -178.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -66.82 -10.35 46.96 Favored 'General case' 0 N--CA 1.52 3.062 0 CA-C-O 118.376 -0.821 . . . . 0.0 112.962 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 28.6 tp -88.73 -55.44 3.71 Favored 'General case' 0 N--CA 1.524 3.234 0 CA-C-N 119.748 1.158 . . . . 0.0 113.186 -177.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -37.99 -37.47 0.26 Allowed 'General case' 1 N--CA 1.552 4.664 0 N-CA-C 114.217 1.192 . . . . 0.0 114.217 -177.118 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -73.72 -44.11 57.3 Favored 'General case' 0 N--CA 1.533 3.687 0 CA-C-N 118.158 0.435 . . . . 0.0 110.411 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -46.57 -49.51 18.69 Favored 'General case' 0 N--CA 1.533 3.692 0 C-N-CA 124.888 1.275 . . . . 0.0 113.49 -179.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.4 pp -132.34 -43.0 0.95 Allowed 'General case' 0 N--CA 1.532 3.656 0 CA-C-O 118.803 -0.618 . . . . 0.0 111.974 -178.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 111.62 74.88 0.74 Allowed Glycine 1 N--CA 1.525 4.61 0 N-CA-C 110.588 -1.005 . . . . 0.0 110.588 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.68 -37.48 5.9 Favored 'General case' 0 N--CA 1.526 3.334 0 C-N-CA 123.409 0.684 . . . . 0.0 110.528 179.047 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 100.16 163.8 28.66 Favored Glycine 1 N--CA 1.523 4.459 0 N-CA-C 109.429 -1.468 . . . . 0.0 109.429 -177.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.0 mt -86.57 -11.49 11.1 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.664 0 CA-C-N 119.403 1.602 . . . . 0.0 109.296 178.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.34 -36.93 68.95 Favored 'General case' 0 N--CA 1.526 3.326 0 CA-C-N 119.93 1.241 . . . . 0.0 110.49 176.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.2 p -83.93 -39.18 20.1 Favored 'General case' 1 N--CA 1.541 4.081 0 CA-C-N 119.517 1.053 . . . . 0.0 112.227 -179.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.8 pt -73.28 -14.79 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.718 0 CA-C-O 117.85 -1.071 . . . . 0.0 112.938 -177.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 50.3 p -112.6 -33.18 6.22 Favored 'General case' 0 N--CA 1.514 2.755 0 CA-C-N 119.951 1.251 . . . . 0.0 110.184 178.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 13.8 ptt180 -72.81 -21.46 60.97 Favored 'General case' 0 N--CA 1.532 3.659 0 CA-C-N 119.464 1.029 . . . . 0.0 108.426 174.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -64.73 -33.49 87.37 Favored Glycine 1 N--CA 1.52 4.249 0 N-CA-C 109.313 -1.515 . . . . 0.0 109.313 175.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.6 t -63.96 -33.18 75.15 Favored 'General case' 1 N--CA 1.539 4.021 0 CA-C-N 118.282 1.041 . . . . 0.0 109.748 176.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -55.65 -33.8 64.39 Favored 'General case' 1 N--CA 1.547 4.376 0 C-N-CA 123.335 0.654 . . . . 0.0 111.285 177.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.7 m -62.15 -34.71 76.91 Favored 'General case' 1 N--CA 1.54 4.043 0 C-N-CA 123.728 0.811 . . . . 0.0 112.114 -179.56 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.3 mt -56.13 -42.32 76.73 Favored 'General case' 0 N--CA 1.536 3.831 0 C-N-CA 123.892 0.877 . . . . 0.0 111.166 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -21.53 61.49 Favored 'General case' 0 N--CA 1.534 3.739 0 CA-C-O 118.244 -0.884 . . . . 0.0 112.116 -179.401 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.76 -41.65 26.17 Favored 'General case' 0 N--CA 1.517 2.892 0 CA-C-N 119.157 0.889 . . . . 0.0 111.669 -179.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.17 159.9 13.56 Favored Pre-proline 1 N--CA 1.543 4.203 0 CA-C-O 118.471 -0.776 . . . . 0.0 113.079 -178.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -85.1 157.22 11.32 Favored 'Trans proline' 0 C--N 1.379 2.183 0 C-N-CA 122.285 1.99 . . . . 0.0 110.261 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 t -78.54 -27.71 14.22 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.114 0 CA-C-O 117.873 -1.061 . . . . 0.0 111.102 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -58.82 -44.21 90.79 Favored 'General case' 0 N--CA 1.518 2.932 0 CA-C-N 120.173 1.351 . . . . 0.0 109.949 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.7 mp -100.18 -7.46 24.73 Favored 'General case' 0 N--CA 1.512 2.667 0 CA-C-O 118.362 -0.827 . . . . 0.0 112.71 177.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -35.86 81.9 Favored 'General case' 0 N--CA 1.539 3.979 0 N-CA-C 102.361 -3.2 . . . . 0.0 102.361 168.048 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.59 -40.39 65.64 Favored 'General case' 0 N--CA 1.515 2.794 0 C-N-CA 124.492 1.117 . . . . 0.0 111.332 174.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 51.5 t90 -64.47 -35.59 81.44 Favored 'General case' 1 N--CA 1.541 4.09 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 177.601 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.57 -37.69 63.17 Favored 'General case' 0 N--CA 1.533 3.681 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 176.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -69.0 -37.24 78.6 Favored 'General case' 1 N--CA 1.539 4.016 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 175.5 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.15 -25.31 61.32 Favored 'General case' 1 N--CA 1.542 4.156 0 C-N-CA 123.089 0.556 . . . . 0.0 110.067 175.575 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -120.37 5.51 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.482 0 C-N-CA 123.592 0.757 . . . . 0.0 112.792 -176.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -125.45 -56.85 1.5 Allowed 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 178.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 4.1 tt . . . . . 1 N--CA 1.544 4.273 0 C-N-CA 124.914 1.286 . . . . 0.0 113.524 -179.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 . . . . . 0 N--CA 1.523 3.212 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 519' ' ' TRP . . . . . 0.431 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 71.7 t-105 -43.07 -28.66 0.29 Allowed 'General case' 1 N--CA 1.55 4.555 0 C-N-CA 124.279 1.032 . . . . 0.0 113.424 179.855 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 520' ' ' LEU . . . . . 0.404 ' CD2' ' N ' ' B' ' 520' ' ' LEU . 2.3 mm? -95.76 -31.43 13.2 Favored 'General case' 0 N--CA 1.526 3.373 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.693 -173.262 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.11 -22.92 65.1 Favored 'General case' 0 N--CA 1.539 3.994 0 N-CA-C 106.904 -1.517 . . . . 0.0 106.904 171.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . 0.475 ' CD2' ' HG ' ' A' ' 51' ' ' LEU . 1.6 m-85 -81.82 -40.16 22.94 Favored 'General case' 0 N--CA 1.509 2.494 0 N-CA-C 107.208 -1.404 . . . . 0.0 107.208 174.167 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 20.4 t -58.88 -44.81 91.56 Favored 'Isoleucine or valine' 1 N--CA 1.565 5.313 0 CA-C-O 117.603 -1.189 . . . . 0.0 113.292 -179.059 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -61.05 -46.11 92.01 Favored 'General case' 1 N--CA 1.548 4.462 0 CA-C-N 120.641 1.564 . . . . 0.0 110.038 -178.484 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 1.7 tp -67.38 -26.52 66.5 Favored 'General case' 0 N--CA 1.536 3.829 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 176.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -68.06 -31.78 71.67 Favored 'General case' 0 N--CA 1.522 3.141 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 176.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 527' ' ' LYS . . . . . 0.433 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 15.2 tttt -67.79 -23.3 65.19 Favored 'General case' 0 N--CA 1.521 3.118 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.833 177.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -71.99 -41.27 67.83 Favored 'General case' 0 N--CA 1.534 3.744 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 176.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 529' ' ' ALA . . . . . . . . . . . . . . . -88.6 -7.34 56.59 Favored 'General case' 0 N--CA 1.503 2.219 0 CA-C-O 118.427 -0.797 . . . . 0.0 110.569 177.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 530' ' ' TYR . . . . . 0.433 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.5 OUTLIER -82.07 -35.68 28.44 Favored 'General case' 0 N--CA 1.532 3.671 0 CA-C-N 120.309 1.413 . . . . 0.0 108.737 179.798 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -60.7 -45.07 95.6 Favored 'General case' 0 N--CA 1.538 3.932 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -90.67 -84.0 0.25 Allowed 'General case' 0 N--CA 1.515 2.805 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 177.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.0 p30 149.31 47.34 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.88 0 C-N-CA 128.105 2.562 . . . . 0.0 108.104 178.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 7.3 mt -102.89 9.13 39.0 Favored 'General case' 0 N--CA 1.529 3.523 0 C-N-CA 124.095 0.958 . . . . 0.0 111.606 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 535' ' ' HIS . . . . . . . . . . . . . 49.2 p-80 -80.76 0.38 34.95 Favored 'General case' 0 N--CA 1.512 2.657 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 175.006 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 536' ' ' LEU . . . . . 0.4 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 33.8 mt -94.01 -51.43 0.26 Allowed Pre-proline 0 N--CA 1.505 2.303 0 CA-C-O 116.343 -1.789 . . . . 0.0 109.067 -175.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 537' ' ' PRO . . . . . 0.4 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 3.7 Cg_exo -64.57 -37.42 37.71 Favored 'Trans proline' 0 C--N 1.396 3.048 0 N-CA-C 107.071 -1.934 . . . . 0.0 107.071 170.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -60.28 -41.53 93.51 Favored 'General case' 0 N--CA 1.527 3.387 0 C-N-CA 124.332 1.053 . . . . 0.0 108.736 175.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 11.0 mt -71.78 -25.04 61.86 Favored 'General case' 0 N--CA 1.536 3.836 0 CA-C-O 118.247 -0.883 . . . . 0.0 111.452 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -77.88 -8.05 57.54 Favored 'General case' 0 N--CA 1.53 3.526 0 CA-C-N 119.31 0.959 . . . . 0.0 110.187 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.6 -42.17 5.74 Favored 'General case' 0 N--CA 1.512 2.656 0 C-N-CA 124.033 0.933 . . . . 0.0 109.779 -179.388 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 15.1 ptp -85.2 -28.08 25.69 Favored 'General case' 0 N--CA 1.534 3.764 0 CA-C-O 117.439 -1.267 . . . . 0.0 113.252 -177.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 1.8 tt -131.54 -110.27 0.25 Allowed 'General case' 0 N--CA 1.533 3.691 0 CA-C-O 116.967 -1.492 . . . . 0.0 112.886 -177.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 24.3 p -163.75 162.81 16.57 Favored Pre-proline 1 N--CA 1.542 4.168 0 CA-C-N 120.754 1.615 . . . . 0.0 111.823 -177.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -76.43 -32.09 4.06 Favored 'Trans proline' 0 CA--C 1.578 2.677 0 C-N-CA 122.792 2.328 . . . . 0.0 109.551 174.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -55.63 -36.41 66.97 Favored 'General case' 1 N--CA 1.546 4.338 0 C-N-CA 123.876 0.87 . . . . 0.0 111.523 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -71.66 -32.57 68.03 Favored 'General case' 0 N--CA 1.523 3.191 0 CA-C-O 117.637 -1.173 . . . . 0.0 110.778 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 20.5 ptt180 -74.16 -21.21 59.94 Favored 'General case' 0 N--CA 1.534 3.731 0 CA-C-N 120.027 1.285 . . . . 0.0 109.618 175.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -65.19 -44.43 88.41 Favored 'General case' 0 N--CA 1.536 3.832 0 N-CA-C 106.184 -1.784 . . . . 0.0 106.184 173.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -72.22 -20.29 61.59 Favored 'General case' 0 N--CA 1.517 2.915 0 CA-C-O 117.198 -1.382 . . . . 0.0 110.764 176.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 551' ' ' LEU . . . . . 0.499 HD22 ' CG ' ' A' ' 22' ' ' PHE . 12.3 tp -80.42 -20.26 44.32 Favored 'General case' 0 N--CA 1.524 3.238 0 CA-C-N 120.582 1.537 . . . . 0.0 109.168 175.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -77.35 -52.18 5.73 Favored Glycine 0 N--CA 1.507 3.401 0 N-CA-C 108.333 -1.907 . . . . 0.0 108.333 177.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.5 m -70.32 -32.54 70.33 Favored 'General case' 0 N--CA 1.535 3.825 0 CA-C-O 118.703 -0.665 . . . . 0.0 110.842 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -63.9 -54.64 31.56 Favored 'General case' 1 N--CA 1.539 4.007 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 176.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 38.9 t -66.28 -14.9 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.531 0 CA-C-O 117.759 -1.115 . . . . 0.0 110.995 177.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.77 -44.39 20.77 Favored 'General case' 0 N--CA 1.526 3.374 0 CA-C-N 120.168 1.349 . . . . 0.0 111.539 178.359 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 557' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -71.94 -22.49 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.278 0 CA-C-N 120.724 1.602 . . . . 0.0 110.213 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 558' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -88.44 -52.49 11.09 Favored 'Isoleucine or valine' 1 N--CA 1.543 4.181 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 -179.789 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -57.72 -24.28 56.12 Favored 'General case' 0 N--CA 1.536 3.826 0 CA-C-O 118.895 -0.574 . . . . 0.0 110.487 177.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -98.07 -22.81 16.04 Favored 'General case' 0 N--CA 1.527 3.377 0 CA-C-O 118.059 -0.972 . . . . 0.0 111.363 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 16.6 tp -78.72 -63.17 1.47 Allowed 'General case' 0 N--CA 1.537 3.878 0 CA-C-N 119.637 1.108 . . . . 0.0 108.473 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 25.9 mt -41.82 -31.38 0.31 Allowed 'General case' 1 N--CA 1.547 4.422 0 C-N-CA 125.303 1.441 . . . . 0.0 113.513 -178.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 11.4 mmm180 -75.75 -51.01 13.61 Favored 'General case' 0 N--CA 1.527 3.398 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 80.67 93.47 0.44 Allowed Glycine 1 N--CA 1.516 4.02 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 177.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -161.54 -53.34 0.05 OUTLIER 'General case' 0 N--CA 1.529 3.508 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 48.1 mtt -153.31 77.8 1.14 Allowed 'General case' 0 N--CA 1.522 3.151 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 95.1 p -136.34 4.59 2.92 Favored 'General case' 0 N--CA 1.519 2.979 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -175.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -110.99 -69.69 0.85 Allowed 'General case' 0 N--CA 1.529 3.491 0 CA-C-N 120.153 1.342 . . . . 0.0 111.592 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.98 -45.4 6.94 Favored 'General case' 0 N--CA 1.53 3.559 0 CA-C-N 118.538 0.608 . . . . 0.0 111.806 -176.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -80.05 -5.13 55.28 Favored 'General case' 0 N--CA 1.522 3.172 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 -177.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 27.9 tp -83.42 -48.49 10.3 Favored 'General case' 0 N--CA 1.531 3.594 0 CA-C-N 120.165 1.348 . . . . 0.0 112.555 -177.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -47.06 -30.61 2.81 Favored 'General case' 1 N--CA 1.552 4.628 0 CA-C-N 119.855 1.207 . . . . 0.0 113.82 -178.682 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -68.84 -38.08 79.56 Favored 'General case' 0 N--CA 1.537 3.92 0 CA-C-N 118.724 0.693 . . . . 0.0 110.881 -178.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -49.96 -61.25 2.25 Favored 'General case' 0 N--CA 1.53 3.549 0 C-N-CA 124.769 1.228 . . . . 0.0 113.0 -179.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.0 -36.56 3.25 Favored 'General case' 0 N--CA 1.534 3.747 0 CA-C-O 118.511 -0.756 . . . . 0.0 111.905 -178.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 115.25 57.71 0.35 Allowed Glycine 1 N--CA 1.525 4.57 0 CA-C-N 119.144 0.883 . . . . 0.0 111.039 179.577 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -114.54 103.16 10.75 Favored 'General case' 0 N--CA 1.52 3.069 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 177.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -39.0 164.28 0.01 OUTLIER Glycine 1 N--CA 1.544 5.834 0 C-N-CA 125.441 1.496 . . . . 0.0 115.311 -176.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 579' ' ' ILE . . . . . . . . . . . . 0.262 10.9 mt -81.89 -12.24 12.4 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.333 0 CA-C-N 118.888 1.344 . . . . 0.0 109.341 178.383 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -70.05 -41.64 73.94 Favored 'General case' 0 N--CA 1.531 3.577 0 CA-C-N 120.363 1.438 . . . . 0.0 109.285 175.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -77.4 -37.71 51.37 Favored 'General case' 1 N--CA 1.54 4.03 0 CA-C-N 118.909 0.777 . . . . 0.0 111.877 179.144 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -66.57 -40.04 85.35 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.375 0 C-N-CA 123.421 0.688 . . . . 0.0 111.722 -176.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 44.2 p -99.89 -18.36 17.15 Favored 'General case' 0 N--CA 1.506 2.368 0 CA-C-O 117.744 -1.122 . . . . 0.0 112.057 -178.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -81.64 -20.95 38.58 Favored 'General case' 0 N--CA 1.528 3.475 0 CA-C-N 120.265 1.393 . . . . 0.0 107.909 173.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -66.33 -35.49 90.32 Favored Glycine 1 N--CA 1.518 4.116 0 N-CA-C 108.785 -1.726 . . . . 0.0 108.785 176.084 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 88.8 p -66.55 -32.6 74.04 Favored 'General case' 0 N--CA 1.534 3.769 0 CA-C-N 117.803 0.802 . . . . 0.0 111.188 177.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -64.14 -31.32 72.47 Favored 'General case' 0 N--CA 1.53 3.544 0 C-N-CA 123.566 0.747 . . . . 0.0 110.778 178.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 52.9 m -62.95 -41.07 99.39 Favored 'General case' 1 N--CA 1.54 4.047 0 C-N-CA 123.5 0.72 . . . . 0.0 110.77 178.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 57.2 mt -52.78 -48.49 66.79 Favored 'General case' 0 N--CA 1.531 3.578 0 C-N-CA 124.46 1.104 . . . . 0.0 111.956 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -61.03 -29.81 69.94 Favored 'General case' 1 N--CA 1.54 4.049 0 CA-C-O 118.691 -0.671 . . . . 0.0 112.349 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -71.39 -41.61 69.43 Favored 'General case' 0 N--CA 1.52 3.03 0 CA-C-N 118.391 0.541 . . . . 0.0 110.806 179.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -57.72 162.52 4.91 Favored Pre-proline 1 N--CA 1.542 4.15 0 CA-C-O 118.194 -0.908 . . . . 0.0 112.132 179.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -78.97 -177.98 4.31 Favored 'Trans proline' 0 C--N 1.379 2.134 0 C-N-CA 121.439 1.426 . . . . 0.0 110.514 178.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.1 t -99.36 -29.2 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.098 0 CA-C-O 117.757 -1.116 . . . . 0.0 111.286 -179.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -63.4 -41.32 98.75 Favored 'General case' 0 N--CA 1.517 2.882 0 CA-C-N 119.761 1.164 . . . . 0.0 110.535 -178.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 6.7 mp -99.52 -15.88 18.5 Favored 'General case' 0 N--CA 1.511 2.582 0 C-N-CA 123.331 0.653 . . . . 0.0 111.762 179.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.48 -29.68 69.19 Favored 'General case' 0 N--CA 1.531 3.617 0 N-CA-C 103.119 -2.919 . . . . 0.0 103.119 167.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -56.36 -36.91 69.33 Favored 'General case' 0 N--CA 1.521 3.094 0 C-N-CA 124.302 1.041 . . . . 0.0 110.388 173.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 599' ' ' TRP . . . . . 0.414 ' HA ' ' HB2' ' B' ' 602' ' ' GLU . 50.4 t90 -63.59 -35.61 81.07 Favored 'General case' 0 N--CA 1.53 3.558 0 CA-C-O 117.657 -1.164 . . . . 0.0 108.112 178.288 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 6.2 mp -54.93 -37.03 65.9 Favored 'General case' 1 N--CA 1.544 4.245 0 CA-C-N 119.37 0.986 . . . . 0.0 108.429 176.501 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -70.81 -34.18 71.47 Favored 'General case' 0 N--CA 1.532 3.634 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 176.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 602' ' ' GLU . . . . . 0.414 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.5 OUTLIER -62.2 -24.4 67.2 Favored 'General case' 1 N--CA 1.546 4.363 0 C-N-CA 123.491 0.716 . . . . 0.0 109.88 174.868 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -121.46 13.73 6.06 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.448 0 C-N-CA 123.851 0.861 . . . . 0.0 111.888 -177.565 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 45.0 mt -126.6 -61.95 1.16 Allowed 'General case' 0 N--CA 1.528 3.426 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 176.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.539 3.989 0 C-N-CA 124.573 1.149 . . . . 0.0 111.295 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 . . . . . 0 N--CA 1.534 3.737 0 N-CA-C 105.777 -1.935 . . . . 0.0 105.777 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 59.1 t-105 -51.03 -37.18 43.7 Favored 'General case' 1 N--CA 1.543 4.192 0 C-N-CA 124.253 1.021 . . . . 0.0 109.182 174.125 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -90.34 -25.95 20.2 Favored 'General case' 0 N--CA 1.526 3.345 0 CA-C-O 117.852 -1.07 . . . . 0.0 111.089 -178.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.2 mtt-85 -53.69 -28.34 33.16 Favored 'General case' 1 N--CA 1.539 4.002 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 173.223 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.475 ' O ' ' HB2' ' A' ' 26' ' ' LEU . 47.7 t80 -87.11 -39.04 15.92 Favored 'General case' 0 N--CA 1.501 2.125 0 CA-C-O 115.907 -1.997 . . . . 0.0 109.276 172.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 91.1 t -66.15 -58.26 7.36 Favored 'Isoleucine or valine' 1 N--CA 1.577 5.905 0 CA-C-N 122.462 2.392 . . . . 0.0 112.704 -177.182 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -55.7 -45.84 77.79 Favored 'General case' 1 N--CA 1.548 4.451 0 CA-C-N 119.957 1.253 . . . . 0.0 110.914 -177.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.7 mp -71.71 -24.34 61.79 Favored 'General case' 0 N--CA 1.531 3.603 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.23 177.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.475 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -66.85 -33.5 75.75 Favored 'General case' 0 N--CA 1.519 3.016 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 176.172 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -65.33 -26.91 68.25 Favored 'General case' 0 N--CA 1.518 2.956 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.679 177.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -69.7 -39.71 76.74 Favored 'General case' 0 N--CA 1.53 3.54 0 CA-C-N 119.167 0.894 . . . . 0.0 109.031 177.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.41 -8.9 58.83 Favored 'General case' 0 N--CA 1.504 2.232 0 CA-C-O 118.489 -0.767 . . . . 0.0 110.633 177.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -80.63 -32.79 36.17 Favored 'General case' 0 N--CA 1.529 3.522 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 176.293 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -56.02 -46.49 78.78 Favored 'General case' 0 N--CA 1.533 3.679 0 C-N-CA 124.2 1.0 . . . . 0.0 108.591 176.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -96.26 -83.48 0.37 Allowed 'General case' 0 N--CA 1.517 2.922 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 178.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p30 150.32 49.7 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.888 0 C-N-CA 127.875 2.47 . . . . 0.0 108.045 177.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.5 mt -103.16 9.49 38.28 Favored 'General case' 0 N--CA 1.526 3.326 0 C-N-CA 124.099 0.96 . . . . 0.0 111.156 -178.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.4 ' HA ' ' HB2' ' A' ' 38' ' ' LEU . 48.5 p-80 -81.17 3.86 22.18 Favored 'General case' 0 N--CA 1.513 2.711 0 C-N-CA 123.224 0.61 . . . . 0.0 109.558 174.547 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.7 mt -95.84 -49.94 0.24 Allowed Pre-proline 0 N--CA 1.512 2.649 0 C-N-CA 125.374 1.47 . . . . 0.0 109.373 -175.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_exo -62.87 -37.97 51.14 Favored 'Trans proline' 0 N--CA 1.513 2.638 0 N-CA-C 105.703 -2.46 . . . . 0.0 105.703 169.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.4 ' HB2' ' HA ' ' A' ' 35' ' ' HIS . 0.9 OUTLIER -54.44 -44.36 72.41 Favored 'General case' 0 N--CA 1.536 3.874 0 C-N-CA 124.442 1.097 . . . . 0.0 109.38 174.151 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.79 -52.77 61.61 Favored 'General case' 1 N--CA 1.561 5.087 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.626 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -58.48 -17.1 18.38 Favored 'General case' 1 N--CA 1.543 4.194 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -179.233 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -107.27 -35.23 6.87 Favored 'General case' 0 N--CA 1.529 3.496 0 CA-C-O 117.738 -1.125 . . . . 0.0 112.971 -176.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 18.0 ptp -125.48 21.87 7.77 Favored 'General case' 1 N--CA 1.549 4.485 0 CA-C-N 120.505 1.502 . . . . 0.0 112.641 -177.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -137.76 -68.75 0.46 Allowed 'General case' 0 N--CA 1.515 2.804 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.295 177.174 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.4 p 122.82 157.25 0.0 OUTLIER Pre-proline 1 N--CA 1.568 5.439 0 C-N-CA 128.528 2.731 . . . . 0.0 109.534 -179.526 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -67.28 -30.49 37.14 Favored 'Trans proline' 0 C--N 1.393 2.875 0 C-N-CA 122.316 2.011 . . . . 0.0 109.429 175.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -68.35 -27.07 65.93 Favored 'General case' 0 N--CA 1.531 3.575 0 CA-C-O 118.208 -0.901 . . . . 0.0 109.55 176.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -70.65 -30.47 67.1 Favored 'General case' 0 N--CA 1.52 3.069 0 CA-C-O 117.588 -1.196 . . . . 0.0 109.935 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 -85.76 -18.0 34.25 Favored 'General case' 0 N--CA 1.537 3.88 0 CA-C-N 119.617 1.098 . . . . 0.0 108.394 174.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -75.86 -22.91 55.72 Favored 'General case' 0 N--CA 1.523 3.179 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 172.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.79 -35.24 15.81 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 117.729 -1.129 . . . . 0.0 109.252 179.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.411 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 31.2 tp -74.16 -20.0 60.37 Favored 'General case' 0 N--CA 1.534 3.741 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 172.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.95 -70.51 1.12 Allowed Glycine 0 N--CA 1.496 2.687 0 C-N-CA 125.161 1.363 . . . . 0.0 110.627 177.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.6 m -73.54 -25.43 60.39 Favored 'General case' 0 N--CA 1.531 3.607 0 CA-C-O 117.759 -1.115 . . . . 0.0 112.46 -178.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -69.62 -51.4 35.37 Favored 'General case' 0 N--CA 1.536 3.866 0 CA-C-N 120.269 1.395 . . . . 0.0 107.914 177.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.5 t -61.82 -20.22 23.08 Favored 'Isoleucine or valine' 1 N--CA 1.543 4.199 0 O-C-N 120.977 -1.077 . . . . 0.0 109.402 175.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.5 mmm180 -74.55 -44.08 52.76 Favored 'General case' 0 N--CA 1.522 3.147 0 CA-C-O 117.098 -1.429 . . . . 0.0 112.082 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.15 -23.87 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.507 0 CA-C-N 121.942 2.155 . . . . 0.0 111.161 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -88.36 -50.56 13.4 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.107 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 -178.153 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -62.26 -25.46 67.85 Favored 'General case' 0 N--CA 1.532 3.653 0 CA-C-O 118.818 -0.611 . . . . 0.0 109.976 178.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -95.05 -21.39 18.6 Favored 'General case' 0 N--CA 1.524 3.258 0 CA-C-O 117.828 -1.082 . . . . 0.0 111.113 178.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -78.08 -46.14 21.61 Favored 'General case' 0 N--CA 1.533 3.678 0 CA-C-N 120.011 1.278 . . . . 0.0 108.026 178.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 30.9 mt -51.84 -26.32 9.7 Favored 'General case' 0 N--CA 1.539 3.987 0 C-N-CA 124.546 1.139 . . . . 0.0 112.203 178.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -90.23 -52.08 5.12 Favored 'General case' 0 N--CA 1.521 3.075 0 N-CA-C 107.397 -1.335 . . . . 0.0 107.397 178.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.1 94.41 0.26 Allowed Glycine 0 N--CA 1.514 3.854 0 CA-C-O 119.442 -0.643 . . . . 0.0 112.424 177.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -160.23 -59.05 0.06 Allowed 'General case' 0 N--CA 1.529 3.504 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 177.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 59.0 mtt -140.19 74.1 1.45 Allowed 'General case' 0 N--CA 1.526 3.351 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 178.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 8.4 t -136.08 -14.59 1.79 Allowed 'General case' 0 N--CA 1.525 3.296 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -176.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -106.7 -56.49 2.18 Favored 'General case' 0 N--CA 1.529 3.492 0 CA-C-N 120.284 1.402 . . . . 0.0 112.122 -176.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 1.9 ttm180 -102.57 -54.03 2.75 Favored 'General case' 0 N--CA 1.53 3.535 0 C-N-CA 123.294 0.638 . . . . 0.0 111.469 -176.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.39 -8.54 56.29 Favored 'General case' 0 N--CA 1.518 2.947 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -176.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 37.0 tp -80.91 -51.33 8.68 Favored 'General case' 0 N--CA 1.528 3.45 0 CA-C-O 117.6 -1.19 . . . . 0.0 113.061 -178.017 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.06 -31.85 0.14 Allowed 'General case' 1 N--CA 1.552 4.669 0 N-CA-C 115.038 1.496 . . . . 0.0 115.038 -176.937 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -72.78 -44.24 61.81 Favored 'General case' 0 N--CA 1.536 3.847 0 CA-C-N 119.18 0.9 . . . . 0.0 110.048 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -53.26 -50.14 65.44 Favored 'General case' 0 N--CA 1.529 3.504 0 C-N-CA 124.631 1.172 . . . . 0.0 112.903 -179.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 56.7 mt -110.54 -51.33 2.88 Favored 'General case' 0 N--CA 1.526 3.365 0 C-N-CA 122.973 0.509 . . . . 0.0 111.646 -177.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 117.59 17.94 5.44 Favored Glycine 1 N--CA 1.527 4.724 0 CA-C-O 118.095 -1.392 . . . . 0.0 111.867 -178.089 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -89.21 112.74 23.84 Favored 'General case' 0 N--CA 1.512 2.643 0 CA-C-N 119.594 1.697 . . . . 0.0 106.508 178.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -42.67 173.95 0.01 OUTLIER Glycine 1 N--CA 1.535 5.299 0 C-N-CA 125.25 1.405 . . . . 0.0 115.253 -177.759 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.8 mt -80.06 -17.29 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.707 0 CA-C-N 118.5 1.15 . . . . 0.0 107.984 177.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.86 -6.63 43.12 Favored 'General case' 0 N--CA 1.521 3.121 0 CA-C-O 117.403 -1.284 . . . . 0.0 111.223 174.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -104.17 -44.28 5.02 Favored 'General case' 0 N--CA 1.53 3.539 0 CA-C-N 120.77 1.623 . . . . 0.0 110.26 177.292 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -72.23 -38.71 62.92 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.652 0 CA-C-N 119.307 0.958 . . . . 0.0 111.202 -177.771 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 44.3 p -82.15 -25.65 34.17 Favored 'General case' 0 N--CA 1.521 3.104 0 CA-C-O 118.865 -0.588 . . . . 0.0 109.917 178.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.9 ttp180 -67.71 -35.54 78.97 Favored 'General case' 1 N--CA 1.54 4.044 0 N-CA-C 107.319 -1.363 . . . . 0.0 107.319 173.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -69.94 -26.24 74.59 Favored Glycine 1 N--CA 1.516 4.025 0 CA-C-O 118.094 -1.392 . . . . 0.0 111.916 178.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 89.7 p -66.14 -25.5 67.0 Favored 'General case' 1 N--CA 1.543 4.222 0 CA-C-N 119.537 1.669 . . . . 0.0 110.754 178.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -54.81 -25.28 27.3 Favored 'General case' 1 N--CA 1.545 4.287 0 C-N-CA 123.281 0.632 . . . . 0.0 110.752 176.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.9 m -49.88 -42.85 48.74 Favored 'General case' 1 N--CA 1.547 4.382 0 C-N-CA 124.837 1.255 . . . . 0.0 111.467 178.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 37.8 mt -65.02 -41.98 94.8 Favored 'General case' 0 N--CA 1.519 2.99 0 C-N-CA 123.324 0.65 . . . . 0.0 110.259 178.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.11 0.06 55.88 Favored 'General case' 0 N--CA 1.532 3.643 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -179.45 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -113.18 -64.0 1.37 Allowed 'General case' 0 N--CA 1.518 2.958 0 CA-C-N 120.047 1.294 . . . . 0.0 111.741 -179.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -49.73 159.31 0.74 Allowed Pre-proline 1 N--CA 1.548 4.461 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -178.528 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -78.01 -179.31 5.33 Favored 'Trans proline' 0 C--N 1.384 2.427 0 C-N-CA 121.735 1.623 . . . . 0.0 110.248 177.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.1 t -98.75 -27.15 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.117 0 CA-C-O 117.545 -1.217 . . . . 0.0 111.69 -178.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -61.9 -43.51 98.69 Favored 'General case' 0 N--CA 1.518 2.936 0 CA-C-N 120.189 1.359 . . . . 0.0 110.459 -178.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.9 mp -98.57 -16.07 19.26 Favored 'General case' 0 N--CA 1.509 2.52 0 CA-C-O 118.676 -0.678 . . . . 0.0 112.149 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.76 -29.65 68.91 Favored 'General case' 0 N--CA 1.538 3.948 0 N-CA-C 103.591 -2.744 . . . . 0.0 103.591 168.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -55.24 -39.1 69.34 Favored 'General case' 0 N--CA 1.518 2.971 0 C-N-CA 123.892 0.877 . . . . 0.0 110.259 174.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.43 ' HA ' ' HB2' ' A' ' 102' ' ' GLU . 54.9 t90 -66.22 -34.67 78.53 Favored 'General case' 0 N--CA 1.528 3.462 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 177.246 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.1 -35.29 59.46 Favored 'General case' 0 N--CA 1.537 3.916 0 CA-C-N 118.923 0.783 . . . . 0.0 108.905 175.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -71.76 -37.12 70.56 Favored 'General case' 1 N--CA 1.539 4.002 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 175.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 3.0 mt-10 -60.51 -22.27 63.38 Favored 'General case' 1 N--CA 1.544 4.251 0 C-N-CA 123.607 0.763 . . . . 0.0 110.636 175.047 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -118.05 6.46 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.514 0 CA-C-O 118.744 -0.646 . . . . 0.0 112.215 -177.017 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.2 mt -111.67 -62.05 1.61 Allowed 'General case' 0 N--CA 1.525 3.281 0 N-CA-C 105.793 -1.929 . . . . 0.0 105.793 175.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.0 tt . . . . . 1 N--CA 1.54 4.049 0 C-N-CA 125.572 1.549 . . . . 0.0 112.287 -179.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 . . . . . 0 N--CA 1.521 3.091 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 519' ' ' TRP . . . . . 0.439 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 64.2 t-105 -42.43 -29.54 0.28 Allowed 'General case' 1 N--CA 1.549 4.482 0 C-N-CA 123.954 0.901 . . . . 0.0 113.335 179.166 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 520' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -93.98 -31.64 14.18 Favored 'General case' 0 N--CA 1.524 3.274 0 CA-C-O 117.696 -1.145 . . . . 0.0 113.879 -172.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 54.3 mtt-85 -61.7 -25.76 67.62 Favored 'General case' 1 N--CA 1.546 4.361 0 N-CA-C 105.729 -1.952 . . . . 0.0 105.729 171.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . 0.439 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 2.0 m-85 -76.24 -43.24 42.97 Favored 'General case' 0 N--CA 1.511 2.602 0 CA-C-O 117.287 -1.34 . . . . 0.0 107.401 173.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 54.1 t -65.82 -17.29 21.95 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.24 0 CA-C-O 117.717 -1.135 . . . . 0.0 112.246 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -77.62 -52.59 8.77 Favored 'General case' 0 N--CA 1.527 3.419 0 CA-C-N 120.396 1.453 . . . . 0.0 107.885 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 5.1 mp -75.35 -14.6 60.49 Favored 'General case' 0 N--CA 1.53 3.547 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 175.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.23 -35.92 68.97 Favored 'General case' 0 N--CA 1.521 3.102 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 174.153 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 30.7 ttmt -68.73 -21.96 64.36 Favored 'General case' 0 N--CA 1.512 2.644 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.633 176.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -67.55 -40.17 84.96 Favored 'General case' 0 N--CA 1.535 3.82 0 CA-C-N 119.365 0.984 . . . . 0.0 108.465 176.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 529' ' ' ALA . . . . . 0.443 ' HB2' ' N ' ' B' ' 535' ' ' HIS . . . -90.22 -13.46 35.41 Favored 'General case' 0 N--CA 1.504 2.24 0 CA-C-O 117.968 -1.015 . . . . 0.0 111.637 178.71 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.29 -28.64 42.25 Favored 'General case' 0 N--CA 1.537 3.908 0 CA-C-N 120.787 1.63 . . . . 0.0 107.461 177.478 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -61.7 -47.77 83.81 Favored 'General case' 0 N--CA 1.527 3.415 0 C-N-CA 124.421 1.089 . . . . 0.0 108.425 176.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -91.4 -85.33 0.24 Allowed 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 177.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.8 p30 152.58 51.76 0.0 OUTLIER 'General case' 1 N--CA 1.555 4.825 0 C-N-CA 127.339 2.256 . . . . 0.0 108.263 176.456 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 7.0 mt -109.89 12.16 23.95 Favored 'General case' 0 N--CA 1.519 2.997 0 C-N-CA 125.249 1.42 . . . . 0.0 109.924 -179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 535' ' ' HIS . . . . . 0.443 ' N ' ' HB2' ' B' ' 529' ' ' ALA . 24.6 p-80 -86.38 9.09 19.08 Favored 'General case' 0 N--CA 1.516 2.871 0 C-N-CA 124.146 0.979 . . . . 0.0 108.873 175.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 536' ' ' LEU . . . . . 0.482 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 20.3 mt -97.05 -52.04 0.22 Allowed Pre-proline 0 N--CA 1.502 2.173 0 CA-C-O 116.589 -1.672 . . . . 0.0 107.794 -176.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 537' ' ' PRO . . . . . 0.482 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 2.7 Cg_exo -65.8 -34.1 41.22 Favored 'Trans proline' 0 C--N 1.401 3.308 0 N-CA-C 106.693 -2.08 . . . . 0.0 106.693 170.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.47 -51.68 68.83 Favored 'General case' 0 N--CA 1.523 3.211 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 174.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 40.1 mt -77.45 -6.81 54.79 Favored 'General case' 0 N--CA 1.535 3.811 0 CA-C-O 118.441 -0.79 . . . . 0.0 112.599 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -75.36 -22.67 57.36 Favored 'General case' 0 N--CA 1.518 2.963 0 CA-C-O 117.601 -1.19 . . . . 0.0 111.576 179.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.58 -27.47 2.86 Favored 'General case' 0 N--CA 1.524 3.256 0 CA-C-O 117.214 -1.374 . . . . 0.0 113.648 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 2.2 ptp -79.77 9.68 4.92 Favored 'General case' 1 N--CA 1.543 4.221 0 CA-C-N 121.663 2.028 . . . . 0.0 110.583 177.42 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 1.6 tp -132.78 -89.36 0.42 Allowed 'General case' 0 N--CA 1.519 2.985 0 CA-C-N 120.183 1.356 . . . . 0.0 111.823 178.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 162.56 175.45 0.04 OUTLIER Pre-proline 1 N--CA 1.578 5.967 0 C-N-CA 125.12 1.368 . . . . 0.0 109.971 -177.682 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -64.73 -21.45 64.93 Favored 'Trans proline' 0 N--CA 1.527 3.475 0 C-N-CA 122.25 1.967 . . . . 0.0 109.834 173.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -72.29 8.87 1.17 Allowed 'General case' 0 N--CA 1.517 2.908 0 C-N-CA 123.38 0.672 . . . . 0.0 110.728 175.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.6 -57.91 3.96 Favored 'General case' 0 N--CA 1.51 2.568 0 CA-C-O 117.493 -1.241 . . . . 0.0 108.326 178.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 -93.65 -5.98 47.42 Favored 'General case' 0 N--CA 1.527 3.422 0 CA-C-N 120.303 1.41 . . . . 0.0 111.507 175.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -74.35 -45.89 44.2 Favored 'General case' 0 N--CA 1.535 3.777 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 173.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -90.34 -23.33 21.16 Favored 'General case' 0 N--CA 1.521 3.108 0 CA-C-O 117.652 -1.166 . . . . 0.0 112.363 179.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 551' ' ' LEU . . . . . . . . . . . . . 17.4 tp -80.86 -33.28 34.6 Favored 'General case' 1 N--CA 1.54 4.071 0 CA-C-N 120.657 1.571 . . . . 0.0 107.707 176.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -73.49 -52.76 8.11 Favored Glycine 0 N--CA 1.496 2.676 0 N-CA-C 109.905 -1.278 . . . . 0.0 109.905 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 1.8 m -71.97 -33.8 68.45 Favored 'General case' 0 N--CA 1.536 3.873 0 CA-C-N 118.415 1.108 . . . . 0.0 112.574 -177.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -67.23 -52.64 38.54 Favored 'General case' 1 N--CA 1.54 4.052 0 N-CA-C 106.916 -1.512 . . . . 0.0 106.916 176.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 42.8 t -61.25 -18.43 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.66 0 CA-C-O 117.938 -1.03 . . . . 0.0 110.485 177.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 -79.25 -42.21 26.41 Favored 'General case' 0 N--CA 1.525 3.291 0 CA-C-O 116.869 -1.539 . . . . 0.0 111.152 177.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 557' ' ' ILE . . . . . 0.433 ' HB ' HG23 ' B' ' 582' ' ' ILE . 0.0 OUTLIER -71.83 -22.04 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.946 0 CA-C-N 122.178 2.263 . . . . 0.0 110.742 179.911 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 558' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -87.14 -52.1 12.06 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.746 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 -178.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -67.1 -17.0 64.68 Favored 'General case' 0 N--CA 1.523 3.188 0 CA-C-O 118.599 -0.715 . . . . 0.0 110.975 178.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -96.97 -23.9 16.07 Favored 'General case' 0 N--CA 1.528 3.445 0 CA-C-O 118.277 -0.868 . . . . 0.0 109.946 176.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 21.2 tp -78.47 -56.66 4.27 Favored 'General case' 0 N--CA 1.534 3.742 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 178.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 6.7 tp -45.18 -30.11 1.1 Allowed 'General case' 0 N--CA 1.537 3.914 0 C-N-CA 125.196 1.398 . . . . 0.0 112.82 -179.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.14 -50.22 7.59 Favored 'General case' 0 N--CA 1.527 3.392 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 177.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 77.7 94.55 0.24 Allowed Glycine 0 N--CA 1.514 3.862 0 CA-C-O 119.616 -0.547 . . . . 0.0 113.51 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -165.86 -57.95 0.03 OUTLIER 'General case' 0 N--CA 1.531 3.608 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 177.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 47.4 mtt -131.18 69.9 1.47 Allowed 'General case' 0 N--CA 1.519 3.0 0 N-CA-C 106.564 -1.643 . . . . 0.0 106.564 178.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 6.1 t -126.25 -8.52 6.44 Favored 'General case' 0 N--CA 1.523 3.209 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -177.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -113.47 -70.67 0.79 Allowed 'General case' 0 N--CA 1.526 3.366 0 CA-C-N 120.042 1.292 . . . . 0.0 111.843 -178.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 24.0 mtt180 -91.43 -52.37 4.82 Favored 'General case' 0 N--CA 1.53 3.532 0 CA-C-N 118.853 0.751 . . . . 0.0 110.38 -178.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -68.68 -12.16 61.05 Favored 'General case' 0 N--CA 1.519 3.0 0 CA-C-O 118.183 -0.913 . . . . 0.0 112.613 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 24.2 tp -80.72 -54.72 5.38 Favored 'General case' 0 N--CA 1.517 2.912 0 CA-C-N 119.554 1.07 . . . . 0.0 109.798 179.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -45.88 -32.35 2.6 Favored 'General case' 1 N--CA 1.545 4.281 0 CA-C-N 119.229 0.922 . . . . 0.0 112.507 -179.716 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -72.65 -42.12 64.72 Favored 'General case' 0 N--CA 1.534 3.757 0 C-N-CA 122.988 0.515 . . . . 0.0 110.61 -179.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -43.97 -56.57 3.86 Favored 'General case' 1 N--CA 1.539 4.002 0 C-N-CA 125.137 1.375 . . . . 0.0 113.568 -179.165 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -137.43 -41.74 0.56 Allowed 'General case' 0 N--CA 1.528 3.447 0 CA-C-O 118.814 -0.612 . . . . 0.0 111.579 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 125.66 98.78 1.15 Allowed Glycine 1 N--CA 1.517 4.047 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -126.72 -47.34 1.54 Allowed 'General case' 0 N--CA 1.525 3.311 0 C-N-CA 123.529 0.732 . . . . 0.0 109.44 178.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 108.14 161.05 20.65 Favored Glycine 1 N--CA 1.519 4.22 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -178.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.01 -18.0 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.861 0 CA-C-N 119.219 1.51 . . . . 0.0 108.062 177.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -71.01 -38.33 72.63 Favored 'General case' 0 N--CA 1.522 3.149 0 CA-C-N 119.843 1.201 . . . . 0.0 110.301 177.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 4.2 p -78.07 -46.86 19.7 Favored 'General case' 0 N--CA 1.536 3.855 0 CA-C-N 119.689 1.131 . . . . 0.0 111.659 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 582' ' ' ILE . . . . . 0.433 HG23 ' HB ' ' B' ' 557' ' ' ILE . 1.4 pt -68.49 -22.36 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.932 0 CA-C-O 117.854 -1.07 . . . . 0.0 113.289 -177.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 31.0 p -108.74 -21.55 12.63 Favored 'General case' 0 N--CA 1.521 3.095 0 CA-C-N 119.728 1.149 . . . . 0.0 111.95 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 11.3 ptt180 -82.75 -21.55 34.65 Favored 'General case' 0 N--CA 1.531 3.592 0 CA-C-N 119.98 1.264 . . . . 0.0 107.875 173.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -67.66 -31.87 77.09 Favored Glycine 0 N--CA 1.514 3.853 0 N-CA-C 109.703 -1.359 . . . . 0.0 109.703 176.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 88.2 p -65.92 -34.83 79.01 Favored 'General case' 1 N--CA 1.54 4.044 0 CA-C-N 118.537 1.168 . . . . 0.0 110.053 177.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -58.06 -29.04 65.08 Favored 'General case' 1 N--CA 1.539 4.01 0 C-N-CA 123.888 0.875 . . . . 0.0 111.306 178.773 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.31 -35.43 80.99 Favored 'General case' 0 N--CA 1.537 3.917 0 C-N-CA 123.26 0.624 . . . . 0.0 110.507 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 23.6 mt -73.14 -45.76 54.86 Favored 'General case' 0 N--CA 1.518 2.954 0 C-N-CA 123.651 0.78 . . . . 0.0 110.699 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.46 -30.71 31.19 Favored 'General case' 1 N--CA 1.552 4.631 0 C-N-CA 123.672 0.789 . . . . 0.0 112.351 -179.608 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -96.61 -35.22 11.13 Favored 'General case' 0 N--CA 1.519 3.013 0 C-N-CA 123.301 0.64 . . . . 0.0 111.259 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -51.72 164.32 0.55 Allowed Pre-proline 1 N--CA 1.543 4.191 0 CA-C-O 118.197 -0.906 . . . . 0.0 112.941 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -76.09 147.64 30.27 Favored 'Trans proline' 0 C--N 1.38 2.212 0 C-N-CA 121.873 1.715 . . . . 0.0 110.028 178.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.7 t -84.6 -26.24 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.745 0 CA-C-O 117.442 -1.266 . . . . 0.0 112.016 -178.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -65.17 -35.6 81.6 Favored 'General case' 0 N--CA 1.518 2.925 0 CA-C-N 120.282 1.401 . . . . 0.0 110.596 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 6.8 mp -97.75 -21.23 17.09 Favored 'General case' 0 N--CA 1.517 2.879 0 C-N-CA 123.929 0.892 . . . . 0.0 110.423 178.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.51 -35.36 77.49 Favored 'General case' 1 N--CA 1.55 4.527 0 N-CA-C 103.764 -2.68 . . . . 0.0 103.764 168.503 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -57.36 -40.46 78.13 Favored 'General case' 0 N--CA 1.52 3.046 0 C-N-CA 125.358 1.463 . . . . 0.0 111.278 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 599' ' ' TRP . . . . . 0.416 ' HA ' ' HB2' ' B' ' 602' ' ' GLU . 57.5 t90 -57.97 -34.44 69.94 Favored 'General case' 1 N--CA 1.54 4.064 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 179.387 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 54.1 mt -53.68 -42.38 67.88 Favored 'General case' 0 N--CA 1.538 3.962 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 176.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -68.07 -33.76 75.16 Favored 'General case' 0 N--CA 1.53 3.545 0 O-C-N 123.802 0.689 . . . . 0.0 109.42 176.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 602' ' ' GLU . . . . . 0.416 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.6 OUTLIER -61.29 -25.02 66.83 Favored 'General case' 1 N--CA 1.542 4.149 0 C-N-CA 123.362 0.665 . . . . 0.0 110.148 175.27 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -120.59 7.61 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.463 0 C-N-CA 123.747 0.819 . . . . 0.0 112.772 -177.003 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.73 -57.06 1.92 Allowed 'General case' 0 N--CA 1.512 2.643 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 178.075 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.533 3.677 0 C-N-CA 124.869 1.268 . . . . 0.0 113.51 -177.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 . . . . . 0 N--CA 1.526 3.375 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -51.35 -39.96 58.14 Favored 'General case' 1 N--CA 1.541 4.085 0 C-N-CA 123.034 0.534 . . . . 0.0 109.664 176.376 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -81.5 -26.91 34.77 Favored 'General case' 0 N--CA 1.519 2.987 0 O-C-N 124.699 1.249 . . . . 0.0 111.633 -176.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.0 ttm180 -56.27 -29.17 60.75 Favored 'General case' 0 N--CA 1.539 3.982 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 173.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.497 ' CG ' HD22 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -86.03 -36.47 19.71 Favored 'General case' 0 N--CA 1.508 2.441 0 CA-C-O 116.218 -1.849 . . . . 0.0 108.784 173.6 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.5 t -68.73 -26.0 31.89 Favored 'Isoleucine or valine' 1 N--CA 1.571 5.606 0 CA-C-N 121.364 1.893 . . . . 0.0 112.645 -176.332 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -76.1 -50.32 15.0 Favored 'General case' 0 N--CA 1.534 3.737 0 CA-C-N 120.017 1.281 . . . . 0.0 107.588 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.7 mp -70.79 -16.46 62.74 Favored 'General case' 0 N--CA 1.527 3.386 0 O-C-N 123.428 0.455 . . . . 0.0 110.013 175.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.407 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -72.16 -36.7 69.37 Favored 'General case' 0 N--CA 1.519 2.997 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 175.762 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.1 tttt -66.02 -20.87 66.33 Favored 'General case' 0 N--CA 1.518 2.939 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.658 176.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -71.75 -40.97 68.99 Favored 'General case' 0 N--CA 1.529 3.485 0 CA-C-N 119.275 0.943 . . . . 0.0 108.722 176.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.89 -8.75 55.36 Favored 'General case' 0 N--CA 1.507 2.382 0 CA-C-O 118.566 -0.73 . . . . 0.0 110.699 177.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -83.02 -28.51 29.59 Favored 'General case' 0 N--CA 1.532 3.64 0 CA-C-N 120.017 1.28 . . . . 0.0 107.768 177.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -64.13 -45.59 87.88 Favored 'General case' 0 N--CA 1.525 3.298 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 176.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -93.31 -89.64 0.2 Allowed 'General case' 0 N--CA 1.513 2.677 0 N-CA-C 106.434 -1.691 . . . . 0.0 106.434 176.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 p30 156.36 51.27 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.918 0 C-N-CA 126.825 2.05 . . . . 0.0 107.877 177.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.8 mt -109.88 12.44 23.87 Favored 'General case' 0 N--CA 1.525 3.289 0 C-N-CA 124.388 1.075 . . . . 0.0 110.669 -178.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.441 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 39.2 p-80 -81.86 2.59 29.65 Favored 'General case' 0 N--CA 1.516 2.841 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 174.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 22.6 mt -95.84 -51.11 0.24 Allowed Pre-proline 0 N--CA 1.508 2.43 0 CA-C-O 117.212 -1.375 . . . . 0.0 109.638 -175.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -65.82 -35.23 36.87 Favored 'Trans proline' 0 CA--C 1.574 2.485 0 N-CA-C 105.975 -2.356 . . . . 0.0 105.975 170.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.441 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 1.9 tm? -59.64 -38.34 81.14 Favored 'General case' 0 N--CA 1.521 3.109 0 C-N-CA 124.149 0.98 . . . . 0.0 108.946 175.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.1 mt -59.95 -44.67 94.26 Favored 'General case' 1 N--CA 1.559 5.005 0 CA-C-N 119.236 0.926 . . . . 0.0 108.903 177.108 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -61.71 -17.75 56.95 Favored 'General case' 1 N--CA 1.542 4.148 0 CA-C-O 118.642 -0.694 . . . . 0.0 112.834 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -97.61 -50.52 4.46 Favored 'General case' 0 N--CA 1.525 3.289 0 CA-C-O 118.067 -0.968 . . . . 0.0 113.115 -177.335 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.9 ptt? -115.36 18.68 15.95 Favored 'General case' 1 N--CA 1.556 4.851 0 CA-C-N 119.829 1.195 . . . . 0.0 113.792 -175.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.8 tp -130.44 -80.78 0.54 Allowed 'General case' 0 N--CA 1.52 3.071 0 CA-C-O 117.481 -1.247 . . . . 0.0 110.233 176.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.6 p 140.73 156.47 0.0 OUTLIER Pre-proline 1 N--CA 1.57 5.538 0 C-N-CA 127.178 2.191 . . . . 0.0 109.271 179.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -67.13 -37.84 17.54 Favored 'Trans proline' 0 N--CA 1.517 2.893 0 C-N-CA 123.167 2.578 . . . . 0.0 110.627 177.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -64.02 -21.98 66.73 Favored 'General case' 0 N--CA 1.532 3.651 0 CA-C-O 118.666 -0.683 . . . . 0.0 110.755 178.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -73.39 -28.97 62.3 Favored 'General case' 0 N--CA 1.52 3.045 0 CA-C-O 117.368 -1.301 . . . . 0.0 110.513 179.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 24.1 ptt180 -83.34 -24.55 32.05 Favored 'General case' 0 N--CA 1.537 3.907 0 CA-C-N 120.175 1.352 . . . . 0.0 107.703 174.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -67.58 -26.41 66.27 Favored 'General case' 1 N--CA 1.542 4.17 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 172.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -92.53 -28.74 16.59 Favored 'General case' 0 N--CA 1.511 2.592 0 C-N-CA 124.809 1.244 . . . . 0.0 111.316 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.427 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 34.8 tp -78.08 -20.05 53.03 Favored 'General case' 0 N--CA 1.537 3.894 0 N-CA-C 105.501 -2.037 . . . . 0.0 105.501 172.137 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.97 -70.96 1.07 Allowed Glycine 0 C--N 1.374 2.686 0 C-N-CA 125.311 1.434 . . . . 0.0 109.557 177.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.6 m -66.18 -25.35 66.9 Favored 'General case' 0 N--CA 1.531 3.607 0 CA-C-O 117.744 -1.122 . . . . 0.0 112.85 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -70.77 -52.07 23.02 Favored 'General case' 0 N--CA 1.534 3.754 0 CA-C-N 120.063 1.302 . . . . 0.0 108.417 177.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 23.0 t -64.42 -16.19 18.85 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.171 0 O-C-N 120.871 -1.143 . . . . 0.0 109.61 175.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -76.75 -46.46 25.17 Favored 'General case' 0 N--CA 1.523 3.199 0 CA-C-N 120.001 1.273 . . . . 0.0 111.793 178.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.58 -23.26 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.41 0 CA-C-N 120.843 1.656 . . . . 0.0 111.297 -179.216 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -88.69 -52.53 10.94 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.846 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -58.02 -24.67 59.22 Favored 'General case' 1 N--CA 1.54 4.034 0 CA-C-O 118.871 -0.585 . . . . 0.0 110.138 178.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -88.35 -32.25 18.5 Favored 'General case' 0 N--CA 1.519 3.009 0 CA-C-O 118.345 -0.836 . . . . 0.0 109.555 177.208 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 16.8 tp -64.09 -58.24 7.24 Favored 'General case' 0 N--CA 1.539 4.0 0 CA-C-N 119.3 0.955 . . . . 0.0 110.463 -179.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 33.1 mt -49.17 -26.7 3.0 Favored 'General case' 1 N--CA 1.542 4.132 0 C-N-CA 123.72 0.808 . . . . 0.0 112.891 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 26.9 mmm180 -88.01 -42.32 12.52 Favored 'General case' 0 N--CA 1.527 3.421 0 CA-C-N 118.474 0.579 . . . . 0.0 110.216 -179.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 67.17 88.09 0.07 OUTLIER Glycine 1 N--CA 1.525 4.602 0 CA-C-O 119.134 -0.814 . . . . 0.0 111.703 178.687 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -160.45 -54.24 0.05 Allowed 'General case' 0 N--CA 1.53 3.563 0 CA-C-N 117.714 0.757 . . . . 0.0 110.468 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 9.0 ptt? -142.32 73.76 1.42 Allowed 'General case' 0 N--CA 1.531 3.622 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 18.1 m -133.38 -13.94 2.62 Favored 'General case' 0 N--CA 1.522 3.126 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 -173.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -111.98 -67.82 0.97 Allowed 'General case' 0 N--CA 1.529 3.482 0 CA-C-N 120.179 1.354 . . . . 0.0 112.776 -177.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 11.0 mtt180 -94.94 -47.1 6.57 Favored 'General case' 0 N--CA 1.532 3.642 0 CA-C-N 118.83 0.741 . . . . 0.0 111.097 -177.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -72.95 -12.17 60.85 Favored 'General case' 0 N--CA 1.517 2.906 0 CA-C-O 118.438 -0.792 . . . . 0.0 112.759 -179.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 26.0 tp -80.21 -54.54 5.65 Favored 'General case' 0 N--CA 1.527 3.401 0 CA-C-O 117.735 -1.126 . . . . 0.0 113.429 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -40.11 -48.7 2.53 Favored 'General case' 1 N--CA 1.558 4.94 0 CA-C-N 119.943 1.247 . . . . 0.0 114.162 -177.39 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -68.88 -34.88 76.16 Favored 'General case' 0 N--CA 1.535 3.782 0 CA-C-O 118.967 -0.54 . . . . 0.0 112.154 -177.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -53.12 -52.67 57.94 Favored 'General case' 0 N--CA 1.534 3.753 0 C-N-CA 124.196 0.998 . . . . 0.0 113.023 -178.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.9 pp -121.6 -41.45 2.48 Favored 'General case' 0 N--CA 1.534 3.733 0 CA-C-O 118.895 -0.574 . . . . 0.0 111.326 -178.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 122.25 64.55 0.22 Allowed Glycine 1 N--CA 1.523 4.463 0 N-CA-C 110.81 -0.916 . . . . 0.0 110.81 179.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -133.3 109.6 9.49 Favored 'General case' 0 N--CA 1.518 2.957 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 178.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -45.14 171.61 0.01 OUTLIER Glycine 1 N--CA 1.546 5.983 0 C-N-CA 124.448 1.023 . . . . 0.0 114.388 -177.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.6 mt -82.13 -14.35 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.666 0 CA-C-N 118.69 1.245 . . . . 0.0 108.9 178.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.03 -31.72 69.49 Favored 'General case' 0 N--CA 1.523 3.188 0 CA-C-N 119.821 1.191 . . . . 0.0 110.675 176.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.3 p -83.51 -42.61 16.67 Favored 'General case' 1 N--CA 1.541 4.115 0 CA-C-N 119.926 1.239 . . . . 0.0 111.636 -179.702 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -70.61 -23.42 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.873 0 CA-C-O 118.043 -0.98 . . . . 0.0 112.587 -178.18 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 70.8 p -105.5 -25.32 12.37 Favored 'General case' 0 N--CA 1.517 2.901 0 CA-C-N 119.605 1.093 . . . . 0.0 111.321 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.9 ptt180 -79.11 -22.51 45.1 Favored 'General case' 0 N--CA 1.535 3.811 0 CA-C-N 120.105 1.321 . . . . 0.0 108.116 174.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.49 -32.29 82.91 Favored Glycine 1 N--CA 1.516 4.005 0 N-CA-C 110.009 -1.237 . . . . 0.0 110.009 176.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 60.2 p -68.07 -32.3 72.54 Favored 'General case' 0 N--CA 1.537 3.91 0 CA-C-N 118.577 1.189 . . . . 0.0 110.031 177.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -60.15 -30.66 69.45 Favored 'General case' 1 N--CA 1.541 4.093 0 C-N-CA 123.726 0.81 . . . . 0.0 111.132 178.224 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 18.4 m -61.04 -42.0 97.65 Favored 'General case' 0 N--CA 1.537 3.909 0 C-N-CA 123.813 0.845 . . . . 0.0 111.578 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 22.1 mt -57.54 -39.72 77.24 Favored 'General case' 0 N--CA 1.531 3.585 0 C-N-CA 124.064 0.946 . . . . 0.0 111.42 -179.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 12.1 mmpt? -59.3 -20.82 57.58 Favored 'General case' 1 N--CA 1.542 4.131 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -178.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -95.88 -48.15 5.85 Favored 'General case' 0 N--CA 1.52 3.044 0 CA-C-N 119.083 0.856 . . . . 0.0 111.864 -178.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.35 160.7 0.35 Allowed Pre-proline 1 N--CA 1.553 4.716 0 CA-C-O 118.14 -0.933 . . . . 0.0 113.486 -178.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -79.68 174.62 11.52 Favored 'Trans proline' 0 C--N 1.381 2.286 0 C-N-CA 121.661 1.574 . . . . 0.0 110.444 179.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -98.82 -28.65 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.972 0 CA-C-O 117.484 -1.246 . . . . 0.0 111.779 -178.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -63.64 -40.61 97.31 Favored 'General case' 0 N--CA 1.515 2.804 0 CA-C-N 119.966 1.257 . . . . 0.0 110.468 -178.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.5 mp -98.13 -18.29 18.58 Favored 'General case' 0 N--CA 1.512 2.641 0 C-N-CA 123.337 0.655 . . . . 0.0 111.517 178.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.53 -29.18 69.21 Favored 'General case' 1 N--CA 1.547 4.397 0 N-CA-C 103.293 -2.854 . . . . 0.0 103.293 169.029 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -57.36 -39.72 76.58 Favored 'General case' 0 N--CA 1.515 2.797 0 C-N-CA 124.29 1.036 . . . . 0.0 110.335 174.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 53.0 t90 -64.03 -34.98 79.25 Favored 'General case' 0 N--CA 1.533 3.701 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 177.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.78 -38.25 60.8 Favored 'General case' 1 N--CA 1.54 4.056 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 176.408 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -68.03 -38.69 82.85 Favored 'General case' 1 N--CA 1.54 4.062 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 175.772 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -61.58 -22.33 65.11 Favored 'General case' 1 N--CA 1.544 4.263 0 C-N-CA 123.45 0.7 . . . . 0.0 110.983 176.6 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -118.97 6.32 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.543 0 CA-C-N 118.481 0.582 . . . . 0.0 112.192 -177.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -108.27 -56.28 2.27 Favored 'General case' 0 N--CA 1.514 2.757 0 N-CA-C 106.028 -1.842 . . . . 0.0 106.028 176.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 35.2 mt . . . . . 1 N--CA 1.544 4.248 0 C-N-CA 125.708 1.603 . . . . 0.0 111.712 179.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 . . . . . 0 N--CA 1.525 3.295 0 CA-C-O 118.947 -0.549 . . . . 0.0 109.749 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 519' ' ' TRP . . . . . 0.439 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 64.6 t-105 -40.64 -32.47 0.21 Allowed 'General case' 1 N--CA 1.548 4.449 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -179.297 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 520' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -90.12 -31.06 17.26 Favored 'General case' 0 N--CA 1.525 3.298 0 CA-C-O 117.867 -1.063 . . . . 0.0 113.418 -172.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 31.6 ttt180 -61.51 -23.09 65.67 Favored 'General case' 1 N--CA 1.544 4.269 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 171.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . 0.439 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.1 m-85 -82.02 -39.36 23.65 Favored 'General case' 0 N--CA 1.513 2.722 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 174.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 41.2 t -64.99 -22.45 31.46 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.228 0 CA-C-O 117.911 -1.042 . . . . 0.0 112.08 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -76.62 -52.8 9.01 Favored 'General case' 0 N--CA 1.534 3.761 0 CA-C-N 120.116 1.326 . . . . 0.0 107.963 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 7.4 mp -66.74 -21.64 66.06 Favored 'General case' 0 N--CA 1.533 3.722 0 CA-C-O 119.401 -0.333 . . . . 0.0 110.273 176.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -70.06 -37.16 75.44 Favored 'General case' 0 N--CA 1.52 3.036 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 176.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 10.3 ttmt -66.68 -24.56 66.28 Favored 'General case' 0 N--CA 1.517 2.888 0 CA-C-O 118.153 -0.927 . . . . 0.0 110.695 176.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -69.21 -38.2 78.46 Favored 'General case' 1 N--CA 1.541 4.08 0 CA-C-N 119.544 1.065 . . . . 0.0 109.017 176.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 529' ' ' ALA . . . . . . . . . . . . . . . -91.68 -9.02 45.4 Favored 'General case' 0 N--CA 1.499 1.983 0 CA-C-O 118.019 -0.991 . . . . 0.0 111.242 178.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -81.72 -30.79 32.39 Favored 'General case' 0 N--CA 1.53 3.549 0 CA-C-N 120.73 1.605 . . . . 0.0 108.595 179.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -61.53 -42.87 99.45 Favored 'General case' 0 N--CA 1.538 3.928 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 176.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -95.71 -86.72 0.3 Allowed 'General case' 0 N--CA 1.518 2.969 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 177.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.8 p30 151.26 52.87 0.0 OUTLIER 'General case' 1 N--CA 1.558 4.94 0 C-N-CA 127.755 2.422 . . . . 0.0 107.59 177.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 6.2 mt -111.11 8.02 21.59 Favored 'General case' 0 N--CA 1.532 3.675 0 C-N-CA 124.161 0.985 . . . . 0.0 111.703 -178.226 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 535' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 -81.98 -1.82 49.45 Favored 'General case' 0 N--CA 1.513 2.712 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 175.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 536' ' ' LEU . . . . . 0.401 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 46.3 mt -91.87 -50.32 0.31 Allowed Pre-proline 0 N--CA 1.507 2.388 0 CA-C-O 116.346 -1.787 . . . . 0.0 109.092 -176.446 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 537' ' ' PRO . . . . . 0.401 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 3.3 Cg_exo -64.48 -37.13 40.06 Favored 'Trans proline' 0 C--N 1.394 2.959 0 N-CA-C 107.225 -1.875 . . . . 0.0 107.225 171.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.94 -41.3 97.8 Favored 'General case' 0 N--CA 1.527 3.394 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 175.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 8.1 mt -70.15 -24.11 63.11 Favored 'General case' 0 N--CA 1.536 3.84 0 CA-C-O 118.045 -0.979 . . . . 0.0 111.448 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -78.34 -6.76 56.07 Favored 'General case' 0 N--CA 1.526 3.365 0 CA-C-N 119.405 1.002 . . . . 0.0 110.645 178.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -106.67 -43.22 4.77 Favored 'General case' 0 N--CA 1.513 2.718 0 C-N-CA 124.159 0.984 . . . . 0.0 109.212 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 7.8 ptt? -94.84 -3.44 48.89 Favored 'General case' 0 N--CA 1.53 3.571 0 CA-C-O 117.78 -1.105 . . . . 0.0 112.728 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.67 -108.17 0.3 Allowed 'General case' 0 N--CA 1.526 3.34 0 CA-C-N 120.386 1.448 . . . . 0.0 112.236 -177.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 3.9 t 157.07 140.2 0.0 OUTLIER Pre-proline 1 N--CA 1.567 5.406 0 C-N-CA 126.654 1.982 . . . . 0.0 108.332 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -52.27 -29.57 38.79 Favored 'Trans proline' 0 N--CA 1.524 3.276 0 C-N-CA 123.818 3.012 . . . . 0.0 115.891 -176.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -58.85 -31.48 68.56 Favored 'General case' 1 N--CA 1.545 4.285 0 CA-C-N 118.898 0.772 . . . . 0.0 112.514 -177.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.72 -31.28 63.3 Favored 'General case' 0 N--CA 1.524 3.239 0 CA-C-O 117.947 -1.025 . . . . 0.0 110.782 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -79.57 -20.18 47.62 Favored 'General case' 0 N--CA 1.527 3.41 0 CA-C-N 119.574 1.079 . . . . 0.0 110.633 177.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -70.07 -47.44 61.9 Favored 'General case' 0 N--CA 1.534 3.768 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 174.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -77.5 -11.67 59.88 Favored 'General case' 0 N--CA 1.512 2.664 0 CA-C-O 117.295 -1.335 . . . . 0.0 111.288 176.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 551' ' ' LEU . . . . . 0.497 HD22 ' CG ' ' A' ' 22' ' ' PHE . 13.3 tp -81.5 -33.95 31.58 Favored 'General case' 0 N--CA 1.527 3.4 0 CA-C-N 120.722 1.601 . . . . 0.0 107.486 175.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -68.47 -52.45 26.1 Favored Glycine 0 N--CA 1.509 3.518 0 N-CA-C 108.732 -1.747 . . . . 0.0 108.732 178.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.9 m -67.34 -30.61 70.48 Favored 'General case' 0 N--CA 1.532 3.628 0 CA-C-O 118.205 -0.902 . . . . 0.0 111.891 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 11.5 mtm180 -67.49 -46.74 72.06 Favored 'General case' 1 N--CA 1.545 4.32 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 176.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 19.6 t -69.81 -15.64 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.681 0 CA-C-O 118.158 -0.925 . . . . 0.0 109.5 176.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 6.8 mtm-85 -80.04 -40.82 26.94 Favored 'General case' 0 N--CA 1.523 3.217 0 CA-C-O 117.583 -1.199 . . . . 0.0 111.202 178.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 557' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.36 -25.1 19.27 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.557 0 CA-C-N 121.115 1.78 . . . . 0.0 110.236 -179.547 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 558' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -85.56 -50.92 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.928 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -58.8 -26.6 64.24 Favored 'General case' 0 N--CA 1.537 3.879 0 CA-C-O 118.985 -0.531 . . . . 0.0 110.377 178.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -95.03 -21.87 18.29 Favored 'General case' 0 N--CA 1.525 3.31 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.854 178.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 27.7 tp -71.44 -47.36 56.35 Favored 'General case' 0 N--CA 1.537 3.914 0 CA-C-N 119.751 1.16 . . . . 0.0 108.617 178.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 51.7 mt -59.26 -18.5 37.94 Favored 'General case' 0 N--CA 1.536 3.839 0 CA-C-O 118.143 -0.932 . . . . 0.0 113.157 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -94.21 -46.53 7.04 Favored 'General case' 0 N--CA 1.526 3.369 0 CA-C-N 119.359 0.982 . . . . 0.0 108.971 179.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 68.42 66.75 2.19 Favored Glycine 1 N--CA 1.52 4.262 0 CA-C-O 119.374 -0.681 . . . . 0.0 112.364 178.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -118.31 -59.56 1.88 Allowed 'General case' 0 N--CA 1.525 3.316 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 178.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 75.1 mtm -152.65 80.64 1.22 Allowed 'General case' 0 N--CA 1.522 3.138 0 N-CA-C 105.25 -2.13 . . . . 0.0 105.25 178.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 50.0 m -131.63 -9.0 3.62 Favored 'General case' 0 N--CA 1.524 3.248 0 N-CA-C 114.049 1.129 . . . . 0.0 114.049 -173.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -117.27 -56.15 2.26 Favored 'General case' 0 N--CA 1.526 3.325 0 CA-C-N 119.852 1.205 . . . . 0.0 110.989 -179.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -89.74 -62.8 1.39 Allowed 'General case' 0 N--CA 1.526 3.375 0 C-N-CA 122.661 0.385 . . . . 0.0 111.538 -178.071 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -80.59 -0.45 37.93 Favored 'General case' 0 N--CA 1.521 3.076 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -176.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 21.4 tp -78.84 -45.81 20.01 Favored 'General case' 0 N--CA 1.526 3.337 0 CA-C-N 120.207 1.367 . . . . 0.0 110.398 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -45.81 -28.75 1.14 Allowed 'General case' 0 N--CA 1.534 3.771 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 -177.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -73.25 -41.33 63.82 Favored 'General case' 0 N--CA 1.532 3.666 0 CA-C-N 118.283 0.492 . . . . 0.0 111.358 -178.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -47.29 -51.58 18.73 Favored 'General case' 0 N--CA 1.536 3.836 0 C-N-CA 124.591 1.157 . . . . 0.0 113.672 -178.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -130.07 -39.75 1.36 Allowed 'General case' 0 N--CA 1.535 3.811 0 CA-C-O 118.662 -0.685 . . . . 0.0 111.857 -179.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 107.31 76.02 0.96 Allowed Glycine 1 N--CA 1.52 4.262 0 N-CA-C 110.331 -1.107 . . . . 0.0 110.331 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -114.23 -1.88 13.51 Favored 'General case' 0 N--CA 1.526 3.374 0 C-N-CA 123.463 0.705 . . . . 0.0 111.47 178.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 72.49 169.24 12.95 Favored Glycine 1 N--CA 1.52 4.272 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -178.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -90.4 -13.18 9.31 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.812 0 CA-C-N 118.554 1.177 . . . . 0.0 108.966 177.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -64.98 -37.65 88.35 Favored 'General case' 0 N--CA 1.526 3.346 0 CA-C-N 120.154 1.343 . . . . 0.0 111.583 178.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 2.8 p -82.97 -41.98 18.13 Favored 'General case' 1 N--CA 1.542 4.145 0 CA-C-N 120.1 1.318 . . . . 0.0 111.839 -179.378 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 17.2 pt -70.25 -18.11 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.959 0 CA-C-O 117.685 -1.15 . . . . 0.0 113.385 -177.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 80.0 p -112.76 -27.49 8.13 Favored 'General case' 0 N--CA 1.514 2.774 0 CA-C-N 119.962 1.255 . . . . 0.0 111.038 177.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -75.57 -20.31 58.71 Favored 'General case' 0 N--CA 1.535 3.775 0 CA-C-N 120.049 1.295 . . . . 0.0 108.491 174.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -65.12 -36.59 93.12 Favored Glycine 1 N--CA 1.517 4.037 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 176.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 68.4 p -64.95 -33.85 77.02 Favored 'General case' 1 N--CA 1.541 4.119 0 CA-C-N 118.399 1.099 . . . . 0.0 110.325 177.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -56.52 -35.06 67.62 Favored 'General case' 1 N--CA 1.545 4.289 0 C-N-CA 123.819 0.848 . . . . 0.0 111.134 178.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 28.5 m -57.55 -42.84 83.79 Favored 'General case' 1 N--CA 1.541 4.096 0 C-N-CA 123.651 0.78 . . . . 0.0 111.153 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 19.8 mt -56.46 -44.82 80.9 Favored 'General case' 0 N--CA 1.528 3.447 0 C-N-CA 124.03 0.932 . . . . 0.0 111.63 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 20.9 mmmt -57.46 -26.47 61.27 Favored 'General case' 1 N--CA 1.544 4.229 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -86.86 -39.98 15.33 Favored 'General case' 0 N--CA 1.515 2.801 0 CA-C-N 118.493 0.588 . . . . 0.0 110.728 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.6 162.3 28.42 Favored Pre-proline 1 N--CA 1.542 4.136 0 CA-C-O 118.346 -0.835 . . . . 0.0 111.974 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -84.98 172.07 8.92 Favored 'Trans proline' 0 C--N 1.377 2.068 0 C-N-CA 122.045 1.83 . . . . 0.0 111.309 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.2 t -92.31 -24.64 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.118 0 CA-C-O 117.818 -1.087 . . . . 0.0 111.497 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -62.9 -40.66 98.24 Favored 'General case' 0 N--CA 1.516 2.866 0 CA-C-N 120.004 1.275 . . . . 0.0 110.437 -179.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 7.1 mp -102.14 -12.54 17.99 Favored 'General case' 0 N--CA 1.511 2.59 0 C-N-CA 123.388 0.675 . . . . 0.0 112.188 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -31.46 71.46 Favored 'General case' 1 N--CA 1.544 4.241 0 N-CA-C 102.572 -3.122 . . . . 0.0 102.572 167.055 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.47 -38.29 68.91 Favored 'General case' 0 N--CA 1.52 3.054 0 C-N-CA 124.937 1.295 . . . . 0.0 110.289 174.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 599' ' ' TRP . . . . . 0.406 ' HA ' ' HB2' ' B' ' 602' ' ' GLU . 53.2 t90 -64.72 -35.84 82.37 Favored 'General case' 0 N--CA 1.538 3.946 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 176.798 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.37 -37.44 62.41 Favored 'General case' 0 N--CA 1.535 3.822 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 176.282 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -68.91 -37.53 79.02 Favored 'General case' 1 N--CA 1.544 4.248 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 175.273 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 602' ' ' GLU . . . . . 0.406 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 3.1 mm-40 -60.88 -21.75 63.6 Favored 'General case' 1 N--CA 1.543 4.192 0 C-N-CA 123.362 0.665 . . . . 0.0 110.494 175.867 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -123.9 6.99 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.536 0 C-N-CA 123.269 0.628 . . . . 0.0 112.439 -177.618 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -111.11 -59.43 1.97 Allowed 'General case' 0 N--CA 1.514 2.74 0 N-CA-C 105.385 -2.08 . . . . 0.0 105.385 176.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 12.6 tp . . . . . 0 N--CA 1.537 3.917 0 C-N-CA 125.085 1.354 . . . . 0.0 111.546 177.528 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 . . . . . 0 N--CA 1.516 2.832 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.453 ' HA ' HD21 ' B' ' 551' ' ' LEU . 66.6 t-105 -53.42 -39.46 64.36 Favored 'General case' 0 N--CA 1.536 3.85 0 C-N-CA 123.042 0.537 . . . . 0.0 109.64 175.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -79.93 -27.29 39.86 Favored 'General case' 0 N--CA 1.517 2.898 0 CA-C-O 117.372 -1.299 . . . . 0.0 112.259 -175.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.8 mtt-85 -57.6 -31.72 66.49 Favored 'General case' 1 N--CA 1.547 4.406 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 172.126 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.515 ' CG ' HD22 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -80.78 -36.81 31.31 Favored 'General case' 0 N--CA 1.504 2.247 0 CA-C-O 116.22 -1.847 . . . . 0.0 109.668 174.615 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.7 t -69.98 -22.83 24.87 Favored 'Isoleucine or valine' 1 N--CA 1.565 5.289 0 CA-C-N 121.373 1.897 . . . . 0.0 112.498 -176.147 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -78.21 -48.56 15.56 Favored 'General case' 0 N--CA 1.535 3.781 0 CA-C-N 120.418 1.463 . . . . 0.0 107.496 178.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.2 mp -70.38 -17.9 63.04 Favored 'General case' 0 N--CA 1.535 3.818 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 175.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.53 -38.56 67.99 Favored 'General case' 0 N--CA 1.517 2.907 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 176.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.454 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 32.6 tttt -66.61 -16.94 64.55 Favored 'General case' 0 N--CA 1.514 2.727 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.025 176.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -74.14 -40.08 62.86 Favored 'General case' 0 N--CA 1.528 3.457 0 N-CA-C 108.32 -0.992 . . . . 0.0 108.32 175.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -89.92 -4.5 57.48 Favored 'General case' 0 N--CA 1.505 2.321 0 CA-C-O 118.701 -0.666 . . . . 0.0 110.434 177.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.454 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -87.55 -33.98 18.73 Favored 'General case' 0 N--CA 1.529 3.518 0 CA-C-N 120.364 1.438 . . . . 0.0 108.381 179.34 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -61.64 -41.82 98.03 Favored 'General case' 0 N--CA 1.537 3.907 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -92.55 -85.38 0.26 Allowed 'General case' 0 N--CA 1.511 2.612 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 177.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p30 150.47 46.84 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.071 0 C-N-CA 127.673 2.389 . . . . 0.0 108.56 177.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.8 mt -106.02 16.19 25.41 Favored 'General case' 0 N--CA 1.522 3.171 0 C-N-CA 124.557 1.143 . . . . 0.0 110.365 -178.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 42.7 p-80 -82.65 4.2 25.82 Favored 'General case' 0 N--CA 1.514 2.735 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 175.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.408 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 17.5 mt -92.67 -50.45 0.28 Allowed Pre-proline 0 N--CA 1.509 2.49 0 C-N-CA 125.462 1.505 . . . . 0.0 108.665 -176.116 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.408 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 9.5 Cg_exo -62.51 -35.96 68.14 Favored 'Trans proline' 0 C--N 1.391 2.811 0 N-CA-C 105.945 -2.367 . . . . 0.0 105.945 168.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.1 tt -53.7 -44.24 69.63 Favored 'General case' 0 N--CA 1.534 3.725 0 C-N-CA 124.085 0.954 . . . . 0.0 108.998 174.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.73 -40.91 94.14 Favored 'General case' 1 N--CA 1.557 4.898 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 177.834 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -63.59 -12.97 37.44 Favored 'General case' 0 N--CA 1.535 3.807 0 CA-C-O 118.123 -0.942 . . . . 0.0 113.036 -179.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -110.92 -41.78 4.16 Favored 'General case' 0 N--CA 1.531 3.579 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 -177.41 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 4.0 ptp -128.72 13.27 6.39 Favored 'General case' 1 N--CA 1.55 4.571 0 CA-C-N 119.848 1.204 . . . . 0.0 113.436 -175.359 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -113.2 -72.65 0.7 Allowed 'General case' 0 N--CA 1.496 1.856 0 CA-C-N 118.99 0.814 . . . . 0.0 108.946 179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 14.2 p 126.52 156.98 0.0 OUTLIER Pre-proline 1 N--CA 1.549 4.507 0 C-N-CA 128.629 2.772 . . . . 0.0 107.343 -178.02 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -70.03 -35.74 11.32 Favored 'Trans proline' 0 CA--C 1.571 2.366 0 C-N-CA 122.345 2.03 . . . . 0.0 107.572 174.189 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -65.31 -21.11 66.67 Favored 'General case' 0 N--CA 1.529 3.503 0 CA-C-O 118.175 -0.916 . . . . 0.0 110.296 175.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -75.03 -28.76 60.57 Favored 'General case' 0 N--CA 1.52 3.027 0 CA-C-O 117.283 -1.341 . . . . 0.0 110.137 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.8 ptt180 -87.21 -19.84 27.81 Favored 'General case' 0 N--CA 1.539 3.991 0 CA-C-N 120.406 1.457 . . . . 0.0 107.745 172.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -72.96 -24.09 60.74 Favored 'General case' 0 N--CA 1.525 3.302 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 172.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.404 ' O ' ' HB2' ' A' ' 54' ' ' ARG . . . -87.1 -42.95 12.65 Favored 'General case' 0 N--CA 1.501 2.1 0 CA-C-O 117.982 -1.009 . . . . 0.0 108.71 179.527 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.447 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 24.0 tp -68.24 -20.21 64.79 Favored 'General case' 1 N--CA 1.544 4.252 0 CA-C-N 120.753 1.615 . . . . 0.0 107.747 173.855 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.408 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -68.21 -69.27 1.42 Allowed Glycine 0 N--CA 1.5 2.966 0 C-N-CA 125.493 1.52 . . . . 0.0 111.17 177.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.7 m -75.44 -27.53 58.96 Favored 'General case' 0 N--CA 1.53 3.563 0 CA-C-O 117.838 -1.077 . . . . 0.0 112.442 -177.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.404 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -68.03 -49.4 61.72 Favored 'General case' 0 N--CA 1.531 3.62 0 CA-C-N 120.185 1.357 . . . . 0.0 107.705 177.514 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.3 t -65.67 -18.59 24.19 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.1 0 CA-C-O 117.929 -1.034 . . . . 0.0 109.776 176.258 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -71.84 -51.58 21.7 Favored 'General case' 0 N--CA 1.527 3.38 0 CA-C-N 120.012 1.278 . . . . 0.0 111.558 178.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -23.66 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.428 0 CA-C-N 120.789 1.631 . . . . 0.0 111.863 -178.049 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -86.13 -52.72 11.63 Favored 'Isoleucine or valine' 1 N--CA 1.548 4.454 0 CA-C-N 120.772 1.624 . . . . 0.0 107.308 -179.758 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -59.6 -24.06 63.47 Favored 'General case' 0 N--CA 1.532 3.634 0 CA-C-O 118.579 -0.724 . . . . 0.0 110.453 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -94.36 -24.18 17.49 Favored 'General case' 0 N--CA 1.524 3.23 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.5 177.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.0 mt -72.2 -59.85 2.53 Favored 'General case' 0 N--CA 1.536 3.848 0 CA-C-N 119.521 1.055 . . . . 0.0 110.041 -179.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 46.3 mt -50.56 -29.29 10.39 Favored 'General case' 1 N--CA 1.545 4.308 0 C-N-CA 123.443 0.697 . . . . 0.0 112.732 -179.15 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -79.91 -47.78 14.51 Favored 'General case' 0 N--CA 1.528 3.446 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 71.67 86.99 0.15 Allowed Glycine 1 N--CA 1.519 4.169 0 CA-C-O 119.368 -0.684 . . . . 0.0 112.096 178.156 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -151.39 -54.71 0.14 Allowed 'General case' 0 N--CA 1.53 3.562 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 4.3 ttt -147.2 71.75 1.23 Allowed 'General case' 0 N--CA 1.52 3.045 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 178.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.2 p -142.86 7.41 1.64 Allowed 'General case' 0 N--CA 1.52 3.066 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -175.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -122.53 -62.31 1.38 Allowed 'General case' 0 N--CA 1.529 3.488 0 CA-C-N 119.672 1.124 . . . . 0.0 111.992 -178.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -110.28 -48.79 3.13 Favored 'General case' 0 N--CA 1.524 3.236 0 C-N-CA 123.547 0.739 . . . . 0.0 109.908 -177.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -78.47 4.6 12.77 Favored 'General case' 0 N--CA 1.513 2.71 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -177.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 44.0 tp -89.13 -46.54 8.74 Favored 'General case' 0 N--CA 1.53 3.567 0 CA-C-N 120.285 1.402 . . . . 0.0 113.233 -178.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -41.7 -42.59 2.6 Favored 'General case' 1 N--CA 1.544 4.228 0 N-CA-C 116.169 1.914 . . . . 0.0 116.169 -173.906 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -64.1 -21.52 66.57 Favored 'General case' 1 N--CA 1.545 4.306 0 CA-C-N 119.071 0.85 . . . . 0.0 113.117 -177.592 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -57.65 -59.77 4.69 Favored 'General case' 0 N--CA 1.529 3.476 0 C-N-CA 124.579 1.152 . . . . 0.0 112.587 -178.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -130.78 -42.0 1.15 Allowed 'General case' 0 N--CA 1.526 3.369 0 CA-C-O 118.857 -0.592 . . . . 0.0 111.21 -179.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 120.34 78.26 0.53 Allowed Glycine 0 N--CA 1.514 3.897 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 179.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -104.53 -39.76 6.29 Favored 'General case' 0 N--CA 1.524 3.257 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 177.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.34 162.24 23.52 Favored Glycine 1 N--CA 1.524 4.547 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 -179.007 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.5 mt -84.7 -13.82 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.813 0 CA-C-N 119.721 1.761 . . . . 0.0 108.346 178.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.75 -40.31 72.77 Favored 'General case' 0 N--CA 1.517 2.878 0 CA-C-O 117.656 -1.164 . . . . 0.0 110.294 177.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 4.6 p -79.52 -42.37 25.32 Favored 'General case' 0 N--CA 1.538 3.961 0 CA-C-N 119.838 1.199 . . . . 0.0 112.807 -178.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 20.5 pt -70.88 -16.49 19.62 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.022 0 CA-C-O 117.853 -1.07 . . . . 0.0 113.749 -176.552 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 80.4 p -113.01 -32.75 6.26 Favored 'General case' 0 N--CA 1.514 2.773 0 CA-C-N 119.795 1.18 . . . . 0.0 110.216 178.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.5 ptt180 -71.91 -20.22 61.81 Favored 'General case' 0 N--CA 1.533 3.68 0 CA-C-N 119.56 1.073 . . . . 0.0 109.005 175.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -64.78 -38.18 95.26 Favored Glycine 1 N--CA 1.52 4.263 0 N-CA-C 108.529 -1.829 . . . . 0.0 108.529 175.43 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.3 m -65.09 -28.13 69.24 Favored 'General case' 1 N--CA 1.54 4.042 0 CA-C-N 117.747 0.773 . . . . 0.0 110.708 176.678 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -60.64 -31.62 70.82 Favored 'General case' 1 N--CA 1.54 4.046 0 CA-C-N 118.542 0.61 . . . . 0.0 111.228 179.218 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 2.6 m -65.59 -35.29 80.38 Favored 'General case' 0 N--CA 1.537 3.89 0 C-N-CA 123.471 0.708 . . . . 0.0 111.219 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 23.8 mt -56.33 -40.11 73.9 Favored 'General case' 0 N--CA 1.534 3.759 0 C-N-CA 124.165 0.986 . . . . 0.0 111.882 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -20.73 18.95 Favored 'General case' 1 N--CA 1.54 4.042 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 -178.756 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -106.56 -30.76 8.84 Favored 'General case' 0 N--CA 1.517 2.913 0 CA-C-N 119.301 0.955 . . . . 0.0 112.511 -179.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -49.88 160.37 0.64 Allowed Pre-proline 1 N--CA 1.55 4.531 0 CA-C-N 119.285 0.948 . . . . 0.0 113.508 -178.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -85.29 151.12 10.6 Favored 'Trans proline' 0 C--N 1.379 2.166 0 C-N-CA 122.497 2.131 . . . . 0.0 110.511 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.8 t -84.08 -25.83 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.217 0 CA-C-O 117.694 -1.146 . . . . 0.0 111.858 -179.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -63.27 -40.6 97.85 Favored 'General case' 0 N--CA 1.52 3.029 0 CA-C-N 120.346 1.43 . . . . 0.0 109.85 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.0 mp -97.87 -13.97 20.97 Favored 'General case' 0 N--CA 1.51 2.542 0 C-N-CA 123.818 0.847 . . . . 0.0 111.344 178.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.07 -36.65 84.7 Favored 'General case' 1 N--CA 1.544 4.237 0 N-CA-C 102.809 -3.034 . . . . 0.0 102.809 168.005 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -52.78 -38.27 60.87 Favored 'General case' 0 N--CA 1.517 2.886 0 C-N-CA 124.585 1.154 . . . . 0.0 111.621 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 50.6 t90 -63.0 -37.1 85.81 Favored 'General case' 0 N--CA 1.532 3.64 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 10.0 mp -55.31 -35.33 65.0 Favored 'General case' 1 N--CA 1.543 4.197 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 176.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -70.5 -35.95 73.51 Favored 'General case' 0 N--CA 1.536 3.853 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 175.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -62.2 -23.78 66.84 Favored 'General case' 1 N--CA 1.542 4.164 0 C-N-CA 123.739 0.816 . . . . 0.0 110.087 175.285 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -120.96 12.82 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.556 0 C-N-CA 123.673 0.789 . . . . 0.0 111.851 -178.052 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 43.4 mt -124.85 -62.32 1.25 Allowed 'General case' 0 N--CA 1.526 3.351 0 N-CA-C 106.573 -1.639 . . . . 0.0 106.573 176.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.8 tt . . . . . 1 N--CA 1.548 4.448 0 C-N-CA 125.278 1.431 . . . . 0.0 111.899 179.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 . . . . . 0 N--CA 1.517 2.894 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 519' ' ' TRP . . . . . 0.455 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 68.5 t-105 -43.33 -28.09 0.3 Allowed 'General case' 1 N--CA 1.545 4.324 0 C-N-CA 124.206 1.002 . . . . 0.0 113.679 179.834 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 520' ' ' LEU . . . . . 0.414 ' CD2' ' N ' ' B' ' 520' ' ' LEU . 2.2 mm? -96.12 -30.38 13.56 Favored 'General case' 0 N--CA 1.528 3.434 0 CA-C-O 117.847 -1.073 . . . . 0.0 113.733 -172.12 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 21.1 tpp180 -64.8 -23.44 67.24 Favored 'General case' 0 N--CA 1.533 3.679 0 N-CA-C 105.882 -1.896 . . . . 0.0 105.882 172.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . 0.455 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 2.1 m-85 -76.42 -41.39 47.85 Favored 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 106.059 -1.83 . . . . 0.0 106.059 172.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 72.2 t -64.53 -18.32 22.98 Favored 'Isoleucine or valine' 1 N--CA 1.559 4.986 0 CA-C-N 119.52 1.055 . . . . 0.0 111.685 177.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -76.53 -56.22 4.82 Favored 'General case' 0 N--CA 1.532 3.669 0 CA-C-N 120.276 1.398 . . . . 0.0 107.842 -179.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 5.6 mp -67.61 -18.98 65.17 Favored 'General case' 0 N--CA 1.533 3.678 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 175.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.36 -39.78 74.44 Favored 'General case' 0 N--CA 1.513 2.716 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 177.688 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -67.07 -18.65 65.43 Favored 'General case' 0 N--CA 1.524 3.24 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.884 177.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -72.97 -39.88 65.77 Favored 'General case' 0 N--CA 1.529 3.517 0 CA-C-N 119.46 1.027 . . . . 0.0 108.665 176.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 529' ' ' ALA . . . . . 0.415 ' HB2' ' N ' ' B' ' 535' ' ' HIS . . . -92.83 -7.6 45.9 Favored 'General case' 0 N--CA 1.507 2.399 0 CA-C-O 118.629 -0.7 . . . . 0.0 111.166 178.221 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.73 -34.51 24.86 Favored 'General case' 0 N--CA 1.535 3.803 0 CA-C-N 120.35 1.432 . . . . 0.0 108.515 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -62.68 -41.35 99.05 Favored 'General case' 0 N--CA 1.534 3.728 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 177.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -91.85 -87.62 0.21 Allowed 'General case' 0 N--CA 1.514 2.732 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 176.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.9 p30 150.33 51.27 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.07 0 C-N-CA 127.755 2.422 . . . . 0.0 108.415 177.227 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 4.8 mt -110.75 9.15 22.71 Favored 'General case' 0 N--CA 1.529 3.486 0 C-N-CA 124.624 1.17 . . . . 0.0 111.024 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 535' ' ' HIS . . . . . 0.415 ' N ' ' HB2' ' B' ' 529' ' ' ALA . 57.2 p-80 -82.53 -0.9 48.81 Favored 'General case' 0 N--CA 1.515 2.793 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 174.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 536' ' ' LEU . . . . . . . . . . . . . 39.2 mt -91.29 -49.82 0.33 Allowed Pre-proline 0 N--CA 1.505 2.277 0 CA-C-O 116.317 -1.802 . . . . 0.0 109.212 -176.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 537' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -66.26 -35.19 33.15 Favored 'Trans proline' 0 C--N 1.395 2.996 0 N-CA-C 107.345 -1.829 . . . . 0.0 107.345 171.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.17 -39.6 93.19 Favored 'General case' 0 N--CA 1.533 3.682 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 175.111 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 9.8 mt -73.32 -23.08 60.21 Favored 'General case' 0 N--CA 1.535 3.817 0 CA-C-O 118.583 -0.722 . . . . 0.0 111.125 177.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -71.53 -17.14 62.34 Favored 'General case' 0 N--CA 1.531 3.596 0 CA-C-N 118.853 0.751 . . . . 0.0 110.802 178.212 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 1.9 tt -101.01 -52.86 3.18 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 123.495 0.718 . . . . 0.0 110.916 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 12.2 ptm -54.55 -41.52 69.87 Favored 'General case' 0 N--CA 1.531 3.611 0 CA-C-O 117.754 -1.117 . . . . 0.0 113.301 -174.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 1.3 tt -134.37 -104.3 0.23 Allowed 'General case' 0 N--CA 1.533 3.722 0 CA-C-O 117.307 -1.33 . . . . 0.0 113.545 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 31.0 p -156.27 163.47 24.77 Favored Pre-proline 1 N--CA 1.545 4.278 0 CA-C-N 121.322 1.874 . . . . 0.0 112.389 -177.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -67.54 -27.48 39.19 Favored 'Trans proline' 0 C--N 1.392 2.85 0 C-N-CA 122.849 2.366 . . . . 0.0 111.287 176.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -61.36 -21.57 64.16 Favored 'General case' 1 N--CA 1.54 4.03 0 CA-C-O 118.327 -0.844 . . . . 0.0 111.122 178.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -71.27 -38.48 71.85 Favored 'General case' 0 N--CA 1.528 3.446 0 CA-C-N 119.061 0.846 . . . . 0.0 108.923 177.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -79.78 -19.71 47.98 Favored 'General case' 0 N--CA 1.525 3.285 0 CA-C-O 117.792 -1.099 . . . . 0.0 111.126 177.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -68.65 -45.89 70.58 Favored 'General case' 0 N--CA 1.539 3.998 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 175.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -79.53 -16.41 56.02 Favored 'General case' 0 N--CA 1.509 2.508 0 CA-C-O 117.376 -1.297 . . . . 0.0 110.726 176.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 551' ' ' LEU . . . . . 0.515 HD22 ' CG ' ' A' ' 22' ' ' PHE . 5.7 tp -74.89 -31.54 61.6 Favored 'General case' 0 N--CA 1.528 3.451 0 CA-C-N 120.758 1.617 . . . . 0.0 107.765 174.759 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -70.74 -62.06 3.79 Favored Glycine 0 N--CA 1.5 2.918 0 N-CA-C 109.051 -1.62 . . . . 0.0 109.051 178.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 3.1 m -61.05 -27.37 68.29 Favored 'General case' 1 N--CA 1.54 4.058 0 CA-C-O 118.393 -0.813 . . . . 0.0 112.119 -179.34 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 7.5 mtm180 -69.5 -49.33 55.61 Favored 'General case' 0 N--CA 1.539 3.997 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 176.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 21.8 t -66.23 -15.51 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.865 0 CA-C-O 118.144 -0.931 . . . . 0.0 109.809 175.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 26.3 mtp180 -77.75 -46.71 20.94 Favored 'General case' 0 N--CA 1.52 3.067 0 CA-C-N 119.568 1.076 . . . . 0.0 110.807 178.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 557' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -71.56 -24.71 23.76 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.502 0 CA-C-N 120.282 1.401 . . . . 0.0 111.084 -179.054 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 558' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -87.83 -52.64 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.76 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 -179.07 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -59.88 -22.95 63.02 Favored 'General case' 0 N--CA 1.534 3.741 0 CA-C-O 118.81 -0.614 . . . . 0.0 110.701 178.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -91.51 -28.34 17.65 Favored 'General case' 0 N--CA 1.524 3.249 0 CA-C-O 118.546 -0.74 . . . . 0.0 109.935 177.257 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -68.04 -46.17 71.92 Favored 'General case' 1 N--CA 1.539 4.015 0 CA-C-N 119.224 0.92 . . . . 0.0 109.249 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 33.3 mt -55.88 -25.71 43.78 Favored 'General case' 0 N--CA 1.535 3.781 0 C-N-CA 124.533 1.133 . . . . 0.0 112.234 178.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -82.99 -52.59 6.53 Favored 'General case' 0 N--CA 1.515 2.799 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 179.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 80.21 77.34 0.96 Allowed Glycine 0 N--CA 1.512 3.729 0 N-CA-C 110.018 -1.233 . . . . 0.0 110.018 179.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -144.61 -60.7 0.37 Allowed 'General case' 0 N--CA 1.523 3.208 0 CA-C-N 117.294 0.547 . . . . 0.0 109.615 -179.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 43.6 mtt -148.86 79.73 1.42 Allowed 'General case' 0 N--CA 1.524 3.251 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 17.4 m -140.46 -16.13 0.93 Allowed 'General case' 0 N--CA 1.522 3.169 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 -174.191 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -110.75 -53.43 2.7 Favored 'General case' 0 N--CA 1.531 3.6 0 CA-C-N 120.626 1.557 . . . . 0.0 112.159 -177.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -106.68 -53.37 2.63 Favored 'General case' 0 N--CA 1.528 3.458 0 C-N-CA 123.116 0.566 . . . . 0.0 110.475 -177.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -74.79 -0.13 17.27 Favored 'General case' 0 N--CA 1.515 2.812 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -177.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 42.5 tp -88.64 -49.19 7.02 Favored 'General case' 0 N--CA 1.528 3.469 0 CA-C-N 120.142 1.337 . . . . 0.0 113.682 -177.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -44.39 -46.5 9.49 Favored 'General case' 1 N--CA 1.544 4.252 0 N-CA-C 114.935 1.457 . . . . 0.0 114.935 -175.11 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -62.47 -29.97 70.92 Favored 'General case' 1 N--CA 1.54 4.032 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -177.565 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -54.83 -57.36 11.87 Favored 'General case' 0 N--CA 1.528 3.437 0 C-N-CA 124.056 0.942 . . . . 0.0 112.636 -179.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -126.12 -38.99 2.11 Favored 'General case' 0 N--CA 1.533 3.709 0 CA-C-O 118.623 -0.703 . . . . 0.0 111.616 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 123.33 65.66 0.21 Allowed Glycine 1 N--CA 1.519 4.225 0 CA-C-N 118.971 0.805 . . . . 0.0 111.122 179.281 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -120.89 102.76 8.57 Favored 'General case' 0 N--CA 1.518 2.957 0 N-CA-C 105.506 -2.035 . . . . 0.0 105.506 177.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -40.4 162.82 0.01 OUTLIER Glycine 1 N--CA 1.539 5.513 0 C-N-CA 124.758 1.17 . . . . 0.0 114.653 -177.402 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 1.1 mt -79.43 -20.59 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.627 0 CA-C-N 119.028 1.414 . . . . 0.0 108.944 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -63.41 -33.53 75.75 Favored 'General case' 0 N--CA 1.53 3.545 0 CA-C-N 120.294 1.406 . . . . 0.0 109.853 175.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.8 p -80.24 -52.47 7.7 Favored 'General case' 0 N--CA 1.532 3.638 0 CA-C-N 118.997 0.817 . . . . 0.0 111.578 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 24.2 pt -67.33 -18.7 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.83 0 CA-C-O 117.701 -1.143 . . . . 0.0 113.482 -176.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 61.0 p -107.57 -25.61 11.28 Favored 'General case' 0 N--CA 1.516 2.844 0 CA-C-N 119.814 1.188 . . . . 0.0 110.781 178.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 13.8 ptt180 -75.64 -22.27 56.95 Favored 'General case' 0 N--CA 1.532 3.653 0 CA-C-N 120.232 1.378 . . . . 0.0 108.087 174.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -69.59 -34.64 73.45 Favored Glycine 0 N--CA 1.513 3.826 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 175.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 60.2 p -72.32 -39.59 68.09 Favored 'General case' 0 N--CA 1.536 3.831 0 CA-C-N 118.362 1.081 . . . . 0.0 110.052 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -60.58 -32.59 71.69 Favored 'General case' 1 N--CA 1.541 4.09 0 C-N-CA 123.126 0.571 . . . . 0.0 110.523 179.085 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 1.4 m -58.87 -38.88 79.8 Favored 'General case' 1 N--CA 1.541 4.114 0 C-N-CA 123.436 0.695 . . . . 0.0 110.381 178.488 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 42.1 mt -61.47 -44.91 96.26 Favored 'General case' 0 N--CA 1.525 3.286 0 C-N-CA 123.955 0.902 . . . . 0.0 110.725 179.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.92 -26.21 64.14 Favored 'General case' 1 N--CA 1.543 4.202 0 C-N-CA 123.678 0.791 . . . . 0.0 112.158 179.53 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -84.05 -39.99 18.91 Favored 'General case' 0 N--CA 1.517 2.911 0 CA-C-N 118.627 0.649 . . . . 0.0 111.917 -178.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -55.63 161.58 3.07 Favored Pre-proline 1 N--CA 1.546 4.373 0 CA-C-O 118.258 -0.877 . . . . 0.0 113.098 -179.591 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -80.05 -179.89 5.65 Favored 'Trans proline' 0 C--N 1.379 2.171 0 C-N-CA 121.777 1.651 . . . . 0.0 110.355 178.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -97.83 -28.34 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.036 0 CA-C-O 117.865 -1.064 . . . . 0.0 111.489 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -61.1 -44.04 97.97 Favored 'General case' 0 N--CA 1.517 2.903 0 CA-C-N 119.808 1.185 . . . . 0.0 110.373 -178.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 6.9 mp -99.47 -14.39 19.11 Favored 'General case' 0 N--CA 1.509 2.503 0 CA-C-O 118.653 -0.689 . . . . 0.0 112.023 179.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.85 -27.84 66.18 Favored 'General case' 1 N--CA 1.54 4.052 0 N-CA-C 103.35 -2.833 . . . . 0.0 103.35 168.75 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -56.87 -38.76 73.18 Favored 'General case' 0 N--CA 1.519 3.01 0 C-N-CA 123.889 0.876 . . . . 0.0 109.641 173.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 599' ' ' TRP . . . . . . . . . . . . . 44.0 t90 -63.75 -36.09 82.75 Favored 'General case' 0 N--CA 1.529 3.482 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 177.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.28 -37.08 54.51 Favored 'General case' 0 N--CA 1.535 3.803 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 177.073 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -69.9 -38.93 76.44 Favored 'General case' 0 N--CA 1.539 3.983 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 175.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.97 -23.8 48.42 Favored 'General case' 1 N--CA 1.546 4.367 0 C-N-CA 123.199 0.6 . . . . 0.0 110.598 175.295 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -120.57 0.85 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.321 0 CA-C-O 118.351 -0.833 . . . . 0.0 113.159 -176.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -112.87 -59.73 1.98 Allowed 'General case' 0 N--CA 1.509 2.522 0 N-CA-C 105.964 -1.865 . . . . 0.0 105.964 176.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 1 N--CA 1.542 4.138 0 C-N-CA 123.948 0.899 . . . . 0.0 110.552 178.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 . . . . . 0 N--CA 1.521 3.112 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.418 ' CE3' ' CD2' ' B' ' 551' ' ' LEU . 76.4 t-105 -51.37 -44.42 62.1 Favored 'General case' 1 N--CA 1.541 4.093 0 C-N-CA 123.471 0.708 . . . . 0.0 109.736 177.29 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -77.41 -25.61 50.93 Favored 'General case' 0 N--CA 1.524 3.271 0 CA-C-O 117.557 -1.211 . . . . 0.0 111.745 -177.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.0 tpm_? -55.64 -30.54 61.17 Favored 'General case' 1 N--CA 1.544 4.266 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 173.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.509 ' O ' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -84.89 -37.57 20.46 Favored 'General case' 0 N--CA 1.507 2.411 0 CA-C-O 116.125 -1.893 . . . . 0.0 109.482 173.496 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 22.0 t -70.67 -29.9 40.03 Favored 'Isoleucine or valine' 1 N--CA 1.574 5.769 0 CA-C-N 121.382 1.901 . . . . 0.0 113.475 -174.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -73.05 -50.64 21.83 Favored 'General case' 0 N--CA 1.533 3.719 0 CA-C-N 120.298 1.408 . . . . 0.0 108.3 -179.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.7 mp -72.8 -15.69 61.63 Favored 'General case' 0 N--CA 1.525 3.314 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 175.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.509 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -69.79 -37.0 76.16 Favored 'General case' 0 N--CA 1.517 2.896 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 175.294 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.429 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 35.4 tttt -63.42 -21.68 66.44 Favored 'General case' 0 N--CA 1.522 3.169 0 CA-C-O 118.437 -0.792 . . . . 0.0 111.247 176.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -70.6 -41.47 72.27 Favored 'General case' 0 N--CA 1.534 3.768 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 175.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.72 -6.19 57.6 Favored 'General case' 0 N--CA 1.507 2.398 0 CA-C-O 118.676 -0.678 . . . . 0.0 110.908 178.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.429 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -83.94 -36.06 23.54 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-N 120.218 1.372 . . . . 0.0 108.52 179.486 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -61.08 -39.06 88.46 Favored 'General case' 0 N--CA 1.532 3.658 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 177.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -97.32 -85.45 0.36 Allowed 'General case' 0 N--CA 1.516 2.872 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 177.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p30 149.78 51.97 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.044 0 C-N-CA 127.515 2.326 . . . . 0.0 107.982 178.312 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.3 mt -112.32 11.56 20.1 Favored 'General case' 0 N--CA 1.532 3.652 0 C-N-CA 123.74 0.816 . . . . 0.0 111.354 -178.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.412 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 52.8 p-80 -81.4 0.29 38.12 Favored 'General case' 0 N--CA 1.518 2.966 0 C-N-CA 123.381 0.672 . . . . 0.0 109.473 174.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.424 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 22.8 mt -91.3 -50.98 0.31 Allowed Pre-proline 0 N--CA 1.51 2.555 0 C-N-CA 125.266 1.426 . . . . 0.0 109.148 -176.333 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.424 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 9.1 Cg_exo -62.11 -39.9 45.97 Favored 'Trans proline' 0 C--N 1.386 2.523 0 N-CA-C 106.428 -2.182 . . . . 0.0 106.428 170.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.412 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.3 OUTLIER -56.59 -38.64 72.29 Favored 'General case' 0 N--CA 1.531 3.606 0 C-N-CA 123.928 0.891 . . . . 0.0 109.736 176.11 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.0 mt -60.08 -42.25 94.2 Favored 'General case' 1 N--CA 1.561 5.093 0 CA-C-N 119.478 1.035 . . . . 0.0 109.237 175.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -63.27 -25.62 68.4 Favored 'General case' 1 N--CA 1.544 4.244 0 CA-C-O 118.614 -0.707 . . . . 0.0 112.732 -179.646 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.8 mp -81.19 -41.14 22.79 Favored 'General case' 0 N--CA 1.534 3.771 0 CA-C-N 118.827 0.74 . . . . 0.0 109.112 -179.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 11.9 ptt? -97.82 44.29 1.05 Allowed 'General case' 0 N--CA 1.53 3.537 0 N-CA-C 104.05 -2.574 . . . . 0.0 104.05 173.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.9 tp -30.73 -103.64 0.0 OUTLIER 'General case' 0 N--CA 1.531 3.611 0 C-N-CA 127.338 2.255 . . . . 0.0 115.41 -173.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 54.0 p 52.5 126.94 0.0 OUTLIER Pre-proline 0 N--CA 1.535 3.795 0 CA-C-N 120.624 1.557 . . . . 0.0 111.69 -178.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -62.09 -32.06 83.46 Favored 'Trans proline' 0 C--N 1.382 2.316 0 C-N-CA 121.27 1.313 . . . . 0.0 110.335 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -48.85 -21.78 0.7 Allowed 'General case' 1 N--CA 1.551 4.585 0 C-N-CA 124.394 1.078 . . . . 0.0 113.71 178.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -62.45 -73.81 0.1 Allowed 'General case' 0 N--CA 1.538 3.936 0 CA-C-N 119.671 1.123 . . . . 0.0 110.522 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -89.64 6.18 42.45 Favored 'General case' 0 N--CA 1.535 3.806 0 CA-C-N 119.806 1.184 . . . . 0.0 111.837 177.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -86.67 -30.77 21.48 Favored 'General case' 0 N--CA 1.518 2.975 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 172.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.88 -48.71 6.85 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.454 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 13.1 tp -65.06 -28.77 69.7 Favored 'General case' 1 N--CA 1.54 4.071 0 CA-C-N 119.98 1.263 . . . . 0.0 107.853 175.304 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.401 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -68.46 -73.72 0.67 Allowed Glycine 0 N--CA 1.505 3.262 0 C-N-CA 124.474 1.035 . . . . 0.0 112.64 177.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.5 m -69.78 -29.0 66.21 Favored 'General case' 0 N--CA 1.537 3.915 0 CA-C-O 117.989 -1.005 . . . . 0.0 113.418 -175.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.6 mtt180 -73.39 -46.89 46.19 Favored 'General case' 0 N--CA 1.53 3.532 0 CA-C-N 120.179 1.354 . . . . 0.0 107.644 178.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.5 t -66.18 -16.96 21.57 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.9 0 O-C-N 120.648 -1.282 . . . . 0.0 109.41 174.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.32 -51.48 20.5 Favored 'General case' 0 N--CA 1.529 3.51 0 CA-C-N 120.022 1.283 . . . . 0.0 111.499 177.752 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -71.84 -23.57 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.51 0 CA-C-N 120.336 1.426 . . . . 0.0 112.123 -177.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -86.11 -51.51 13.15 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.088 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 -179.697 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -58.57 -25.0 62.07 Favored 'General case' 0 N--CA 1.538 3.931 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.505 178.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -94.45 -24.3 17.37 Favored 'General case' 0 N--CA 1.526 3.341 0 CA-C-O 118.303 -0.856 . . . . 0.0 110.859 177.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 20.7 tp -79.14 -70.2 0.52 Allowed 'General case' 0 N--CA 1.529 3.506 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.8 mt -42.84 -31.93 0.55 Allowed 'General case' 1 N--CA 1.544 4.232 0 C-N-CA 125.163 1.385 . . . . 0.0 113.683 -178.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.7 mmm180 -87.99 -43.33 11.82 Favored 'General case' 0 N--CA 1.526 3.345 0 CA-C-O 119.149 -0.453 . . . . 0.0 110.115 -179.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.37 87.12 0.59 Allowed Glycine 1 N--CA 1.517 4.097 0 N-CA-C 110.678 -0.969 . . . . 0.0 110.678 178.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -148.68 -54.53 0.19 Allowed 'General case' 0 N--CA 1.522 3.146 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 76.3 mtm -148.42 83.12 1.48 Allowed 'General case' 0 N--CA 1.516 2.83 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.8 t -146.95 14.9 1.18 Allowed 'General case' 0 N--CA 1.528 3.436 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -178.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 8.4 mp0 -116.29 -72.18 0.7 Allowed 'General case' 0 N--CA 1.526 3.341 0 CA-C-N 119.154 0.888 . . . . 0.0 111.097 179.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -110.86 -46.29 3.37 Favored 'General case' 0 N--CA 1.522 3.149 0 C-N-CA 123.278 0.631 . . . . 0.0 110.135 -178.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -68.17 -14.62 63.12 Favored 'General case' 0 N--CA 1.517 2.892 0 CA-C-O 117.866 -1.064 . . . . 0.0 113.441 -178.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 13.6 tp -76.89 -60.34 2.4 Favored 'General case' 0 N--CA 1.529 3.485 0 CA-C-N 120.117 1.326 . . . . 0.0 112.701 -177.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -39.03 -32.63 0.09 Allowed 'General case' 1 N--CA 1.552 4.67 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -177.783 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -72.78 -44.64 61.31 Favored 'General case' 0 N--CA 1.532 3.642 0 CA-C-N 118.361 0.528 . . . . 0.0 110.46 -178.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -41.34 -51.65 3.63 Favored 'General case' 1 N--CA 1.541 4.094 0 C-N-CA 125.548 1.539 . . . . 0.0 113.39 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.99 -77.2 0.59 Allowed 'General case' 0 N--CA 1.532 3.674 0 CA-C-O 118.739 -0.648 . . . . 0.0 109.374 -179.703 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 157.63 45.89 0.01 OUTLIER Glycine 1 N--CA 1.522 4.38 0 CA-C-O 119.177 -0.79 . . . . 0.0 111.522 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -113.3 113.48 25.34 Favored 'General case' 0 N--CA 1.514 2.755 0 N-CA-C 107.4 -1.334 . . . . 0.0 107.4 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -44.67 176.24 0.01 OUTLIER Glycine 1 N--CA 1.541 5.652 0 C-N-CA 124.966 1.27 . . . . 0.0 115.184 -177.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.4 mt -81.55 -18.81 11.36 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.913 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 177.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.43 -0.19 19.2 Favored 'General case' 0 N--CA 1.513 2.694 0 CA-C-O 117.86 -1.067 . . . . 0.0 111.084 174.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.74 -47.94 3.91 Favored 'General case' 0 N--CA 1.536 3.864 0 CA-C-N 120.758 1.617 . . . . 0.0 109.283 176.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -66.16 -41.01 88.56 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.912 0 CA-C-O 118.938 -0.553 . . . . 0.0 111.373 -178.192 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 50.3 p -82.64 -26.28 32.33 Favored 'General case' 0 N--CA 1.519 2.991 0 CA-C-O 118.743 -0.646 . . . . 0.0 109.991 178.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.6 ttp180 -65.15 -35.16 80.22 Favored 'General case' 1 N--CA 1.544 4.264 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 175.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -56.56 -36.61 71.66 Favored Glycine 1 N--CA 1.529 4.849 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 176.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 14.7 m -62.25 -41.43 98.43 Favored 'General case' 1 N--CA 1.542 4.158 0 CA-C-N 117.552 0.676 . . . . 0.0 110.181 177.526 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -61.67 -32.72 72.92 Favored 'General case' 1 N--CA 1.541 4.084 0 C-N-CA 123.893 0.877 . . . . 0.0 112.219 -179.677 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 2.5 m -68.32 -39.43 81.96 Favored 'General case' 1 N--CA 1.54 4.026 0 CA-C-N 118.311 0.505 . . . . 0.0 111.07 -178.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.4 mt -59.35 -40.46 86.47 Favored 'General case' 0 N--CA 1.528 3.471 0 C-N-CA 123.764 0.826 . . . . 0.0 111.588 -179.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -56.82 -28.69 61.87 Favored 'General case' 1 N--CA 1.543 4.219 0 CA-C-O 118.771 -0.633 . . . . 0.0 112.064 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.96 -38.0 21.55 Favored 'General case' 0 N--CA 1.516 2.874 0 CA-C-N 118.323 0.51 . . . . 0.0 111.216 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.11 161.86 0.68 Allowed Pre-proline 1 N--CA 1.548 4.434 0 CA-C-O 118.206 -0.902 . . . . 0.0 112.897 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -81.64 170.73 14.03 Favored 'Trans proline' 0 C--N 1.379 2.155 0 C-N-CA 121.687 1.591 . . . . 0.0 110.72 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.8 t -95.34 -29.08 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.029 0 CA-C-O 117.92 -1.038 . . . . 0.0 111.076 -179.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -62.3 -42.61 99.5 Favored 'General case' 0 N--CA 1.513 2.685 0 CA-C-N 119.764 1.166 . . . . 0.0 109.962 -179.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.2 mp -98.84 -14.04 19.82 Favored 'General case' 0 N--CA 1.508 2.47 0 CA-C-O 118.302 -0.856 . . . . 0.0 112.221 179.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.42 -30.57 70.35 Favored 'General case' 1 N--CA 1.549 4.522 0 N-CA-C 102.728 -3.064 . . . . 0.0 102.728 168.254 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -57.04 -39.59 75.14 Favored 'General case' 0 N--CA 1.517 2.914 0 C-N-CA 123.871 0.868 . . . . 0.0 110.201 174.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.404 ' HA ' ' HB2' ' A' ' 102' ' ' GLU . 47.8 t90 -65.1 -33.96 77.27 Favored 'General case' 0 N--CA 1.527 3.407 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 177.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.23 -36.68 61.3 Favored 'General case' 0 N--CA 1.538 3.928 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 176.429 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -69.51 -38.7 77.69 Favored 'General case' 1 N--CA 1.54 4.052 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 175.213 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.404 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 1.2 mm-40 -59.17 -23.99 62.69 Favored 'General case' 1 N--CA 1.546 4.341 0 C-N-CA 123.4 0.68 . . . . 0.0 110.63 175.865 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.37 -2.9 10.66 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.348 0 CA-C-O 118.11 -0.947 . . . . 0.0 112.399 -176.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 54.5 mt -102.99 -62.24 1.3 Allowed 'General case' 0 N--CA 1.527 3.378 0 N-CA-C 105.088 -2.19 . . . . 0.0 105.088 174.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.6 tp . . . . . 0 N--CA 1.53 3.538 0 C-N-CA 125.077 1.351 . . . . 0.0 111.384 177.912 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 . . . . . 0 N--CA 1.522 3.137 0 CA-C-O 118.66 -0.686 . . . . 0.0 110.924 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 519' ' ' TRP . . . . . 0.479 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 70.8 t-105 -43.7 -28.68 0.43 Allowed 'General case' 1 N--CA 1.55 4.559 0 N-CA-C 113.658 0.985 . . . . 0.0 113.658 -178.542 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 520' ' ' LEU . . . . . 0.413 ' CD2' ' N ' ' B' ' 520' ' ' LEU . 2.1 mm? -97.76 -28.34 13.92 Favored 'General case' 0 N--CA 1.529 3.485 0 CA-C-O 117.637 -1.173 . . . . 0.0 113.715 -172.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -63.05 -24.84 68.1 Favored 'General case' 1 N--CA 1.54 4.039 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 171.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . 0.479 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.5 m-85 -76.73 -41.54 44.7 Favored 'General case' 0 N--CA 1.513 2.724 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 173.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 43.4 t -67.12 -22.51 29.38 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.25 0 CA-C-O 117.645 -1.169 . . . . 0.0 112.631 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -78.03 -51.45 10.31 Favored 'General case' 0 N--CA 1.528 3.44 0 CA-C-N 120.202 1.364 . . . . 0.0 109.153 -177.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 5.0 mp -75.71 -18.84 59.46 Favored 'General case' 0 N--CA 1.524 3.249 0 O-C-N 123.395 0.434 . . . . 0.0 109.979 176.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.89 -32.84 67.83 Favored 'General case' 0 N--CA 1.524 3.228 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 173.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -65.02 -26.35 68.23 Favored 'General case' 0 N--CA 1.518 2.966 0 CA-C-O 118.398 -0.81 . . . . 0.0 110.386 176.173 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -66.6 -41.93 87.67 Favored 'General case' 1 N--CA 1.54 4.071 0 CA-C-N 119.088 0.858 . . . . 0.0 108.861 176.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 529' ' ' ALA . . . . . . . . . . . . . . . -88.11 -10.47 49.96 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 118.035 -0.983 . . . . 0.0 111.548 178.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -81.31 -34.3 31.99 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-N 120.925 1.693 . . . . 0.0 108.864 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -60.31 -43.02 96.71 Favored 'General case' 0 N--CA 1.538 3.972 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 177.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 61.5 m-80 -92.96 -85.81 0.26 Allowed 'General case' 0 N--CA 1.516 2.864 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 177.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.9 p30 150.14 48.98 0.0 OUTLIER 'General case' 1 N--CA 1.559 5.017 0 C-N-CA 127.89 2.476 . . . . 0.0 108.245 177.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 6.0 mt -105.45 7.7 33.21 Favored 'General case' 0 N--CA 1.53 3.564 0 C-N-CA 124.3 1.04 . . . . 0.0 111.012 -179.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 535' ' ' HIS . . . . . . . . . . . . . 46.6 p-80 -82.52 0.47 42.39 Favored 'General case' 0 N--CA 1.508 2.469 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 175.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 536' ' ' LEU . . . . . . . . . . . . . 42.5 mt -92.93 -49.16 0.29 Allowed Pre-proline 0 N--CA 1.508 2.458 0 CA-C-O 116.391 -1.766 . . . . 0.0 109.282 -176.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 537' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -67.11 -37.01 19.9 Favored 'Trans proline' 0 C--N 1.394 2.921 0 N-CA-C 107.179 -1.893 . . . . 0.0 107.179 171.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.85 -43.69 98.0 Favored 'General case' 0 N--CA 1.529 3.507 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 176.455 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 11.6 mt -66.36 -31.04 71.57 Favored 'General case' 0 N--CA 1.537 3.893 0 CA-C-O 118.865 -0.588 . . . . 0.0 110.781 179.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -54.63 -23.48 17.28 Favored 'General case' 1 N--CA 1.542 4.158 0 CA-C-N 118.952 0.796 . . . . 0.0 111.996 178.701 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -102.18 -41.34 6.43 Favored 'General case' 0 N--CA 1.519 2.98 0 C-N-CA 123.734 0.814 . . . . 0.0 109.297 -179.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 4.3 ptt? -101.46 25.11 8.74 Favored 'General case' 1 N--CA 1.541 4.108 0 CA-C-N 119.061 0.846 . . . . 0.0 112.789 -178.427 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 18.7 tp -131.64 -96.43 0.34 Allowed 'General case' 0 N--CA 1.536 3.84 0 CA-C-O 117.559 -1.21 . . . . 0.0 112.67 178.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 18.1 p 129.14 140.23 0.0 OUTLIER Pre-proline 1 N--CA 1.558 4.952 0 C-N-CA 128.727 2.811 . . . . 0.0 106.94 -177.145 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -57.49 -32.56 94.5 Favored 'Trans proline' 0 N--CA 1.521 3.098 0 C-N-CA 122.84 2.36 . . . . 0.0 113.368 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -63.17 -34.76 78.32 Favored 'General case' 1 N--CA 1.539 4.024 0 CA-C-O 118.886 -0.578 . . . . 0.0 111.02 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -68.67 -40.97 79.91 Favored 'General case' 0 N--CA 1.53 3.534 0 CA-C-O 118.469 -0.777 . . . . 0.0 110.759 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 19.8 ptt180 -76.21 -20.5 57.41 Favored 'General case' 0 N--CA 1.529 3.519 0 CA-C-O 118.045 -0.979 . . . . 0.0 111.592 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -69.17 -44.26 72.57 Favored 'General case' 0 N--CA 1.536 3.842 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 174.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -80.18 -11.12 59.77 Favored 'General case' 0 N--CA 1.512 2.66 0 CA-C-O 117.736 -1.126 . . . . 0.0 111.538 177.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 551' ' ' LEU . . . . . 0.44 HD22 ' CG ' ' A' ' 22' ' ' PHE . 10.2 tp -77.23 -44.04 31.41 Favored 'General case' 0 N--CA 1.528 3.43 0 CA-C-N 120.779 1.627 . . . . 0.0 107.827 176.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -69.78 -49.23 37.22 Favored Glycine 0 N--CA 1.506 3.309 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.6 m -65.21 -33.81 76.88 Favored 'General case' 0 N--CA 1.532 3.667 0 CA-C-O 118.535 -0.745 . . . . 0.0 112.037 -178.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 22.6 mtt180 -65.31 -52.34 54.71 Favored 'General case' 1 N--CA 1.541 4.082 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 176.294 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 17.5 t -64.86 -16.81 20.51 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.806 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.559 177.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 11.4 mmt180 -79.11 -43.49 23.98 Favored 'General case' 0 N--CA 1.52 3.03 0 CA-C-N 119.884 1.22 . . . . 0.0 110.5 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 557' ' ' ILE . . . . . 0.474 HD12 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -75.94 -25.68 17.23 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.93 0 CA-C-N 120.124 1.329 . . . . 0.0 111.421 -178.89 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 558' ' ' VAL . . . . . 0.474 ' N ' HD12 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -86.43 -51.42 13.16 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.902 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 -178.708 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -61.08 -28.28 68.97 Favored 'General case' 0 N--CA 1.527 3.381 0 CA-C-O 118.6 -0.714 . . . . 0.0 110.326 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -89.49 -22.64 22.36 Favored 'General case' 0 N--CA 1.522 3.156 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.326 177.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.14 -46.62 70.31 Favored 'General case' 1 N--CA 1.543 4.185 0 CA-C-N 119.749 1.159 . . . . 0.0 108.379 177.503 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 15.2 mt -50.25 -28.61 7.97 Favored 'General case' 0 N--CA 1.537 3.911 0 C-N-CA 124.048 0.939 . . . . 0.0 111.978 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 24.8 mmm180 -82.61 -52.73 6.54 Favored 'General case' 0 N--CA 1.526 3.369 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 66.02 83.71 0.1 OUTLIER Glycine 1 N--CA 1.524 4.559 0 CA-C-O 119.308 -0.718 . . . . 0.0 112.949 177.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -161.8 -52.26 0.04 OUTLIER 'General case' 0 N--CA 1.528 3.46 0 CA-C-N 117.581 0.69 . . . . 0.0 109.729 178.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 86.9 mtp -145.02 54.53 1.22 Allowed 'General case' 0 N--CA 1.525 3.299 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 75.7 p -130.75 -4.88 4.09 Favored 'General case' 0 N--CA 1.522 3.16 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -176.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -107.29 -57.81 2.03 Favored 'General case' 0 N--CA 1.527 3.387 0 CA-C-N 119.938 1.244 . . . . 0.0 111.238 -178.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 3.5 ttm180 -99.53 -51.4 3.78 Favored 'General case' 0 N--CA 1.529 3.512 0 C-N-CA 123.234 0.613 . . . . 0.0 110.617 -177.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -73.73 3.77 6.03 Favored 'General case' 0 N--CA 1.515 2.797 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -176.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 45.8 tp -91.12 -56.01 3.32 Favored 'General case' 0 N--CA 1.526 3.349 0 CA-C-N 120.219 1.372 . . . . 0.0 113.299 -178.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -30.12 -34.19 0.01 OUTLIER 'General case' 1 N--CA 1.551 4.615 0 N-CA-C 117.662 2.468 . . . . 0.0 117.662 -174.67 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -55.23 -20.36 10.63 Favored 'General case' 1 N--CA 1.545 4.276 0 CA-C-N 119.155 0.889 . . . . 0.0 112.779 -179.331 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -101.95 -83.1 0.47 Allowed 'General case' 0 N--CA 1.509 2.485 0 C-N-CA 124.287 1.035 . . . . 0.0 109.143 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 55.4 mt -139.17 17.85 2.6 Favored 'General case' 0 N--CA 1.53 3.529 0 CA-C-N 119.14 0.882 . . . . 0.0 111.51 -179.086 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . -47.68 -28.75 5.39 Favored Glycine 1 N--CA 1.548 6.138 0 O-C-N 120.866 -1.146 . . . . 0.0 113.851 -179.164 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . 67.5 39.99 2.72 Favored 'General case' 1 N--CA 1.545 4.288 0 CA-C-N 118.539 1.17 . . . . 0.0 112.071 178.523 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 86.21 167.4 43.51 Favored Glycine 1 N--CA 1.519 4.195 0 CA-C-O 119.449 -0.639 . . . . 0.0 112.317 178.182 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 36.2 mm -84.63 -17.79 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.709 0 CA-C-N 118.621 1.21 . . . . 0.0 108.466 176.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -63.82 -39.39 94.12 Favored 'General case' 0 N--CA 1.523 3.218 0 CA-C-N 120.17 1.35 . . . . 0.0 110.097 177.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 15.2 p -77.44 -40.69 42.48 Favored 'General case' 1 N--CA 1.542 4.134 0 CA-C-N 119.208 0.913 . . . . 0.0 111.64 178.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 1.1 tt -63.31 -36.8 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.258 0 C-N-CA 123.563 0.745 . . . . 0.0 112.682 -175.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 41.3 p -99.24 -30.15 12.42 Favored 'General case' 0 N--CA 1.513 2.722 0 CA-C-O 118.053 -0.975 . . . . 0.0 111.428 -178.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 21.3 ptt180 -71.91 -22.66 61.45 Favored 'General case' 0 N--CA 1.533 3.676 0 CA-C-N 119.891 1.223 . . . . 0.0 109.411 175.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -77.99 -28.06 57.17 Favored Glycine 0 N--CA 1.511 3.662 0 N-CA-C 109.428 -1.469 . . . . 0.0 109.428 176.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 10.9 m -63.16 -40.35 97.31 Favored 'General case' 0 N--CA 1.537 3.9 0 CA-C-N 118.239 1.019 . . . . 0.0 111.074 179.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -61.24 -24.93 66.72 Favored 'General case' 1 N--CA 1.54 4.03 0 CA-C-O 118.783 -0.627 . . . . 0.0 112.318 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 7.8 m -64.12 -41.88 97.07 Favored 'General case' 1 N--CA 1.541 4.093 0 CA-C-N 118.726 0.694 . . . . 0.0 110.663 179.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 42.1 mt -54.7 -43.3 72.41 Favored 'General case' 0 N--CA 1.531 3.588 0 C-N-CA 124.406 1.082 . . . . 0.0 111.944 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.86 -31.98 73.12 Favored 'General case' 1 N--CA 1.541 4.117 0 C-N-CA 123.339 0.656 . . . . 0.0 112.382 -178.83 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -74.35 -35.1 63.55 Favored 'General case' 0 N--CA 1.525 3.281 0 CA-C-N 118.352 0.524 . . . . 0.0 111.983 -179.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -45.07 163.61 0.2 Allowed Pre-proline 1 N--CA 1.548 4.452 0 N-CA-C 115.207 1.558 . . . . 0.0 115.207 -178.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -86.81 173.82 5.89 Favored 'Trans proline' 0 C--N 1.38 2.229 0 C-N-CA 122.125 1.884 . . . . 0.0 107.407 174.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.9 t -98.92 -27.62 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.311 0 CA-C-N 120.188 1.358 . . . . 0.0 111.662 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -62.55 -43.4 98.91 Favored 'General case' 0 N--CA 1.517 2.905 0 CA-C-N 120.079 1.309 . . . . 0.0 110.792 -178.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 7.2 mp -99.97 -14.35 18.72 Favored 'General case' 0 N--CA 1.511 2.61 0 CA-C-O 118.723 -0.656 . . . . 0.0 112.26 179.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.07 -30.17 69.3 Favored 'General case' 0 N--CA 1.538 3.927 0 N-CA-C 103.245 -2.872 . . . . 0.0 103.245 168.412 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -54.73 -37.97 66.55 Favored 'General case' 0 N--CA 1.521 3.115 0 C-N-CA 123.868 0.867 . . . . 0.0 110.094 173.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 599' ' ' TRP . . . . . . . . . . . . . 43.3 t90 -63.06 -38.41 91.07 Favored 'General case' 0 N--CA 1.536 3.828 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.85 -36.86 59.49 Favored 'General case' 0 N--CA 1.535 3.796 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 177.24 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -70.12 -36.24 74.67 Favored 'General case' 1 N--CA 1.541 4.117 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 175.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -62.27 -23.82 66.92 Favored 'General case' 1 N--CA 1.543 4.199 0 C-N-CA 123.619 0.768 . . . . 0.0 110.402 176.229 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -115.73 9.79 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.497 0 C-N-CA 123.163 0.585 . . . . 0.0 111.832 -177.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 26.7 mt -110.03 -63.1 1.42 Allowed 'General case' 0 N--CA 1.519 2.977 0 N-CA-C 105.281 -2.118 . . . . 0.0 105.281 175.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.525 3.285 0 C-N-CA 124.484 1.114 . . . . 0.0 109.932 179.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.412 -10.642 2 O4'-C1'-N19 118.852 13.814 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.343 4 O4'-C1'-N19 119.704 14.88 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.452 4 C4'-C3'-C2' 116.902 13.702 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.565 10.289 4 O4'-C1'-N19 118.995 13.994 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' E' E ' 5' ' ' ' DC' . . . . . 0.506 ' H41' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 6 C3'--C2' 1.4 -11.793 5 O4'-C1'-N19 120.347 15.683 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.348 4 O4'-C1'-N19 120.115 15.394 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' E' E ' 7' ' ' ' DA' . . . . . 0.472 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.413 -10.509 5 N19-C1'-C2' 133.022 11.764 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' E' E ' 8' ' ' ' DG' . . . . . 0.472 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 5 C3'--C2' 1.421 -9.688 4 O4'-C1'-N19 119.673 14.842 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.409 -10.901 3 C4'-C3'-C2' 117.289 14.089 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.409 -10.919 3 O4'-C1'-N19 119.083 14.104 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.417 -10.078 4 O4'-C1'-N19 121.038 16.547 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.4 -11.753 2 O4'-C1'-N19 119.961 15.201 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.553 9.388 5 O4'-C1'-N19 123.301 19.376 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' E' E ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.407 -11.136 5 O4'-C1'-N19 119.87 15.087 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' E' E ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.937 5 O4'-C1'-N19 120.292 15.615 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.413 -10.51 4 O4'-C1'-N19 120.331 15.663 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.576 11.189 5 O4'-C1'-N19 119.761 14.951 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.401 4 O4'-C1'-N19 120.783 16.229 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.607 3 O4'-C1'-N19 119.738 14.922 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.507 6.679 4 O4'-C1'-N19 119.506 14.632 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.361 3 O4'-C1'-N19 119.528 14.66 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.406 -11.241 5 O4'-C1'-N19 119.433 14.541 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.874 3 O4'-C1'-N19 119.866 15.083 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' F' F ' 4' ' ' ' DA' . . . . . 0.4 ' N6 ' HG23 ' A' ' 79' ' ' ILE . . . . . . . . 5 C3'--C2' 1.42 -9.83 4 O4'-C1'-N19 119.757 14.946 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' F' F ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.575 11.048 4 O4'-C1'-N19 118.312 13.14 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.406 -11.174 3 O4'-C1'-N19 119.243 14.304 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.412 -11.625 4 N19-C1'-C2' 131.312 10.695 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.351 4 O4'-C1'-N19 119.423 14.529 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.503 4 O4'-C1'-N19 120.356 15.695 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.409 -10.899 4 O4'-C1'-N19 118.821 13.776 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.331 4 O4'-C1'-N19 120.417 15.771 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.228 5 C4'-C3'-C2' 117.227 14.027 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 4 O3'--C3' 1.551 9.195 4 O4'-C1'-N19 119.845 15.057 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' F' F ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.765 5 O4'-C1'-N19 118.762 13.703 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' F' F ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.426 -9.212 3 O4'-C1'-N19 119.624 14.78 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.866 4 O4'-C1'-N19 119.401 14.502 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.647 3 O4'-C1'-N19 118.716 13.645 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.463 4 O4'-C1'-N19 120.21 15.513 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.564 10.253 3 O4'-C1'-N19 120.01 15.263 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C4'--C3' 1.598 6.954 5 O4'-C1'-N19 118.173 12.967 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 . . . . . 0 N--CA 1.499 1.977 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.6 t -144.21 129.82 9.73 Favored Pre-proline 0 N--CA 1.524 3.256 0 CA-C-O 117.298 -1.334 . . . . 0.0 110.134 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -72.4 -50.07 0.25 Allowed 'Trans proline' 0 C--N 1.392 2.822 0 C-N-CA 122.542 2.161 . . . . 0.0 110.213 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -120.85 140.92 51.1 Favored 'General case' 0 N--CA 1.528 3.463 0 C-N-CA 123.18 0.592 . . . . 0.0 110.218 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 46.8 m 66.56 125.79 0.02 OUTLIER 'General case' 0 N--CA 1.537 3.885 0 C-N-CA 124.584 1.154 . . . . 0.0 110.519 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -128.12 120.63 27.76 Favored 'General case' 0 N--CA 1.521 3.076 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 63.18 122.49 0.02 OUTLIER 'General case' 0 N--CA 1.534 3.748 0 C-N-CA 124.662 1.185 . . . . 0.0 111.323 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 36.6 ttp -103.15 124.8 49.27 Favored 'General case' 0 N--CA 1.518 2.931 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -145.05 -50.77 0.26 Allowed 'General case' 0 N--CA 1.521 3.088 0 C-N-CA 122.687 0.395 . . . . 0.0 110.203 -179.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 65.57 124.8 0.02 OUTLIER 'General case' 0 N--CA 1.536 3.86 0 C-N-CA 124.519 1.128 . . . . 0.0 110.484 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -158.36 134.38 9.17 Favored 'General case' 0 N--CA 1.53 3.534 0 C-N-CA 122.703 0.401 . . . . 0.0 110.793 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 -144.45 136.07 25.75 Favored 'General case' 0 N--CA 1.526 3.345 0 C-N-CA 122.605 0.362 . . . . 0.0 111.32 -179.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -98.08 118.45 34.73 Favored 'General case' 0 N--CA 1.523 3.188 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 179.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -113.58 77.72 1.08 Allowed 'General case' 0 N--CA 1.526 3.37 0 CA-C-O 121.978 0.895 . . . . 0.0 110.739 -178.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -149.9 -68.74 0.2 Allowed 'General case' 0 N--CA 1.531 3.594 0 N-CA-C 106.908 -1.516 . . . . 0.0 106.908 178.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.428 ' CE3' ' HG ' ' B' ' 551' ' ' LEU . 68.5 t-105 -57.23 -21.09 31.44 Favored 'General case' 0 N--CA 1.534 3.771 0 CA-C-O 118.073 -0.965 . . . . 0.0 111.76 175.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -91.29 -30.6 16.5 Favored 'General case' 0 N--CA 1.529 3.476 0 CA-C-O 118.182 -0.913 . . . . 0.0 111.861 -177.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.9 mtt180 -64.12 -26.82 68.71 Favored 'General case' 0 N--CA 1.535 3.796 0 N-CA-C 106.122 -1.807 . . . . 0.0 106.122 172.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -83.21 -32.74 26.36 Favored 'General case' 0 N--CA 1.506 2.361 0 CA-C-O 116.739 -1.6 . . . . 0.0 108.564 174.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.3 t -76.25 -25.25 16.55 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.227 0 CA-C-N 121.682 2.037 . . . . 0.0 112.885 -177.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -77.97 -43.79 28.64 Favored 'General case' 0 N--CA 1.532 3.648 0 CA-C-N 120.454 1.479 . . . . 0.0 108.83 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.4 mp -71.43 -27.2 63.12 Favored 'General case' 0 N--CA 1.53 3.557 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 176.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -67.57 -35.82 79.76 Favored 'General case' 0 N--CA 1.53 3.55 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 176.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.9 ttmt -68.66 -25.68 64.94 Favored 'General case' 0 N--CA 1.515 2.781 0 CA-C-O 118.074 -0.965 . . . . 0.0 110.931 177.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -70.39 -38.51 74.71 Favored 'General case' 0 N--CA 1.533 3.676 0 CA-C-N 119.435 1.016 . . . . 0.0 109.434 178.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -89.59 -8.85 51.71 Favored 'General case' 0 N--CA 1.499 2.02 0 CA-C-O 118.371 -0.823 . . . . 0.0 110.762 178.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -79.01 -33.82 44.55 Favored 'General case' 0 N--CA 1.53 3.526 0 CA-C-N 120.136 1.335 . . . . 0.0 108.994 179.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -65.61 -43.74 88.69 Favored 'General case' 0 N--CA 1.535 3.818 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 66.9 m-80 -88.28 -88.7 0.14 Allowed 'General case' 0 N--CA 1.513 2.704 0 N-CA-C 106.341 -1.726 . . . . 0.0 106.341 176.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.8 p30 152.9 48.46 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.039 0 C-N-CA 127.318 2.247 . . . . 0.0 108.418 177.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.6 mt -109.99 14.06 23.15 Favored 'General case' 0 N--CA 1.528 3.435 0 C-N-CA 124.493 1.117 . . . . 0.0 110.456 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 30.2 p-80 -81.43 3.65 23.81 Favored 'General case' 0 N--CA 1.518 2.939 0 C-N-CA 123.381 0.672 . . . . 0.0 109.352 175.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.413 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 22.9 mt -94.03 -51.46 0.26 Allowed Pre-proline 0 N--CA 1.507 2.382 0 CA-C-O 116.857 -1.544 . . . . 0.0 108.565 -175.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.413 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 8.2 Cg_exo -61.63 -32.61 87.36 Favored 'Trans proline' 0 C--N 1.397 3.101 0 N-CA-C 106.257 -2.247 . . . . 0.0 106.257 169.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.7 tt -60.25 -46.34 90.14 Favored 'General case' 0 N--CA 1.529 3.518 0 C-N-CA 124.598 1.159 . . . . 0.0 109.05 174.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.35 -12.26 60.48 Favored 'General case' 0 N--CA 1.533 3.7 0 CA-C-O 118.526 -0.749 . . . . 0.0 111.199 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -87.84 -19.18 27.79 Favored 'General case' 0 N--CA 1.514 2.75 0 CA-C-O 117.282 -1.342 . . . . 0.0 111.273 178.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -113.93 -23.7 9.46 Favored 'General case' 0 N--CA 1.534 3.729 0 CA-C-N 120.591 1.541 . . . . 0.0 114.038 -178.301 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 23.6 ptp -129.23 27.76 5.32 Favored 'General case' 1 N--CA 1.546 4.33 0 CA-C-N 120.6 1.545 . . . . 0.0 111.46 178.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -135.16 -68.25 0.53 Allowed 'General case' 0 N--CA 1.515 2.795 0 CA-C-O 117.922 -1.037 . . . . 0.0 109.233 177.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 25.5 p 121.47 160.59 0.0 OUTLIER Pre-proline 1 N--CA 1.571 5.624 0 C-N-CA 128.003 2.521 . . . . 0.0 109.8 -179.232 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -68.14 -28.62 34.21 Favored 'Trans proline' 0 C--N 1.394 2.942 0 C-N-CA 122.3 2.0 . . . . 0.0 109.297 175.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -66.95 -19.05 65.65 Favored 'General case' 0 N--CA 1.532 3.636 0 CA-C-O 118.407 -0.806 . . . . 0.0 110.462 176.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -75.7 -29.67 59.05 Favored 'General case' 0 N--CA 1.525 3.281 0 CA-C-O 117.853 -1.07 . . . . 0.0 109.656 178.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 12.7 ptt180 -91.35 -14.32 30.93 Favored 'General case' 0 N--CA 1.535 3.806 0 CA-C-N 119.39 0.996 . . . . 0.0 108.535 173.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -79.8 -22.81 42.64 Favored 'General case' 0 N--CA 1.518 2.953 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 173.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -93.96 -36.04 12.36 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 123.854 0.862 . . . . 0.0 109.156 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.474 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 18.1 tp -75.05 -25.5 58.71 Favored 'General case' 0 N--CA 1.533 3.699 0 N-CA-C 106.684 -1.598 . . . . 0.0 106.684 174.181 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.414 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -69.8 -70.91 1.08 Allowed Glycine 0 N--CA 1.503 3.164 0 C-N-CA 125.39 1.471 . . . . 0.0 111.492 177.615 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.5 m -71.83 -27.13 62.7 Favored 'General case' 0 N--CA 1.532 3.635 0 CA-C-O 118.008 -0.996 . . . . 0.0 113.009 -176.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 39.6 mtt180 -74.31 -45.46 47.27 Favored 'General case' 0 N--CA 1.524 3.251 0 CA-C-N 120.12 1.327 . . . . 0.0 108.195 178.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 30.9 t -64.89 -18.12 23.03 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.002 0 O-C-N 120.636 -1.29 . . . . 0.0 109.164 174.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.31 -50.73 20.55 Favored 'General case' 0 N--CA 1.531 3.602 0 CA-C-N 119.734 1.152 . . . . 0.0 111.571 177.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.75 -22.57 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.823 0 CA-C-N 120.779 1.627 . . . . 0.0 111.826 -178.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -87.54 -51.49 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.986 0 CA-C-N 120.257 1.389 . . . . 0.0 107.688 -179.014 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -61.13 -22.03 64.3 Favored 'General case' 0 N--CA 1.531 3.594 0 CA-C-O 118.782 -0.627 . . . . 0.0 110.576 177.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -95.27 -24.05 16.95 Favored 'General case' 0 N--CA 1.52 3.046 0 CA-C-O 118.089 -0.958 . . . . 0.0 110.8 178.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.3 tp -77.01 -57.29 3.93 Favored 'General case' 0 N--CA 1.535 3.787 0 CA-C-N 119.662 1.119 . . . . 0.0 108.484 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 42.5 mt -45.97 -29.82 1.58 Allowed 'General case' 1 N--CA 1.544 4.262 0 C-N-CA 124.775 1.23 . . . . 0.0 112.858 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.89 -53.23 5.23 Favored 'General case' 0 N--CA 1.519 3.02 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.11 80.29 0.82 Allowed Glycine 0 N--CA 1.512 3.704 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 179.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -138.41 -59.4 0.63 Allowed 'General case' 0 N--CA 1.526 3.327 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 87.7 mtp -149.51 76.13 1.3 Allowed 'General case' 0 N--CA 1.525 3.304 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 5.6 t -142.02 3.64 1.61 Allowed 'General case' 0 N--CA 1.524 3.271 0 N-CA-C 114.245 1.202 . . . . 0.0 114.245 -176.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -116.21 -55.29 2.41 Favored 'General case' 0 N--CA 1.526 3.333 0 CA-C-N 120.018 1.281 . . . . 0.0 112.124 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -110.63 -57.23 2.25 Favored 'General case' 0 N--CA 1.527 3.424 0 C-N-CA 123.198 0.599 . . . . 0.0 111.233 -176.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -74.11 -4.85 38.16 Favored 'General case' 0 N--CA 1.518 2.968 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 60.8 tp -76.71 -48.32 19.19 Favored 'General case' 0 N--CA 1.525 3.293 0 CA-C-N 119.91 1.232 . . . . 0.0 111.446 -178.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -35.65 -40.48 0.17 Allowed 'General case' 1 N--CA 1.541 4.102 0 N-CA-C 115.514 1.672 . . . . 0.0 115.514 -175.903 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -78.03 -40.31 39.24 Favored 'General case' 0 N--CA 1.529 3.524 0 CA-C-N 118.126 0.421 . . . . 0.0 110.811 -178.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -51.97 -35.19 45.44 Favored 'General case' 0 N--CA 1.531 3.576 0 C-N-CA 124.174 0.99 . . . . 0.0 113.149 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.3 pp -132.98 -44.94 0.86 Allowed 'General case' 0 N--CA 1.533 3.712 0 CA-C-N 118.76 0.709 . . . . 0.0 111.588 -179.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 104.93 73.96 0.93 Allowed Glycine 1 N--CA 1.528 4.803 0 CA-C-N 118.975 0.807 . . . . 0.0 112.099 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.08 -12.01 6.41 Favored 'General case' 0 N--CA 1.531 3.621 0 CA-C-N 117.886 0.843 . . . . 0.0 112.831 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 86.59 167.12 43.29 Favored Glycine 1 N--CA 1.532 5.09 0 CA-C-N 119.634 1.106 . . . . 0.0 111.128 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.4 HG23 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.5 OUTLIER -87.05 -20.81 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.337 0 CA-C-N 119.483 1.641 . . . . 0.0 109.107 179.069 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.05 -30.87 71.06 Favored 'General case' 0 N--CA 1.525 3.317 0 CA-C-N 120.145 1.338 . . . . 0.0 111.995 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.5 p -83.53 -43.17 16.03 Favored 'General case' 1 N--CA 1.55 4.534 0 CA-C-N 120.249 1.386 . . . . 0.0 111.16 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 14.9 pt -70.8 -18.56 20.99 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.031 0 CA-C-O 117.958 -1.02 . . . . 0.0 112.98 -177.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 59.1 p -109.68 -31.91 7.29 Favored 'General case' 0 N--CA 1.516 2.871 0 CA-C-N 119.656 1.116 . . . . 0.0 110.688 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.2 ptt180 -73.22 -25.55 60.79 Favored 'General case' 0 N--CA 1.535 3.821 0 CA-C-N 119.475 1.034 . . . . 0.0 108.435 175.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -62.79 -31.35 79.97 Favored Glycine 1 N--CA 1.522 4.413 0 N-CA-C 108.991 -1.644 . . . . 0.0 108.991 175.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 18.3 m -63.1 -41.54 99.4 Favored 'General case' 0 N--CA 1.538 3.943 0 CA-C-N 118.004 0.902 . . . . 0.0 109.335 176.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -55.25 -28.01 50.41 Favored 'General case' 1 N--CA 1.547 4.423 0 C-N-CA 123.941 0.896 . . . . 0.0 111.942 178.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.4 m -65.81 -40.42 91.86 Favored 'General case' 0 N--CA 1.534 3.739 0 C-N-CA 123.193 0.597 . . . . 0.0 111.049 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.7 mt -58.92 -41.48 87.39 Favored 'General case' 0 N--CA 1.534 3.74 0 C-N-CA 124.291 1.036 . . . . 0.0 111.021 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.49 -21.02 65.18 Favored 'General case' 1 N--CA 1.54 4.025 0 CA-C-O 118.458 -0.782 . . . . 0.0 112.61 -179.636 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.59 -42.41 11.42 Favored 'General case' 0 N--CA 1.517 2.896 0 CA-C-N 118.915 0.78 . . . . 0.0 111.367 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.54 158.19 8.58 Favored Pre-proline 1 N--CA 1.542 4.165 0 CA-C-O 118.308 -0.853 . . . . 0.0 112.857 -179.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -84.66 170.2 10.33 Favored 'Trans proline' 0 C--N 1.377 2.048 0 C-N-CA 122.215 1.944 . . . . 0.0 110.401 178.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.405 ' HA ' ' HB3' ' A' ' 97' ' ' ARG . 2.9 t -90.83 -25.36 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.074 0 CA-C-O 117.912 -1.042 . . . . 0.0 111.543 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -61.91 -43.85 98.0 Favored 'General case' 0 N--CA 1.516 2.851 0 CA-C-N 119.966 1.257 . . . . 0.0 110.135 -179.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.3 mp -99.07 -16.09 18.78 Favored 'General case' 0 N--CA 1.511 2.588 0 C-N-CA 123.344 0.658 . . . . 0.0 111.704 178.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.405 ' HB3' ' HA ' ' A' ' 94' ' ' VAL . 0.2 OUTLIER -68.12 -26.25 65.71 Favored 'General case' 1 N--CA 1.541 4.084 0 N-CA-C 103.809 -2.663 . . . . 0.0 103.809 169.174 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -57.5 -40.1 77.92 Favored 'General case' 0 N--CA 1.516 2.874 0 C-N-CA 123.688 0.795 . . . . 0.0 109.519 174.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.412 ' HA ' ' HB2' ' A' ' 102' ' ' GLU . 57.2 t90 -63.93 -34.98 79.2 Favored 'General case' 0 N--CA 1.527 3.419 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 177.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.57 -38.73 60.52 Favored 'General case' 0 N--CA 1.536 3.835 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 176.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -67.61 -38.61 84.19 Favored 'General case' 1 N--CA 1.545 4.286 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 175.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.412 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 1.0 OUTLIER -59.31 -22.7 61.63 Favored 'General case' 1 N--CA 1.549 4.475 0 C-N-CA 123.633 0.773 . . . . 0.0 110.391 175.732 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -122.58 5.25 5.64 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.259 0 C-N-CA 123.468 0.707 . . . . 0.0 112.682 -177.336 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.85 -55.89 2.34 Favored 'General case' 0 N--CA 1.516 2.863 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 175.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 5.4 tt -57.45 -47.99 80.35 Favored 'General case' 0 N--CA 1.534 3.762 0 C-N-CA 125.181 1.392 . . . . 0.0 110.802 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 41.6 tttm -91.71 -64.55 1.1 Allowed 'General case' 0 N--CA 1.524 3.27 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 51.0 m . . . . . 1 N--CA 1.54 4.058 0 C-N-CA 124.568 1.147 . . . . 0.0 111.461 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 . . . . . 0 N--CA 1.505 2.279 0 CA-C-O 119.509 -0.282 . . . . 0.0 110.285 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 53.3 p -156.17 123.35 2.71 Favored Pre-proline 0 N--CA 1.522 3.152 0 CA-C-O 117.05 -1.452 . . . . 0.0 110.364 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_endo -69.12 146.28 63.64 Favored 'Trans proline' 0 C--N 1.394 2.935 0 C-N-CA 122.513 2.142 . . . . 0.0 110.945 179.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -74.23 -64.57 0.99 Allowed 'General case' 0 N--CA 1.534 3.737 0 CA-C-O 119.091 -0.48 . . . . 0.0 110.496 -178.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 66.9 m -133.22 125.65 29.86 Favored 'General case' 0 N--CA 1.523 3.189 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -159.05 -48.43 0.06 Allowed 'General case' 0 N--CA 1.525 3.291 0 C-N-CA 122.444 0.298 . . . . 0.0 110.917 -178.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -75.21 142.62 43.42 Favored 'General case' 0 N--CA 1.526 3.358 0 O-C-N 123.296 0.373 . . . . 0.0 111.434 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 48.6 mmm 79.23 -71.64 0.09 Allowed 'General case' 0 N--CA 1.538 3.967 0 C-N-CA 125.563 1.545 . . . . 0.0 111.341 179.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -124.48 138.9 54.31 Favored 'General case' 0 N--CA 1.525 3.307 0 CA-C-N 118.882 0.765 . . . . 0.0 111.699 -178.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -104.32 -49.14 3.65 Favored 'General case' 0 N--CA 1.524 3.266 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -99.6 134.81 41.94 Favored 'General case' 0 N--CA 1.525 3.325 0 C-N-CA 123.286 0.635 . . . . 0.0 109.36 179.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 40.0 ttt180 -95.78 128.28 42.52 Favored 'General case' 0 N--CA 1.523 3.183 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 82.9 m-70 -97.95 120.98 39.31 Favored 'General case' 0 N--CA 1.523 3.205 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -115.12 -40.64 3.44 Favored 'General case' 0 N--CA 1.52 3.026 0 CA-C-O 118.353 -0.832 . . . . 0.0 112.66 -177.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -119.38 -82.37 0.64 Allowed 'General case' 0 N--CA 1.532 3.633 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -175.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 519' ' ' TRP . . . . . 0.426 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 76.2 t-105 -36.74 -29.32 0.02 OUTLIER 'General case' 1 N--CA 1.548 4.468 0 N-CA-C 116.131 1.9 . . . . 0.0 116.131 -174.72 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 520' ' ' LEU . . . . . 0.419 ' CD2' ' N ' ' B' ' 520' ' ' LEU . 2.1 mm? -98.6 -31.0 12.17 Favored 'General case' 0 N--CA 1.537 3.915 0 CA-C-O 117.98 -1.009 . . . . 0.0 113.497 -172.543 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 -62.72 -25.59 68.26 Favored 'General case' 1 N--CA 1.544 4.231 0 N-CA-C 105.639 -1.986 . . . . 0.0 105.639 171.429 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . 0.474 ' CD2' ' HG ' ' A' ' 51' ' ' LEU . 1.9 m-85 -75.29 -43.19 52.49 Favored 'General case' 0 N--CA 1.511 2.618 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 173.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 74.4 t -63.6 -18.56 22.37 Favored 'Isoleucine or valine' 1 N--CA 1.563 5.224 0 CA-C-O 117.999 -1.0 . . . . 0.0 111.334 177.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -74.66 -52.7 10.96 Favored 'General case' 0 N--CA 1.531 3.621 0 CA-C-N 119.996 1.271 . . . . 0.0 107.82 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 4.8 mp -63.33 -26.18 68.64 Favored 'General case' 0 N--CA 1.537 3.893 0 CA-C-O 119.134 -0.46 . . . . 0.0 110.165 175.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -67.52 -39.34 85.11 Favored 'General case' 0 N--CA 1.519 2.991 0 CA-C-O 118.206 -0.902 . . . . 0.0 108.602 178.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 13.7 mttt -69.17 -19.8 64.0 Favored 'General case' 0 N--CA 1.525 3.31 0 CA-C-O 118.078 -0.963 . . . . 0.0 111.262 177.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -75.25 -37.35 61.06 Favored 'General case' 0 N--CA 1.529 3.524 0 CA-C-N 119.629 1.104 . . . . 0.0 109.056 176.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 529' ' ' ALA . . . . . . . . . . . . . . . -92.81 -8.63 43.06 Favored 'General case' 0 N--CA 1.504 2.238 0 CA-C-O 118.537 -0.744 . . . . 0.0 110.475 178.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -81.53 -29.1 33.64 Favored 'General case' 0 N--CA 1.532 3.673 0 CA-C-N 119.953 1.252 . . . . 0.0 109.272 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -68.69 -43.35 76.26 Favored 'General case' 0 N--CA 1.531 3.613 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 176.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 41.5 m-80 -90.54 -91.85 0.14 Allowed 'General case' 0 N--CA 1.516 2.853 0 N-CA-C 106.625 -1.62 . . . . 0.0 106.625 176.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 3.0 p30 155.1 54.47 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.868 0 C-N-CA 127.474 2.31 . . . . 0.0 107.397 177.25 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 7.4 mt -114.64 11.6 16.99 Favored 'General case' 0 N--CA 1.53 3.531 0 C-N-CA 124.029 0.932 . . . . 0.0 111.197 -177.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 535' ' ' HIS . . . . . . . . . . . . . 42.2 p-80 -81.15 0.27 37.07 Favored 'General case' 0 N--CA 1.515 2.805 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 175.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 536' ' ' LEU . . . . . 0.408 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 35.4 mt -93.92 -51.52 0.26 Allowed Pre-proline 0 N--CA 1.506 2.37 0 CA-C-O 116.381 -1.771 . . . . 0.0 109.175 -176.166 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 537' ' ' PRO . . . . . 0.408 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 2.7 Cg_exo -64.28 -33.93 57.59 Favored 'Trans proline' 0 C--N 1.395 3.009 0 N-CA-C 107.104 -1.922 . . . . 0.0 107.104 171.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -61.94 -41.99 98.59 Favored 'General case' 0 N--CA 1.529 3.487 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 175.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 13.7 mt -70.86 -22.43 62.3 Favored 'General case' 0 N--CA 1.537 3.909 0 CA-C-O 118.419 -0.8 . . . . 0.0 111.084 177.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -76.29 -8.52 57.26 Favored 'General case' 0 N--CA 1.526 3.375 0 CA-C-N 118.934 0.788 . . . . 0.0 110.228 176.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -106.12 -46.85 3.97 Favored 'General case' 0 N--CA 1.511 2.595 0 C-N-CA 124.247 1.019 . . . . 0.0 110.238 -178.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 8.2 ptt? -94.41 -21.7 18.77 Favored 'General case' 0 N--CA 1.536 3.854 0 CA-C-O 116.85 -1.548 . . . . 0.0 114.966 -175.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 3.1 mp -119.09 -106.97 0.38 Allowed 'General case' 0 N--CA 1.534 3.752 0 CA-C-N 121.464 1.938 . . . . 0.0 113.539 -176.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 7.6 p 179.13 165.78 0.69 Allowed Pre-proline 1 N--CA 1.56 5.05 0 CA-C-N 121.381 1.901 . . . . 0.0 110.788 -176.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -69.37 -33.98 16.88 Favored 'Trans proline' 0 CA--C 1.574 2.512 0 C-N-CA 122.427 2.085 . . . . 0.0 109.031 172.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -59.94 -18.86 48.36 Favored 'General case' 0 N--CA 1.533 3.718 0 CA-C-O 118.078 -0.963 . . . . 0.0 111.633 177.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -76.74 -44.86 31.47 Favored 'General case' 0 N--CA 1.525 3.315 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 177.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 548' ' ' ARG . . . . . 0.407 ' O ' HD11 ' B' ' 551' ' ' LEU . 31.0 ptt180 -81.4 -1.85 47.19 Favored 'General case' 0 N--CA 1.533 3.707 0 CA-C-N 118.627 0.649 . . . . 0.0 110.95 176.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -84.53 -47.53 10.5 Favored 'General case' 0 N--CA 1.524 3.275 0 N-CA-C 105.07 -2.196 . . . . 0.0 105.07 174.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -75.63 -17.14 60.1 Favored 'General case' 0 N--CA 1.509 2.499 0 CA-C-O 117.414 -1.279 . . . . 0.0 111.448 177.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 551' ' ' LEU . . . . . 0.428 ' HG ' ' CE3' ' A' ' 19' ' ' TRP . 0.0 OUTLIER -74.91 -39.71 61.28 Favored 'General case' 0 N--CA 1.53 3.557 0 N-CA-C 106.35 -1.722 . . . . 0.0 106.35 175.139 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -62.79 -58.71 10.99 Favored Glycine 0 N--CA 1.495 2.577 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 -177.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.8 m -71.73 -34.59 69.69 Favored 'General case' 0 N--CA 1.537 3.904 0 CA-C-O 118.168 -0.92 . . . . 0.0 112.604 -178.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -68.25 -58.15 4.87 Favored 'General case' 1 N--CA 1.541 4.082 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 178.344 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 47.8 t -58.09 -18.9 11.77 Favored 'Isoleucine or valine' 1 N--CA 1.549 4.48 0 CA-C-O 117.621 -1.18 . . . . 0.0 110.264 175.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 13.6 mtt-85 -84.88 -32.74 23.02 Favored 'General case' 0 N--CA 1.52 3.062 0 CA-C-O 117.077 -1.439 . . . . 0.0 111.729 178.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 557' ' ' ILE . . . . . 0.411 HD11 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -77.2 -20.92 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.182 0 CA-C-N 122.049 2.204 . . . . 0.0 109.728 177.722 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 558' ' ' VAL . . . . . 0.411 ' N ' HD11 ' B' ' 557' ' ' ILE . 0.0 OUTLIER -89.44 -50.33 13.26 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.911 0 N-CA-C 106.954 -1.499 . . . . 0.0 106.954 -179.205 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -60.69 -24.78 65.89 Favored 'General case' 0 N--CA 1.531 3.607 0 CA-C-O 119.004 -0.522 . . . . 0.0 109.822 177.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -96.97 -23.74 16.15 Favored 'General case' 0 N--CA 1.522 3.13 0 CA-C-O 117.831 -1.08 . . . . 0.0 111.306 178.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 27.6 tp -75.75 -51.92 11.6 Favored 'General case' 1 N--CA 1.542 4.129 0 CA-C-N 120.108 1.322 . . . . 0.0 108.306 179.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 40.5 mt -48.24 -27.55 2.53 Favored 'General case' 1 N--CA 1.543 4.195 0 C-N-CA 124.375 1.07 . . . . 0.0 112.3 179.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.69 -51.03 13.65 Favored 'General case' 0 N--CA 1.53 3.54 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 178.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 62.78 54.91 30.15 Favored Glycine 1 N--CA 1.521 4.324 0 C-N-CA 123.975 0.797 . . . . 0.0 114.228 175.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -115.73 -56.15 2.36 Favored 'General case' 0 N--CA 1.517 2.877 0 N-CA-C 106.657 -1.608 . . . . 0.0 106.657 177.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 52.1 ttp -139.64 76.06 1.54 Allowed 'General case' 0 N--CA 1.524 3.225 0 N-CA-C 104.271 -2.492 . . . . 0.0 104.271 177.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 29.6 m -135.53 -3.28 2.38 Favored 'General case' 0 N--CA 1.522 3.173 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -173.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -98.03 -84.66 0.38 Allowed 'General case' 0 N--CA 1.52 3.029 0 CA-C-N 119.809 1.186 . . . . 0.0 110.654 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 3.9 mtt-85 -75.67 -55.91 5.2 Favored 'General case' 0 N--CA 1.527 3.386 0 CA-C-N 119.857 1.208 . . . . 0.0 111.851 -178.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -70.98 -2.4 15.17 Favored 'General case' 0 N--CA 1.523 3.21 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -174.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 34.0 tp -85.41 -47.23 10.17 Favored 'General case' 0 N--CA 1.533 3.699 0 CA-C-N 120.664 1.575 . . . . 0.0 111.773 -178.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.79 -35.88 0.55 Allowed 'General case' 1 N--CA 1.557 4.888 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -179.444 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -71.49 -39.16 71.03 Favored 'General case' 0 N--CA 1.536 3.874 0 CA-C-N 118.806 0.73 . . . . 0.0 111.02 -178.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -53.91 -59.99 3.91 Favored 'General case' 0 N--CA 1.53 3.531 0 C-N-CA 123.976 0.911 . . . . 0.0 111.743 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 5.5 mp -93.81 -64.64 1.06 Allowed 'General case' 0 N--CA 1.519 3.018 0 C-N-CA 123.224 0.61 . . . . 0.0 110.012 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 124.78 46.54 0.24 Allowed Glycine 1 N--CA 1.518 4.158 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -178.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -119.32 115.73 24.76 Favored 'General case' 0 N--CA 1.517 2.876 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -39.45 171.48 0.01 OUTLIER Glycine 1 N--CA 1.541 5.674 0 C-N-CA 125.493 1.52 . . . . 0.0 116.168 -177.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 579' ' ' ILE . . . . . 0.506 HG21 ' H41' ' E' ' 5' ' ' ' DC' . 0.6 OUTLIER -80.24 -16.37 12.8 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.386 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.504 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -68.85 -39.45 79.9 Favored 'General case' 0 N--CA 1.527 3.379 0 CA-C-N 119.502 1.046 . . . . 0.0 109.967 176.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.5 p -77.76 -38.79 46.11 Favored 'General case' 0 N--CA 1.535 3.776 0 CA-C-N 118.888 0.767 . . . . 0.0 111.502 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 2.1 tt -67.27 -35.34 73.63 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.185 0 CA-C-O 118.849 -0.596 . . . . 0.0 112.411 -175.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 82.0 p -102.27 -25.1 13.8 Favored 'General case' 0 N--CA 1.515 2.78 0 CA-C-O 117.904 -1.046 . . . . 0.0 111.573 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -73.12 -24.86 60.66 Favored 'General case' 0 N--CA 1.538 3.953 0 CA-C-N 119.981 1.264 . . . . 0.0 108.544 174.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -62.71 -36.1 92.82 Favored Glycine 1 N--CA 1.521 4.35 0 N-CA-C 107.325 -2.31 . . . . 0.0 107.325 173.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 1.7 m -60.65 -39.74 89.41 Favored 'General case' 1 N--CA 1.541 4.106 0 C-N-CA 123.94 0.896 . . . . 0.0 110.32 176.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -59.7 -32.65 70.71 Favored 'General case' 1 N--CA 1.548 4.445 0 C-N-CA 123.539 0.736 . . . . 0.0 111.683 -179.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 4.8 m -65.29 -37.62 87.73 Favored 'General case' 0 N--CA 1.535 3.817 0 C-N-CA 123.039 0.536 . . . . 0.0 110.867 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 29.8 mt -58.31 -45.23 88.4 Favored 'General case' 0 N--CA 1.529 3.52 0 C-N-CA 124.094 0.958 . . . . 0.0 111.519 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -14.82 63.27 Favored 'General case' 0 N--CA 1.538 3.934 0 CA-C-O 118.04 -0.981 . . . . 0.0 112.926 -178.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -88.52 -43.55 11.33 Favored 'General case' 0 N--CA 1.521 3.11 0 CA-C-N 119.534 1.061 . . . . 0.0 110.849 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -57.12 163.83 2.85 Favored Pre-proline 1 N--CA 1.542 4.161 0 C-N-CA 123.647 0.779 . . . . 0.0 112.934 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -80.51 173.32 12.45 Favored 'Trans proline' 0 C--N 1.381 2.26 0 C-N-CA 121.777 1.651 . . . . 0.0 110.54 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -94.73 -25.89 4.53 Favored 'Isoleucine or valine' 0 N--CA 1.522 3.173 0 CA-C-O 117.875 -1.059 . . . . 0.0 111.579 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -62.83 -41.16 99.22 Favored 'General case' 0 N--CA 1.517 2.893 0 CA-C-N 120.02 1.282 . . . . 0.0 110.246 -179.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 7.0 mp -98.45 -15.37 19.65 Favored 'General case' 0 N--CA 1.512 2.639 0 CA-C-O 118.687 -0.673 . . . . 0.0 111.878 178.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.18 -34.37 78.22 Favored 'General case' 1 N--CA 1.544 4.231 0 N-CA-C 103.338 -2.838 . . . . 0.0 103.338 168.632 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -52.76 -40.47 63.16 Favored 'General case' 0 N--CA 1.516 2.872 0 C-N-CA 124.328 1.051 . . . . 0.0 111.001 174.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 599' ' ' TRP . . . . . 0.416 ' HA ' ' HB2' ' B' ' 602' ' ' GLU . 52.3 t90 -64.68 -37.38 87.38 Favored 'General case' 0 N--CA 1.532 3.64 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 177.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -51.71 -36.86 48.45 Favored 'General case' 1 N--CA 1.541 4.106 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 176.554 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -70.51 -39.55 74.03 Favored 'General case' 0 N--CA 1.537 3.88 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 175.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 602' ' ' GLU . . . . . 0.416 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.9 OUTLIER -57.43 -24.35 55.08 Favored 'General case' 1 N--CA 1.546 4.372 0 C-N-CA 124.045 0.938 . . . . 0.0 111.505 176.41 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -107.22 -6.3 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.358 0 CA-C-O 117.862 -1.066 . . . . 0.0 113.526 -175.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 6.7 mp -104.88 -61.12 1.51 Allowed 'General case' 0 N--CA 1.525 3.307 0 N-CA-C 106.314 -1.736 . . . . 0.0 106.314 174.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 5.4 tp -45.36 -32.71 2.18 Favored 'General case' 0 N--CA 1.535 3.81 0 C-N-CA 125.507 1.523 . . . . 0.0 113.55 -179.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt 66.69 96.72 0.06 Allowed 'General case' 0 N--CA 1.529 3.525 0 C-N-CA 124.428 1.091 . . . . 0.0 109.904 -179.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 6.3 t . . . . . 0 N--CA 1.523 3.179 0 CA-C-O 118.548 -0.739 . . . . 0.0 109.855 -179.53 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.082 0 CA-C-O 118.355 -0.831 . . . . 0.0 108.832 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.504 2.272 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.42 -9.813 3 O4'-C1'-N19 119.323 14.404 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.412 -10.592 4 O4'-C1'-N19 120.299 15.623 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.202 4 O4'-C1'-N19 119.119 14.149 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.098 5 O4'-C1'-N19 120.116 15.395 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' E' E ' 5' ' ' ' DC' . . . . . 0.488 ' H42' ' HA ' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.41 -10.791 5 O4'-C1'-N19 118.578 13.472 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.404 -11.365 3 O4'-C1'-N19 118.351 13.189 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' E' E ' 7' ' ' ' DA' . . . . . 0.612 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.398 -11.963 4 C4'-C3'-C2' 112.378 9.178 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' E' E ' 8' ' ' ' DG' . . . . . 0.612 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.417 -10.095 4 O4'-C1'-N19 119.643 14.804 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.578 11.288 4 O4'-C1'-N19 119.041 14.052 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.402 -11.553 4 O4'-C1'-N19 119.324 14.406 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.406 -11.229 5 O4'-C1'-N19 121.157 16.696 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.446 4 O4'-C1'-N19 120.581 15.977 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 4 O3'--C3' 1.555 9.562 5 O4'-C1'-N19 123.677 19.846 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' E' E ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.278 4 O4'-C1'-N19 119.371 14.464 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' E' E ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.244 6 O4'-C1'-N19 119.101 14.127 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.415 -10.326 5 O4'-C1'-N19 119.889 15.111 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.464 5 O4'-C1'-N19 119.265 14.331 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.696 3 O4'-C1'-N19 120.27 15.588 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.376 5 O4'-C1'-N19 119.71 14.887 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.598 6.967 4 O4'-C1'-N19 119.223 14.279 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.499 4 C4'-C3'-C2' 116.874 13.674 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.405 -11.259 3 O4'-C1'-N19 119.618 14.772 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.312 5 O4'-C1'-N19 119.901 15.126 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' F' F ' 4' ' ' ' DA' . . . . . 0.422 ' N6 ' HG23 ' A' ' 79' ' ' ILE . . . . . . . . 5 C3'--C2' 1.429 -8.933 4 O4'-C1'-N19 119.362 14.452 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' F' F ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.569 10.625 3 O4'-C1'-N19 118.344 13.181 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.832 4 O4'-C1'-N19 119.362 14.452 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.415 -11.277 4 C4'-C3'-C2' 112.584 9.384 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.409 -10.864 4 O4'-C1'-N19 119.46 14.575 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.412 -10.615 3 C4'-C3'-C2' 117.343 14.143 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.81 3 O4'-C1'-N19 119.664 14.829 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.668 4 O4'-C1'-N19 120.747 16.184 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.6 2 O4'-C1'-N19 119.118 14.148 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.445 4 O4'-C1'-N19 119.286 14.358 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' F' F ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.221 3 C4'-C3'-C2' 116.879 13.679 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' F' F ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.333 6 O4'-C1'-N19 119.537 14.671 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.418 -9.989 5 O4'-C1'-N19 119.017 14.021 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.627 3 O4'-C1'-N19 118.952 13.939 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.433 4 O4'-C1'-N19 120.363 15.704 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.515 5 O4'-C1'-N19 120.042 15.302 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.515 7.296 3 O4'-C1'-N19 120.02 15.276 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 . . . . . 0 N--CA 1.502 2.138 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 25.4 m -146.39 129.99 8.35 Favored Pre-proline 0 N--CA 1.522 3.16 0 CA-C-O 117.49 -1.243 . . . . 0.0 110.062 -179.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -74.53 143.08 30.31 Favored 'Trans proline' 0 C--N 1.387 2.556 0 C-N-CA 122.565 2.177 . . . . 0.0 111.927 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -131.28 115.93 16.95 Favored 'General case' 0 N--CA 1.521 3.12 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 177.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.8 p -91.92 131.26 37.37 Favored 'General case' 0 N--CA 1.528 3.457 0 C-N-CA 122.694 0.398 . . . . 0.0 110.663 -178.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -115.54 121.41 42.56 Favored 'General case' 0 N--CA 1.516 2.857 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -154.65 133.49 12.22 Favored 'General case' 0 N--CA 1.521 3.121 0 C-N-CA 122.457 0.303 . . . . 0.0 110.875 -178.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 4.5 mpp? -125.63 125.82 43.73 Favored 'General case' 0 N--CA 1.516 2.847 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -121.52 121.18 36.91 Favored 'General case' 0 N--CA 1.518 2.972 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 179.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -162.28 147.71 12.77 Favored 'General case' 0 N--CA 1.53 3.568 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -178.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -81.79 132.82 35.29 Favored 'General case' 0 N--CA 1.523 3.209 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 -94.44 132.85 38.66 Favored 'General case' 0 N--CA 1.524 3.225 0 C-N-CA 122.939 0.495 . . . . 0.0 110.842 -178.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.0 t-80 -116.57 115.23 25.35 Favored 'General case' 0 N--CA 1.519 3.024 0 N-CA-C 105.484 -2.043 . . . . 0.0 105.484 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -84.67 119.72 25.57 Favored 'General case' 0 N--CA 1.52 3.026 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -176.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -149.24 -70.27 0.2 Allowed 'General case' 0 N--CA 1.523 3.181 0 N-CA-C 105.441 -2.059 . . . . 0.0 105.441 177.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 75.1 t-105 -59.99 -20.09 55.82 Favored 'General case' 0 N--CA 1.537 3.909 0 CA-C-O 117.824 -1.084 . . . . 0.0 110.973 174.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -92.25 -31.42 15.42 Favored 'General case' 0 N--CA 1.52 3.039 0 C-N-CA 124.114 0.966 . . . . 0.0 110.765 -177.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.7 mtt180 -60.83 -27.48 68.11 Favored 'General case' 0 N--CA 1.534 3.743 0 N-CA-C 106.395 -1.706 . . . . 0.0 106.395 172.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -88.53 -31.55 18.63 Favored 'General case' 0 CA--C 1.595 2.695 0 CA-C-O 116.645 -1.645 . . . . 0.0 109.332 175.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 93.3 t -74.54 -62.38 1.34 Allowed 'Isoleucine or valine' 1 N--CA 1.565 5.285 0 CA-C-N 122.215 2.28 . . . . 0.0 110.425 -178.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -52.91 -36.18 59.16 Favored 'General case' 1 N--CA 1.548 4.452 0 CA-C-N 119.106 0.866 . . . . 0.0 111.62 -178.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.94 -35.32 66.96 Favored 'General case' 0 N--CA 1.533 3.699 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 177.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.03 -40.84 95.12 Favored 'General case' 0 N--CA 1.529 3.477 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 176.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -56.47 -30.46 62.96 Favored 'General case' 0 N--CA 1.531 3.609 0 C-N-CA 123.216 0.606 . . . . 0.0 111.743 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -71.67 -42.33 67.63 Favored 'General case' 0 N--CA 1.529 3.511 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.81 3.35 48.57 Favored 'General case' 0 N--CA 1.517 2.889 0 O-C-N 123.176 0.297 . . . . 0.0 110.295 177.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -87.54 -45.65 10.27 Favored 'General case' 0 N--CA 1.524 3.236 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -58.21 -39.72 79.74 Favored 'General case' 1 N--CA 1.541 4.088 0 C-N-CA 123.292 0.637 . . . . 0.0 109.3 178.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 65.5 m-80 -92.63 -83.21 0.31 Allowed 'General case' 0 N--CA 1.512 2.669 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 177.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 p30 145.51 44.16 0.0 OUTLIER 'General case' 1 N--CA 1.562 5.157 0 C-N-CA 128.444 2.698 . . . . 0.0 107.879 178.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.3 mt -98.22 12.02 35.96 Favored 'General case' 0 N--CA 1.53 3.541 0 O-C-N 121.368 -0.832 . . . . 0.0 110.693 -179.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.467 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 1.0 OUTLIER -89.86 16.39 8.21 Favored 'General case' 0 N--CA 1.515 2.799 0 C-N-CA 123.984 0.913 . . . . 0.0 109.071 174.894 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.585 ' HA ' HD22 ' A' ' 39' ' ' LEU . 23.6 mt -98.96 -51.93 0.2 Allowed Pre-proline 0 N--CA 1.503 2.198 0 C-N-CA 125.335 1.454 . . . . 0.0 107.581 -178.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.446 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 6.1 Cg_exo -70.03 -33.43 15.57 Favored 'Trans proline' 0 C--N 1.393 2.869 0 N-CA-C 107.098 -1.924 . . . . 0.0 107.098 170.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.467 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.1 OUTLIER -65.79 -42.08 91.2 Favored 'General case' 0 N--CA 1.517 2.903 0 CA-C-O 117.93 -1.033 . . . . 0.0 108.495 177.357 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.585 HD22 ' HA ' ' A' ' 36' ' ' LEU 0.268 0.1 OUTLIER -77.42 -11.08 59.8 Favored 'General case' 1 N--CA 1.552 4.649 0 CA-C-N 120.316 1.416 . . . . 0.0 110.934 176.628 . . . . . . . . 5 4 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -91.59 9.77 30.79 Favored 'General case' 0 N--CA 1.524 3.228 0 CA-C-N 119.057 0.844 . . . . 0.0 110.038 176.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.57 -50.08 1.63 Allowed 'General case' 0 N--CA 1.522 3.166 0 CA-C-N 119.407 1.003 . . . . 0.0 109.686 -178.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 7.9 ptp -93.95 -14.0 26.44 Favored 'General case' 1 N--CA 1.543 4.222 0 CA-C-O 118.273 -0.87 . . . . 0.0 113.298 -177.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.6 mp -110.88 -83.38 0.57 Allowed 'General case' 0 N--CA 1.502 2.167 0 CA-C-O 117.934 -1.031 . . . . 0.0 110.911 -177.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 150.52 166.09 0.0 OUTLIER Pre-proline 1 N--CA 1.564 5.233 0 C-N-CA 126.144 1.778 . . . . 0.0 109.1 -178.445 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -68.86 -33.86 19.35 Favored 'Trans proline' 0 CA--C 1.574 2.515 0 C-N-CA 122.304 2.003 . . . . 0.0 108.399 173.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -62.66 -19.69 64.08 Favored 'General case' 0 N--CA 1.529 3.476 0 CA-C-O 118.058 -0.972 . . . . 0.0 111.15 177.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -73.2 -32.6 64.9 Favored 'General case' 0 N--CA 1.523 3.203 0 CA-C-O 117.684 -1.15 . . . . 0.0 109.969 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.8 ptt180 -89.5 -14.27 35.62 Favored 'General case' 0 N--CA 1.538 3.956 0 CA-C-N 119.689 1.131 . . . . 0.0 108.779 173.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -79.52 -19.35 49.81 Favored 'General case' 0 N--CA 1.516 2.847 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 172.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -95.46 -38.06 10.63 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 123.932 0.893 . . . . 0.0 109.467 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.461 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 23.3 tp -75.26 -21.77 58.31 Favored 'General case' 0 N--CA 1.534 3.753 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 173.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.407 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -69.08 -71.34 0.99 Allowed Glycine 0 N--CA 1.497 2.704 0 C-N-CA 125.104 1.335 . . . . 0.0 110.553 176.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.6 m -70.33 -28.44 65.16 Favored 'General case' 0 N--CA 1.537 3.893 0 CA-C-O 117.842 -1.075 . . . . 0.0 112.991 -177.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -69.47 -51.7 33.57 Favored 'General case' 0 N--CA 1.534 3.751 0 CA-C-N 120.007 1.276 . . . . 0.0 107.848 178.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 33.2 t -61.78 -19.31 21.0 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.241 0 CA-C-O 117.683 -1.151 . . . . 0.0 109.793 175.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.5 mtp180 -77.39 -43.94 30.97 Favored 'General case' 0 N--CA 1.526 3.355 0 CA-C-N 120.371 1.441 . . . . 0.0 112.299 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.03 -21.69 19.33 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.75 0 CA-C-N 121.719 2.054 . . . . 0.0 111.011 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -89.15 -52.18 11.25 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.024 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 -178.855 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -59.61 -23.06 62.66 Favored 'General case' 0 N--CA 1.529 3.509 0 CA-C-O 119.087 -0.482 . . . . 0.0 109.984 177.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -96.34 -22.52 17.14 Favored 'General case' 0 N--CA 1.526 3.357 0 CA-C-O 117.861 -1.066 . . . . 0.0 110.97 177.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.3 mt -75.3 -54.66 6.7 Favored 'General case' 1 N--CA 1.544 4.235 0 CA-C-N 119.999 1.272 . . . . 0.0 107.903 178.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.3 -36.34 4.02 Favored 'General case' 1 N--CA 1.545 4.278 0 C-N-CA 125.346 1.458 . . . . 0.0 112.003 179.727 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.9 mmm180 -81.85 -52.6 6.93 Favored 'General case' 0 N--CA 1.527 3.397 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.06 59.73 3.31 Favored Glycine 1 N--CA 1.517 4.081 0 CA-C-O 119.349 -0.695 . . . . 0.0 111.795 178.098 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -116.05 -54.52 2.48 Favored 'General case' 0 N--CA 1.524 3.234 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 178.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 10.7 ptp -149.39 77.64 1.35 Allowed 'General case' 0 N--CA 1.526 3.351 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 178.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 5.6 t -128.97 -8.54 4.9 Favored 'General case' 0 N--CA 1.528 3.429 0 N-CA-C 114.066 1.136 . . . . 0.0 114.066 -176.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -114.97 -59.24 2.04 Favored 'General case' 0 N--CA 1.528 3.468 0 CA-C-N 120.056 1.298 . . . . 0.0 111.955 -178.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 3.2 mmt-85 -94.68 -55.12 3.24 Favored 'General case' 0 N--CA 1.528 3.432 0 CA-C-N 118.093 0.406 . . . . 0.0 111.46 -177.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -76.87 -9.3 58.59 Favored 'General case' 0 N--CA 1.524 3.273 0 N-CA-C 114.05 1.129 . . . . 0.0 114.05 -177.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 36.4 tp -77.66 -49.65 14.08 Favored 'General case' 0 N--CA 1.526 3.37 0 CA-C-N 119.973 1.26 . . . . 0.0 112.299 -177.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.45 -34.07 15.75 Favored 'General case' 0 N--CA 1.534 3.747 0 N-CA-C 114.306 1.225 . . . . 0.0 114.306 -176.135 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -68.34 -33.54 74.47 Favored 'General case' 0 N--CA 1.535 3.805 0 CA-C-O 119.051 -0.5 . . . . 0.0 111.709 -178.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -52.54 -46.42 66.76 Favored 'General case' 0 N--CA 1.531 3.611 0 C-N-CA 124.275 1.03 . . . . 0.0 112.584 -178.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -138.16 -40.56 0.53 Allowed 'General case' 0 N--CA 1.527 3.388 0 CA-C-O 118.63 -0.7 . . . . 0.0 111.852 -179.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 107.87 79.21 1.16 Allowed Glycine 1 N--CA 1.524 4.517 0 CA-C-N 119.185 0.902 . . . . 0.0 111.712 178.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -112.47 -9.78 13.78 Favored 'General case' 0 N--CA 1.526 3.367 0 C-N-CA 123.626 0.77 . . . . 0.0 111.269 177.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 87.81 162.88 38.47 Favored Glycine 0 N--CA 1.513 3.78 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 -178.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.422 HG23 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.3 OUTLIER -85.33 -23.31 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.522 3.17 0 CA-C-N 118.825 1.313 . . . . 0.0 108.387 178.625 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.32 -29.21 70.29 Favored 'General case' 0 N--CA 1.515 2.776 0 CA-C-O 116.921 -1.514 . . . . 0.0 111.509 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.8 p -83.08 -46.91 12.25 Favored 'General case' 1 N--CA 1.545 4.296 0 CA-C-N 120.809 1.64 . . . . 0.0 110.545 178.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 15.9 pt -68.36 -16.3 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.99 0 CA-C-O 117.879 -1.058 . . . . 0.0 113.114 -177.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 62.7 p -111.19 -29.88 7.67 Favored 'General case' 0 N--CA 1.516 2.861 0 CA-C-N 120.022 1.283 . . . . 0.0 110.721 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -74.96 -21.76 58.97 Favored 'General case' 0 N--CA 1.53 3.564 0 CA-C-N 119.528 1.058 . . . . 0.0 108.309 174.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.07 -29.65 74.81 Favored Glycine 0 N--CA 1.516 3.983 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 176.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.2 t -64.37 -39.55 94.1 Favored 'General case' 0 N--CA 1.539 3.978 0 CA-C-N 118.402 1.101 . . . . 0.0 109.326 176.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -62.04 -19.1 62.52 Favored 'General case' 1 N--CA 1.543 4.187 0 CA-C-O 118.41 -0.805 . . . . 0.0 112.367 179.075 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 14.3 m -72.04 -39.93 68.74 Favored 'General case' 0 N--CA 1.535 3.79 0 CA-C-N 119.297 0.953 . . . . 0.0 110.288 179.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 54.9 mt -56.47 -49.28 75.12 Favored 'General case' 0 N--CA 1.525 3.285 0 C-N-CA 124.324 1.05 . . . . 0.0 112.525 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.66 -11.94 59.36 Favored 'General case' 1 N--CA 1.54 4.071 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -179.421 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.03 -44.72 12.79 Favored 'General case' 0 N--CA 1.519 2.997 0 CA-C-N 119.537 1.062 . . . . 0.0 110.974 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.39 161.98 5.01 Favored Pre-proline 1 N--CA 1.546 4.344 0 CA-C-O 118.249 -0.882 . . . . 0.0 112.663 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -78.22 174.61 12.19 Favored 'Trans proline' 0 C--N 1.38 2.21 0 C-N-CA 121.758 1.639 . . . . 0.0 110.43 178.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -94.56 -28.08 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.077 0 CA-C-O 117.302 -1.332 . . . . 0.0 111.721 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -64.24 -39.6 94.29 Favored 'General case' 0 N--CA 1.517 2.903 0 CA-C-N 120.37 1.441 . . . . 0.0 110.904 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.2 mp -98.9 -17.55 18.32 Favored 'General case' 0 N--CA 1.513 2.721 0 C-N-CA 123.291 0.636 . . . . 0.0 111.751 178.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.35 -32.85 74.71 Favored 'General case' 1 N--CA 1.545 4.3 0 N-CA-C 103.047 -2.946 . . . . 0.0 103.047 168.459 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -55.18 -40.28 70.53 Favored 'General case' 0 N--CA 1.515 2.808 0 C-N-CA 124.371 1.068 . . . . 0.0 110.686 174.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.416 ' HA ' ' HB2' ' A' ' 102' ' ' GLU . 54.4 t90 -62.65 -35.49 79.79 Favored 'General case' 0 N--CA 1.536 3.855 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 177.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -52.25 -39.1 59.91 Favored 'General case' 1 N--CA 1.542 4.147 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 175.905 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -68.83 -37.25 79.04 Favored 'General case' 1 N--CA 1.542 4.129 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 175.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.416 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 1.2 mm-40 -60.79 -23.39 64.99 Favored 'General case' 1 N--CA 1.546 4.362 0 C-N-CA 123.542 0.737 . . . . 0.0 110.609 175.965 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -115.49 -3.19 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.179 0 CA-C-O 118.375 -0.821 . . . . 0.0 111.921 -177.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.25 -56.24 2.53 Favored 'General case' 0 N--CA 1.516 2.842 0 N-CA-C 106.121 -1.807 . . . . 0.0 106.121 175.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.2 tt -66.68 -42.75 86.03 Favored 'General case' 0 N--CA 1.535 3.777 0 C-N-CA 124.95 1.3 . . . . 0.0 110.014 178.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 23.6 mtmt 91.87 -45.86 0.01 OUTLIER 'General case' 1 N--CA 1.549 4.478 0 C-N-CA 126.375 1.87 . . . . 0.0 110.682 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 60.5 p . . . . . 0 N--CA 1.535 3.816 0 C-N-CA 125.128 1.371 . . . . 0.0 111.861 -179.573 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 . . . . . 0 N--CA 1.501 2.105 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 6.9 t 63.57 102.48 0.04 OUTLIER Pre-proline 0 N--CA 1.535 3.82 0 C-N-CA 124.361 1.064 . . . . 0.0 109.849 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -79.84 146.06 18.31 Favored 'Trans proline' 0 C--N 1.388 2.655 0 C-N-CA 122.817 2.344 . . . . 0.0 112.15 -178.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -118.08 -51.27 2.45 Favored 'General case' 0 N--CA 1.523 3.179 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 177.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 75.6 m -119.1 137.07 53.83 Favored 'General case' 0 N--CA 1.524 3.251 0 C-N-CA 123.545 0.738 . . . . 0.0 110.222 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -81.47 -36.26 29.52 Favored 'General case' 0 N--CA 1.528 3.462 0 CA-C-O 118.944 -0.551 . . . . 0.0 111.14 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . 68.21 159.23 0.16 Allowed 'General case' 1 N--CA 1.543 4.19 0 C-N-CA 124.121 0.968 . . . . 0.0 112.294 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 7.9 tpt -98.52 142.24 30.36 Favored 'General case' 0 N--CA 1.534 3.759 0 C-N-CA 123.434 0.694 . . . . 0.0 110.162 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -155.54 -43.65 0.08 Allowed 'General case' 0 N--CA 1.526 3.364 0 CA-C-O 118.921 -0.562 . . . . 0.0 112.375 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -104.5 148.39 26.52 Favored 'General case' 0 N--CA 1.538 3.927 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -75.07 132.43 41.27 Favored 'General case' 0 N--CA 1.533 3.678 0 C-N-CA 123.008 0.523 . . . . 0.0 110.531 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -93.53 -46.96 7.06 Favored 'General case' 0 N--CA 1.527 3.412 0 CA-C-O 119.163 -0.446 . . . . 0.0 109.895 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 24.6 t60 -101.99 120.1 39.87 Favored 'General case' 0 N--CA 1.523 3.208 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -93.13 126.48 38.25 Favored 'General case' 0 N--CA 1.528 3.475 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -122.28 -84.35 0.66 Allowed 'General case' 0 N--CA 1.524 3.228 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.019 -179.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 519' ' ' TRP . . . . . 0.456 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 73.6 t-105 -44.65 -27.27 0.46 Allowed 'General case' 1 N--CA 1.55 4.57 0 CA-C-N 119.961 1.255 . . . . 0.0 113.291 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 520' ' ' LEU . . . . . 0.408 ' CD2' ' N ' ' B' ' 520' ' ' LEU . 2.2 mm? -99.3 -28.08 13.48 Favored 'General case' 0 N--CA 1.529 3.491 0 CA-C-O 117.645 -1.169 . . . . 0.0 113.273 -173.339 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 18.8 ttm180 -61.33 -26.11 67.59 Favored 'General case' 1 N--CA 1.544 4.228 0 N-CA-C 105.38 -2.081 . . . . 0.0 105.38 171.278 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . 0.461 ' CD2' ' HG ' ' A' ' 51' ' ' LEU . 1.8 m-85 -77.05 -43.8 33.16 Favored 'General case' 0 N--CA 1.507 2.423 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 174.311 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 99.2 t -71.57 -17.45 19.56 Favored 'Isoleucine or valine' 1 N--CA 1.571 5.604 0 CA-C-O 117.755 -1.116 . . . . 0.0 113.203 -178.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -79.34 -48.64 13.72 Favored 'General case' 0 N--CA 1.534 3.772 0 CA-C-N 120.631 1.56 . . . . 0.0 108.45 -178.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 5.1 mp -76.95 -18.77 58.04 Favored 'General case' 0 N--CA 1.525 3.301 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 175.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 526' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' B' ' 522' ' ' PHE . 0.2 OUTLIER -69.43 -34.4 74.39 Favored 'General case' 0 N--CA 1.519 2.989 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 173.779 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 52.5 tttt -64.37 -27.7 69.19 Favored 'General case' 0 N--CA 1.519 3.003 0 CA-C-O 118.569 -0.729 . . . . 0.0 110.543 176.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -64.67 -41.62 95.96 Favored 'General case' 0 N--CA 1.536 3.873 0 CA-C-N 118.981 0.809 . . . . 0.0 109.492 177.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 529' ' ' ALA . . . . . 0.442 ' HB2' ' N ' ' B' ' 535' ' ' HIS . . . -83.33 -13.34 55.28 Favored 'General case' 0 N--CA 1.505 2.308 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.894 178.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -76.54 -31.79 57.82 Favored 'General case' 0 N--CA 1.539 3.991 0 CA-C-N 120.401 1.455 . . . . 0.0 109.62 179.393 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -64.79 -44.66 89.24 Favored 'General case' 0 N--CA 1.536 3.872 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 178.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -89.63 -90.01 0.15 Allowed 'General case' 0 N--CA 1.515 2.782 0 N-CA-C 105.779 -1.934 . . . . 0.0 105.779 176.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.3 p30 155.56 48.9 0.0 OUTLIER 'General case' 1 N--CA 1.559 4.979 0 C-N-CA 127.447 2.299 . . . . 0.0 108.021 176.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 9.4 mt -105.38 12.6 31.41 Favored 'General case' 0 N--CA 1.52 3.041 0 C-N-CA 124.531 1.132 . . . . 0.0 110.257 -178.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 535' ' ' HIS . . . . . 0.442 ' N ' ' HB2' ' B' ' 529' ' ' ALA . 30.9 p-80 -85.17 5.57 29.45 Favored 'General case' 0 N--CA 1.51 2.565 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 175.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 536' ' ' LEU . . . . . 0.439 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 31.3 mt -97.03 -51.33 0.22 Allowed Pre-proline 0 N--CA 1.501 2.11 0 CA-C-O 116.362 -1.78 . . . . 0.0 108.45 -175.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 537' ' ' PRO . . . . . 0.439 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 6.3 Cg_exo -68.44 -36.47 15.38 Favored 'Trans proline' 0 C--N 1.394 2.925 0 N-CA-C 106.999 -1.962 . . . . 0.0 106.999 171.397 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 538' ' ' LEU . . . . . 0.407 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 0.8 OUTLIER -59.87 -45.11 93.52 Favored 'General case' 0 N--CA 1.526 3.326 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 176.382 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 39.9 mt -73.43 -20.89 60.61 Favored 'General case' 0 N--CA 1.535 3.802 0 CA-C-O 118.224 -0.893 . . . . 0.0 111.456 179.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -74.2 -23.33 59.18 Favored 'General case' 0 N--CA 1.532 3.638 0 CA-C-N 119.772 1.169 . . . . 0.0 110.049 176.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -86.1 -51.83 6.07 Favored 'General case' 0 N--CA 1.514 2.757 0 C-N-CA 123.82 0.848 . . . . 0.0 109.649 -179.098 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 8.8 ptt? -99.49 17.17 21.01 Favored 'General case' 0 N--CA 1.53 3.531 0 CA-C-O 118.024 -0.989 . . . . 0.0 113.588 -177.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -134.34 -98.85 0.25 Allowed 'General case' 0 N--CA 1.535 3.798 0 CA-C-N 120.467 1.485 . . . . 0.0 113.31 178.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 158.17 175.11 0.02 OUTLIER Pre-proline 1 N--CA 1.586 6.331 0 CA-C-N 120.985 1.72 . . . . 0.0 109.511 -177.187 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -63.18 -23.81 72.85 Favored 'Trans proline' 0 N--CA 1.525 3.364 0 C-N-CA 122.135 1.89 . . . . 0.0 110.544 174.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -54.03 -22.45 10.69 Favored 'General case' 1 N--CA 1.55 4.53 0 C-N-CA 123.894 0.877 . . . . 0.0 110.751 176.067 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -45.71 -76.23 0.03 OUTLIER 'General case' 0 N--CA 1.519 3.001 0 C-N-CA 126.333 1.853 . . . . 0.0 112.19 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -93.77 -0.6 55.82 Favored 'General case' 0 N--CA 1.526 3.356 0 N-CA-C 113.634 0.975 . . . . 0.0 113.634 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -75.69 -52.46 10.44 Favored 'General case' 1 N--CA 1.544 4.243 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 173.259 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -73.88 -22.05 59.86 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 117.016 -1.469 . . . . 0.0 111.656 177.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 551' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.22 -40.24 62.56 Favored 'General case' 0 N--CA 1.533 3.701 0 CA-C-N 121.039 1.745 . . . . 0.0 107.67 176.242 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -63.46 -47.77 84.34 Favored Glycine 0 N--CA 1.507 3.378 0 N-CA-C 110.803 -0.919 . . . . 0.0 110.803 -177.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.2 m -79.52 -39.56 31.69 Favored 'General case' 0 N--CA 1.534 3.754 0 CA-C-N 118.244 1.022 . . . . 0.0 112.086 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.2 -49.05 71.22 Favored 'General case' 0 N--CA 1.539 3.994 0 CA-C-N 119.511 1.05 . . . . 0.0 108.982 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 46.2 t -67.74 -19.82 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.761 0 CA-C-O 117.484 -1.246 . . . . 0.0 109.697 177.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 34.1 mtt180 -82.97 -33.49 26.65 Favored 'General case' 0 N--CA 1.521 3.101 0 CA-C-O 116.413 -1.756 . . . . 0.0 112.574 178.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 557' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -78.19 -22.12 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.484 0 CA-C-N 122.984 2.629 . . . . 0.0 109.573 178.221 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 558' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -85.75 -52.97 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.738 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -60.87 -28.29 68.75 Favored 'General case' 0 N--CA 1.53 3.53 0 CA-C-O 118.653 -0.689 . . . . 0.0 110.659 178.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -86.52 -26.73 24.4 Favored 'General case' 0 N--CA 1.529 3.514 0 CA-C-N 118.667 0.667 . . . . 0.0 109.592 176.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 15.9 tp -65.69 -44.07 87.33 Favored 'General case' 1 N--CA 1.54 4.046 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 21.4 mt -59.65 -21.66 60.8 Favored 'General case' 0 N--CA 1.533 3.685 0 C-N-CA 123.752 0.821 . . . . 0.0 111.719 178.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 14.2 mmm180 -77.83 -53.44 7.49 Favored 'General case' 0 N--CA 1.524 3.235 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 69.04 77.1 0.42 Allowed Glycine 1 N--CA 1.523 4.458 0 CA-C-O 119.195 -0.781 . . . . 0.0 111.197 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -162.51 -52.69 0.04 OUTLIER 'General case' 0 N--CA 1.529 3.512 0 CA-C-N 117.834 0.817 . . . . 0.0 110.36 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 75.3 mtm -136.03 62.82 1.61 Allowed 'General case' 0 N--CA 1.521 3.108 0 N-CA-C 106.106 -1.813 . . . . 0.0 106.106 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 57.9 m -136.42 9.62 3.18 Favored 'General case' 0 N--CA 1.518 2.949 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.718 -176.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -112.15 -64.31 1.31 Allowed 'General case' 0 N--CA 1.517 2.907 0 CA-C-N 119.259 0.936 . . . . 0.0 110.404 -179.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -110.03 -43.53 3.96 Favored 'General case' 0 N--CA 1.519 3.01 0 C-N-CA 123.166 0.586 . . . . 0.0 110.271 -178.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -70.07 -13.12 62.06 Favored 'General case' 0 N--CA 1.514 2.767 0 CA-C-O 117.89 -1.052 . . . . 0.0 113.551 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 18.2 tp -82.4 -51.46 7.83 Favored 'General case' 0 N--CA 1.527 3.411 0 CA-C-N 120.245 1.384 . . . . 0.0 110.615 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -44.56 -30.51 0.91 Allowed 'General case' 1 N--CA 1.55 4.563 0 CA-C-N 119.125 0.875 . . . . 0.0 113.308 179.956 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -67.21 -43.59 81.71 Favored 'General case' 0 N--CA 1.535 3.806 0 C-N-CA 122.882 0.473 . . . . 0.0 110.795 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -47.68 -50.55 24.57 Favored 'General case' 0 N--CA 1.534 3.741 0 C-N-CA 124.734 1.214 . . . . 0.0 113.449 -178.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 2.0 pp -135.97 -43.86 0.65 Allowed 'General case' 0 N--CA 1.537 3.885 0 CA-C-O 118.938 -0.554 . . . . 0.0 111.604 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 113.85 82.37 1.1 Allowed Glycine 1 N--CA 1.523 4.479 0 N-CA-C 110.305 -1.118 . . . . 0.0 110.305 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -103.2 -43.04 5.57 Favored 'General case' 0 N--CA 1.526 3.352 0 C-N-CA 123.426 0.691 . . . . 0.0 109.594 178.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 108.61 157.94 18.99 Favored Glycine 0 N--CA 1.515 3.913 0 N-CA-C 109.734 -1.346 . . . . 0.0 109.734 -179.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 579' ' ' ILE . . . . . 0.405 HG21 ' H41' ' E' ' 5' ' ' ' DC' . 0.8 OUTLIER -82.74 -15.82 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.898 0 CA-C-N 119.235 1.518 . . . . 0.0 108.265 177.701 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 580' ' ' ALA . . . . . 0.488 ' HA ' ' H42' ' E' ' 5' ' ' ' DC' . . . -69.4 -42.62 74.87 Favored 'General case' 0 N--CA 1.525 3.318 0 CA-C-N 120.047 1.294 . . . . 0.0 109.149 176.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.2 p -75.94 -38.68 57.35 Favored 'General case' 1 N--CA 1.542 4.142 0 CA-C-N 119.127 0.876 . . . . 0.0 112.365 179.31 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.66 -37.19 78.23 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.356 0 C-N-CA 123.347 0.659 . . . . 0.0 112.35 -175.112 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 75.6 p -101.07 -24.79 14.23 Favored 'General case' 0 N--CA 1.511 2.608 0 CA-C-O 117.897 -1.049 . . . . 0.0 111.685 -179.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 13.7 ptt180 -74.59 -23.69 58.78 Favored 'General case' 0 N--CA 1.526 3.365 0 CA-C-N 119.936 1.244 . . . . 0.0 109.004 175.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -63.02 -35.03 91.54 Favored Glycine 1 N--CA 1.528 4.781 0 N-CA-C 107.871 -2.092 . . . . 0.0 107.871 173.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 19.4 m -65.35 -34.52 78.52 Favored 'General case' 1 N--CA 1.541 4.104 0 C-N-CA 123.136 0.575 . . . . 0.0 110.403 176.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -62.85 -35.09 78.83 Favored 'General case' 1 N--CA 1.547 4.408 0 C-N-CA 123.354 0.662 . . . . 0.0 110.274 178.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.84 -35.26 76.1 Favored 'General case' 0 N--CA 1.534 3.758 0 C-N-CA 123.773 0.829 . . . . 0.0 111.133 179.337 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 24.1 mt -58.25 -42.47 86.46 Favored 'General case' 0 N--CA 1.531 3.575 0 C-N-CA 123.724 0.81 . . . . 0.0 110.731 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 3.1 mptt -60.29 -29.41 68.81 Favored 'General case' 1 N--CA 1.543 4.21 0 C-N-CA 123.205 0.602 . . . . 0.0 111.89 179.148 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -71.8 -40.88 68.87 Favored 'General case' 0 N--CA 1.517 2.884 0 CA-C-O 119.226 -0.416 . . . . 0.0 110.241 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -70.82 159.0 86.77 Favored Pre-proline 0 N--CA 1.527 3.41 0 CA-C-O 118.5 -0.762 . . . . 0.0 111.439 178.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -82.07 178.88 5.99 Favored 'Trans proline' 0 C--N 1.376 2.015 0 C-N-CA 122.013 1.809 . . . . 0.0 111.731 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.8 t -92.36 -26.97 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.906 0 CA-C-O 117.558 -1.211 . . . . 0.0 110.272 179.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -65.35 -38.14 89.18 Favored 'General case' 0 N--CA 1.515 2.819 0 CA-C-N 119.938 1.244 . . . . 0.0 110.195 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 6.8 mp -97.95 -20.92 17.14 Favored 'General case' 0 N--CA 1.513 2.676 0 C-N-CA 123.443 0.697 . . . . 0.0 110.973 178.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -27.42 66.83 Favored 'General case' 0 N--CA 1.536 3.854 0 N-CA-C 103.389 -2.819 . . . . 0.0 103.389 168.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.16 -39.88 79.98 Favored 'General case' 0 N--CA 1.523 3.224 0 C-N-CA 124.345 1.058 . . . . 0.0 109.742 173.401 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 599' ' ' TRP . . . . . 0.423 ' HA ' ' HB2' ' B' ' 602' ' ' GLU . 45.7 t90 -61.86 -35.72 79.14 Favored 'General case' 0 N--CA 1.526 3.374 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 178.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.81 -36.26 47.27 Favored 'General case' 1 N--CA 1.541 4.092 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 176.781 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -73.38 -37.28 66.07 Favored 'General case' 0 N--CA 1.533 3.716 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 175.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 602' ' ' GLU . . . . . 0.423 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.2 OUTLIER -59.65 -22.16 61.5 Favored 'General case' 1 N--CA 1.544 4.261 0 CA-C-O 118.675 -0.679 . . . . 0.0 110.912 175.513 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -112.93 3.15 8.32 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.763 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -176.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 75.6 mt -114.43 -60.26 1.91 Allowed 'General case' 0 N--CA 1.519 3.017 0 N-CA-C 106.395 -1.705 . . . . 0.0 106.395 175.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 4.1 mp -62.12 -64.28 0.98 Allowed 'General case' 0 N--CA 1.536 3.841 0 C-N-CA 124.467 1.107 . . . . 0.0 111.768 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 61.9 mttm -63.82 -45.85 87.76 Favored 'General case' 0 N--CA 1.534 3.752 0 C-N-CA 122.926 0.49 . . . . 0.0 111.333 -177.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 73.3 m . . . . . 0 N--CA 1.525 3.306 0 CA-C-O 118.654 -0.689 . . . . 0.0 110.418 -179.718 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.001 0 CA-C-O 117.328 -1.32 . . . . 0.0 109.03 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.956 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.421 -9.745 3 O4'-C1'-N19 119.034 14.042 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.559 4 O4'-C1'-N19 120.862 16.328 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -10.002 3 O4'-C1'-N19 119.661 14.826 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -9.967 4 O4'-C1'-N19 119.061 14.076 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' E' E ' 5' ' ' ' DC' . . . . . 0.478 ' H41' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 6 C3'--C2' 1.411 -10.663 3 O4'-C1'-N19 119.488 14.61 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.409 -10.921 5 O4'-C1'-N19 119.27 14.338 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' E' E ' 7' ' ' ' DA' . . . . . 0.555 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.396 -12.157 3 C4'-C3'-C2' 113.03 9.83 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' E' E ' 8' ' ' ' DG' . . . . . 0.555 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 O3'--C3' 1.56 9.931 4 O4'-C1'-N19 120.021 15.276 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.566 10.372 4 O4'-C1'-N19 119.817 15.022 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.408 -11.008 5 O4'-C1'-N19 120.168 15.46 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.278 2 O4'-C1'-N19 120.647 16.059 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.768 5 O4'-C1'-N19 119.014 14.017 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' E' E ' 13' ' ' ' DC' . . . . . 0.486 H2'' " O5'" ' E' ' 14' ' ' ' DT' . . . . . . . . 6 O3'--C3' 1.551 9.206 3 O4'-C1'-N19 119.586 14.733 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' E' E ' 14' ' ' ' DT' . . . . . 0.486 " O5'" H2'' ' E' ' 13' ' ' ' DC' . . . . . . . . 6 C3'--C2' 1.402 -11.606 6 O4'-C1'-N19 119.534 14.667 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' E' E ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.423 -9.516 3 O4'-C1'-N19 119.828 15.035 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.427 -9.114 4 O4'-C1'-N19 119.437 14.546 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.072 6 O4'-C1'-N19 119.169 14.211 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.293 4 O4'-C1'-N19 119.818 15.023 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.12 4 O4'-C1'-N19 119.935 15.169 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.598 6.987 4 O4'-C1'-N19 119.446 14.557 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.395 3 O4'-C1'-N19 119.551 14.689 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.407 -11.096 3 O4'-C1'-N19 119.582 14.727 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.455 5 O4'-C1'-N19 120.268 15.586 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' F' F ' 4' ' ' ' DA' . . . . . 0.466 ' N6 ' HG23 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.424 -9.447 4 O4'-C1'-N19 119.458 14.572 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' F' F ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.177 4 O4'-C1'-N19 118.688 13.61 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.407 -11.146 3 O4'-C1'-N19 120.112 15.39 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.408 -11.952 4 N19-C1'-C2' 130.914 10.446 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.42 -9.751 3 O4'-C1'-N19 119.692 14.865 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.565 10.297 3 C4'-C3'-C2' 117.038 13.838 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.407 -11.091 4 O4'-C1'-N19 118.644 13.555 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.414 -10.377 5 O4'-C1'-N19 120.31 15.637 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -10.028 5 O4'-C1'-N19 119.367 14.459 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.426 -9.173 4 O4'-C1'-N19 118.995 13.994 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' F' F ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.207 3 O4'-C1'-N19 119.327 14.409 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' F' F ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.354 6 O4'-C1'-N19 119.899 15.124 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.417 -10.077 4 O4'-C1'-N19 119.347 14.433 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.618 3 O4'-C1'-N19 119.513 14.641 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.058 4 O4'-C1'-N19 120.607 16.009 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.355 4 O4'-C1'-N19 119.371 14.464 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.513 7.116 4 O4'-C1'-N19 119.909 15.136 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 . . . . . 0 N--CA 1.505 2.318 0 CA-C-O 119.628 -0.225 . . . . 0.0 110.488 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 52.7 p -154.02 124.55 3.43 Favored Pre-proline 0 N--CA 1.524 3.26 0 CA-C-O 117.135 -1.412 . . . . 0.0 110.156 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -76.27 132.23 13.59 Favored 'Trans proline' 0 C--N 1.389 2.708 0 C-N-CA 122.648 2.232 . . . . 0.0 109.871 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -89.64 137.73 32.08 Favored 'General case' 0 N--CA 1.531 3.577 0 C-N-CA 122.486 0.314 . . . . 0.0 110.796 -179.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 50.5 p -127.99 129.7 47.17 Favored 'General case' 0 N--CA 1.522 3.13 0 C-N-CA 123.563 0.745 . . . . 0.0 109.767 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -101.43 131.65 47.42 Favored 'General case' 0 N--CA 1.522 3.161 0 C-N-CA 122.974 0.51 . . . . 0.0 110.196 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -156.23 -51.94 0.08 Allowed 'General case' 0 N--CA 1.522 3.163 0 C-N-CA 122.673 0.389 . . . . 0.0 110.284 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.44 -34.82 63.3 Favored 'General case' 0 N--CA 1.531 3.591 0 CA-C-O 118.805 -0.617 . . . . 0.0 111.18 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -95.37 123.23 38.79 Favored 'General case' 0 N--CA 1.517 2.893 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -112.9 122.64 48.24 Favored 'General case' 0 N--CA 1.516 2.849 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -138.1 152.1 48.44 Favored 'General case' 0 N--CA 1.528 3.429 0 C-N-CA 122.81 0.444 . . . . 0.0 111.02 -178.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? 61.83 119.14 0.01 OUTLIER 'General case' 0 N--CA 1.533 3.695 0 C-N-CA 124.629 1.171 . . . . 0.0 111.638 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 56.34 103.67 0.01 OUTLIER 'General case' 0 N--CA 1.531 3.589 0 C-N-CA 124.561 1.144 . . . . 0.0 111.648 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -111.46 63.59 0.61 Allowed 'General case' 0 N--CA 1.516 2.849 0 N-CA-C 106.697 -1.594 . . . . 0.0 106.697 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -132.08 -92.46 0.39 Allowed 'General case' 0 N--CA 1.514 2.74 0 CA-C-O 118.205 -0.902 . . . . 0.0 109.265 -178.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.431 ' HA ' HD21 ' B' ' 551' ' ' LEU . 72.6 t-105 -48.45 -38.49 19.96 Favored 'General case' 0 N--CA 1.534 3.728 0 CA-C-N 119.862 1.21 . . . . 0.0 112.148 179.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -87.37 -27.11 22.99 Favored 'General case' 0 N--CA 1.524 3.239 0 CA-C-O 117.369 -1.3 . . . . 0.0 112.891 -174.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.71 -28.4 68.63 Favored 'General case' 1 N--CA 1.54 4.059 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 173.272 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.484 ' CG ' HD22 ' B' ' 551' ' ' LEU . 0.1 OUTLIER -79.6 -39.44 31.65 Favored 'General case' 0 N--CA 1.5 2.046 0 CA-C-O 116.366 -1.778 . . . . 0.0 108.075 173.585 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 86.7 t -68.22 -21.28 26.45 Favored 'Isoleucine or valine' 1 N--CA 1.568 5.456 0 CA-C-N 121.138 1.79 . . . . 0.0 112.569 -177.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -78.19 -53.02 7.81 Favored 'General case' 0 N--CA 1.534 3.741 0 CA-C-N 120.112 1.324 . . . . 0.0 107.51 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.6 mp -70.03 -15.94 63.08 Favored 'General case' 0 N--CA 1.529 3.492 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 175.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -72.34 -37.8 68.77 Favored 'General case' 0 N--CA 1.513 2.694 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 176.305 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.59 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 11.0 tptp -69.16 -15.02 63.31 Favored 'General case' 0 N--CA 1.515 2.804 0 CA-C-O 117.924 -1.036 . . . . 0.0 111.483 176.171 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -74.16 -41.28 61.75 Favored 'General case' 0 N--CA 1.533 3.681 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 175.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.457 ' HB2' ' N ' ' A' ' 35' ' ' HIS . . . -87.62 -7.1 57.91 Favored 'General case' 0 N--CA 1.505 2.301 0 CA-C-O 118.671 -0.681 . . . . 0.0 110.364 177.216 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.59 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -82.99 -33.34 26.62 Favored 'General case' 0 N--CA 1.537 3.92 0 CA-C-N 120.071 1.305 . . . . 0.0 109.073 179.532 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -65.56 -40.12 92.47 Favored 'General case' 0 N--CA 1.532 3.649 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 176.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -90.94 -90.61 0.15 Allowed 'General case' 0 N--CA 1.514 2.736 0 N-CA-C 106.143 -1.799 . . . . 0.0 106.143 176.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 152.93 50.73 0.0 OUTLIER 'General case' 1 N--CA 1.558 4.93 0 C-N-CA 127.629 2.372 . . . . 0.0 108.474 176.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.7 mt -112.16 13.29 20.54 Favored 'General case' 0 N--CA 1.527 3.389 0 C-N-CA 124.312 1.045 . . . . 0.0 109.855 -179.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.457 ' N ' ' HB2' ' A' ' 29' ' ' ALA . 43.6 p-80 -83.07 3.61 29.74 Favored 'General case' 0 N--CA 1.506 2.341 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 175.566 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.427 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 21.2 mt -94.92 -50.95 0.25 Allowed Pre-proline 0 N--CA 1.509 2.503 0 CA-C-O 116.957 -1.497 . . . . 0.0 108.971 -175.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.427 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 3.9 Cg_exo -65.41 -30.87 52.8 Favored 'Trans proline' 0 C--N 1.396 3.036 0 N-CA-C 106.563 -2.13 . . . . 0.0 106.563 170.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.445 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.2 OUTLIER -67.32 -37.83 83.96 Favored 'General case' 0 N--CA 1.52 3.068 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 175.88 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.99 -15.98 61.08 Favored 'General case' 1 N--CA 1.543 4.186 0 CA-C-N 119.549 1.068 . . . . 0.0 110.407 175.956 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -82.58 -17.91 43.18 Favored 'General case' 0 N--CA 1.523 3.218 0 CA-C-N 119.651 1.114 . . . . 0.0 110.151 177.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 pp -99.83 -44.91 5.9 Favored 'General case' 0 N--CA 1.531 3.578 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -177.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 12.8 ptp -109.94 2.04 19.49 Favored 'General case' 1 N--CA 1.551 4.579 0 CA-C-N 118.962 0.801 . . . . 0.0 112.637 -175.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.0 mt -115.89 -65.39 1.19 Allowed 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 117.729 -1.129 . . . . 0.0 110.416 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 35.4 p 119.45 159.66 0.0 OUTLIER Pre-proline 1 N--CA 1.573 5.705 0 C-N-CA 128.32 2.648 . . . . 0.0 109.542 -178.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -67.24 -30.97 36.74 Favored 'Trans proline' 0 C--N 1.39 2.761 0 C-N-CA 122.026 1.817 . . . . 0.0 109.276 175.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -65.63 -26.42 67.81 Favored 'General case' 0 N--CA 1.531 3.604 0 CA-C-O 118.476 -0.773 . . . . 0.0 109.77 176.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -69.64 -33.35 72.5 Favored 'General case' 0 N--CA 1.524 3.275 0 CA-C-O 117.584 -1.198 . . . . 0.0 109.579 178.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 25.3 ptt180 -83.97 -18.12 38.27 Favored 'General case' 0 N--CA 1.53 3.533 0 CA-C-N 119.653 1.115 . . . . 0.0 108.906 174.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -75.23 -21.77 58.38 Favored 'General case' 0 N--CA 1.521 3.116 0 N-CA-C 107.2 -1.408 . . . . 0.0 107.2 173.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -92.91 -35.22 13.45 Favored 'General case' 0 N--CA 1.506 2.368 0 CA-C-O 118.124 -0.941 . . . . 0.0 109.05 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.445 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 25.7 tp -71.99 -21.81 61.52 Favored 'General case' 0 N--CA 1.536 3.873 0 N-CA-C 106.232 -1.766 . . . . 0.0 106.232 172.637 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.421 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -68.91 -75.55 0.52 Allowed Glycine 0 C--N 1.374 2.648 0 C-N-CA 125.585 1.564 . . . . 0.0 110.684 177.068 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.4 m -66.97 -26.08 66.64 Favored 'General case' 0 N--CA 1.534 3.757 0 CA-C-O 117.774 -1.108 . . . . 0.0 113.389 -177.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 29.2 mtm180 -72.53 -47.06 51.37 Favored 'General case' 0 N--CA 1.532 3.637 0 CA-C-N 120.105 1.321 . . . . 0.0 108.329 178.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.6 t -66.77 -18.41 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.978 0 CA-C-N 119.638 1.108 . . . . 0.0 108.839 174.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.3 mtp180 -73.49 -46.81 45.81 Favored 'General case' 0 N--CA 1.528 3.454 0 CA-C-O 117.16 -1.4 . . . . 0.0 111.792 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.24 -23.54 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.733 0 CA-C-N 121.626 2.012 . . . . 0.0 111.304 -179.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -83.46 -47.32 18.16 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.261 0 CA-C-N 120.374 1.443 . . . . 0.0 107.59 -179.529 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -63.88 -29.39 70.58 Favored 'General case' 0 N--CA 1.528 3.446 0 N-CA-C 109.435 -0.579 . . . . 0.0 109.435 177.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -88.28 -17.99 29.52 Favored 'General case' 0 N--CA 1.524 3.237 0 CA-C-O 118.084 -0.96 . . . . 0.0 110.549 177.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.7 mt -79.93 -40.97 26.99 Favored 'General case' 0 N--CA 1.531 3.58 0 CA-C-N 119.439 1.018 . . . . 0.0 108.342 178.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.2 tt -50.05 -36.94 31.06 Favored 'General case' 1 N--CA 1.543 4.184 0 C-N-CA 124.402 1.081 . . . . 0.0 110.537 178.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -80.07 -59.79 2.58 Favored 'General case' 0 N--CA 1.524 3.271 0 N-CA-C 106.824 -1.546 . . . . 0.0 106.824 177.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 57.11 67.59 2.14 Favored Glycine 1 N--CA 1.524 4.506 0 C-N-CA 124.222 0.915 . . . . 0.0 113.264 176.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -130.06 -52.17 1.12 Allowed 'General case' 0 N--CA 1.517 2.921 0 CA-C-N 117.765 0.782 . . . . 0.0 109.027 179.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 73.4 mtp -141.86 15.82 2.12 Favored 'General case' 0 N--CA 1.527 3.387 0 C-N-CA 122.895 0.478 . . . . 0.0 111.761 -179.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 5.1 t -115.67 37.37 3.62 Favored 'General case' 0 N--CA 1.531 3.603 0 CA-C-N 119.517 1.053 . . . . 0.0 111.581 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -114.92 -47.07 2.89 Favored 'General case' 0 N--CA 1.518 2.928 0 C-N-CA 124.381 1.072 . . . . 0.0 109.26 178.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -105.21 -55.6 2.3 Favored 'General case' 0 N--CA 1.526 3.342 0 C-N-CA 123.745 0.818 . . . . 0.0 109.555 -179.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -69.29 -9.2 52.15 Favored 'General case' 0 N--CA 1.52 3.055 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -178.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 22.1 tp -69.0 -46.99 66.59 Favored 'General case' 0 N--CA 1.528 3.43 0 CA-C-N 119.526 1.057 . . . . 0.0 111.229 -179.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -41.42 -41.42 2.02 Favored 'General case' 1 N--CA 1.549 4.519 0 N-CA-C 114.555 1.316 . . . . 0.0 114.555 -178.093 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -68.32 -36.14 78.85 Favored 'General case' 0 N--CA 1.538 3.943 0 C-N-CA 122.859 0.464 . . . . 0.0 111.94 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -47.61 -55.99 8.15 Favored 'General case' 0 N--CA 1.535 3.814 0 C-N-CA 124.838 1.255 . . . . 0.0 113.383 -178.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -128.81 -38.87 1.64 Allowed 'General case' 0 N--CA 1.532 3.663 0 CA-C-O 118.621 -0.705 . . . . 0.0 111.68 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 125.3 78.98 0.34 Allowed Glycine 1 N--CA 1.522 4.38 0 CA-C-N 119.181 0.9 . . . . 0.0 111.539 178.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.56 104.99 4.11 Favored 'General case' 0 N--CA 1.523 3.204 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 177.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -38.69 168.37 0.01 OUTLIER Glycine 1 N--CA 1.536 5.309 0 C-N-CA 125.576 1.56 . . . . 0.0 116.021 -176.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.466 HG23 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.5 OUTLIER -80.68 -20.37 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.981 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 177.754 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.2 -32.49 73.9 Favored 'General case' 0 N--CA 1.522 3.171 0 CA-C-O 117.797 -1.097 . . . . 0.0 110.158 177.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 5.3 p -80.97 -50.17 10.04 Favored 'General case' 0 N--CA 1.536 3.873 0 CA-C-N 119.614 1.097 . . . . 0.0 111.962 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -65.83 -20.73 27.83 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.239 0 CA-C-O 117.831 -1.081 . . . . 0.0 112.888 -178.004 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 46.1 p -107.96 -25.68 11.06 Favored 'General case' 0 N--CA 1.514 2.763 0 CA-C-N 119.794 1.179 . . . . 0.0 111.904 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 14.4 ptt180 -79.28 -21.92 45.4 Favored 'General case' 0 N--CA 1.532 3.633 0 CA-C-N 119.722 1.147 . . . . 0.0 108.3 174.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.14 -32.67 69.13 Favored Glycine 0 N--CA 1.513 3.808 0 N-CA-C 110.259 -1.137 . . . . 0.0 110.259 177.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 51.5 p -67.88 -35.34 78.33 Favored 'General case' 1 N--CA 1.541 4.082 0 CA-C-N 118.579 1.189 . . . . 0.0 111.084 179.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -61.28 -30.53 70.53 Favored 'General case' 1 N--CA 1.541 4.114 0 C-N-CA 123.31 0.644 . . . . 0.0 110.962 179.037 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.3 m -69.0 -38.91 79.56 Favored 'General case' 0 N--CA 1.534 3.746 0 C-N-CA 123.422 0.689 . . . . 0.0 110.46 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 15.5 mt -59.54 -40.43 87.22 Favored 'General case' 0 N--CA 1.528 3.465 0 C-N-CA 124.02 0.928 . . . . 0.0 111.506 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.08 -19.72 54.6 Favored 'General case' 1 N--CA 1.541 4.112 0 CA-C-O 118.309 -0.853 . . . . 0.0 112.682 -179.322 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -96.27 -35.82 11.12 Favored 'General case' 0 N--CA 1.517 2.92 0 CA-C-N 119.179 0.9 . . . . 0.0 111.907 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -48.1 160.77 0.4 Allowed Pre-proline 1 N--CA 1.55 4.568 0 CA-C-O 118.253 -0.88 . . . . 0.0 113.259 -179.126 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -81.77 150.11 16.34 Favored 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 121.996 1.798 . . . . 0.0 109.946 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -84.11 -25.12 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.865 0 CA-C-O 117.817 -1.087 . . . . 0.0 111.24 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -62.83 -39.48 94.48 Favored 'General case' 0 N--CA 1.518 2.967 0 CA-C-N 120.16 1.346 . . . . 0.0 109.881 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.4 mp -98.08 -16.35 19.62 Favored 'General case' 0 N--CA 1.513 2.723 0 C-N-CA 123.836 0.854 . . . . 0.0 111.438 178.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -34.93 79.09 Favored 'General case' 1 N--CA 1.544 4.252 0 N-CA-C 103.458 -2.793 . . . . 0.0 103.458 169.348 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -56.17 -39.9 73.08 Favored 'General case' 0 N--CA 1.508 2.432 0 C-N-CA 124.401 1.08 . . . . 0.0 111.144 175.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.455 ' HA ' ' HB2' ' A' ' 102' ' ' GLU . 63.8 t90 -63.39 -34.67 78.23 Favored 'General case' 0 N--CA 1.53 3.548 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 177.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.16 -40.85 64.64 Favored 'General case' 0 N--CA 1.539 3.992 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 175.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -67.5 -36.79 81.76 Favored 'General case' 1 N--CA 1.54 4.045 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 175.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.455 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 3.0 mt-10 -60.75 -22.8 64.41 Favored 'General case' 1 N--CA 1.542 4.149 0 C-N-CA 123.635 0.774 . . . . 0.0 110.737 176.645 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -121.81 6.67 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.366 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -177.104 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.36 -55.4 2.52 Favored 'General case' 0 N--CA 1.513 2.715 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 176.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.9 tp -61.52 -41.53 97.46 Favored 'General case' 0 N--CA 1.529 3.489 0 C-N-CA 124.861 1.264 . . . . 0.0 111.68 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt 77.18 100.58 0.07 Allowed 'General case' 0 N--CA 1.533 3.685 0 C-N-CA 124.779 1.232 . . . . 0.0 108.401 -178.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 6.5 t . . . . . 0 N--CA 1.524 3.257 0 CA-C-O 118.476 -0.773 . . . . 0.0 110.227 -179.205 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 . . . . . 0 N--CA 1.5 2.034 0 N-CA-C 109.541 -0.541 . . . . 0.0 109.541 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 72.4 m -136.6 124.19 14.53 Favored Pre-proline 0 N--CA 1.518 2.935 0 CA-C-O 117.508 -1.234 . . . . 0.0 109.665 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -81.55 4.69 6.81 Favored 'Trans proline' 0 CA--C 1.586 3.092 0 C-N-CA 122.352 2.035 . . . . 0.0 112.31 179.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -93.3 -52.95 4.3 Favored 'General case' 0 N--CA 1.53 3.573 0 CA-C-N 119.717 1.144 . . . . 0.0 110.251 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 7.8 t -118.64 132.17 56.18 Favored 'General case' 0 N--CA 1.524 3.269 0 C-N-CA 123.064 0.546 . . . . 0.0 110.544 -179.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -155.24 142.95 19.8 Favored 'General case' 0 N--CA 1.527 3.398 0 C-N-CA 123.184 0.594 . . . . 0.0 110.876 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -154.62 149.79 27.0 Favored 'General case' 0 N--CA 1.525 3.314 0 N-CA-C 112.443 0.535 . . . . 0.0 112.443 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 3.9 mtt -94.5 126.07 39.55 Favored 'General case' 0 N--CA 1.524 3.229 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 178.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -151.1 -49.28 0.12 Allowed 'General case' 0 N--CA 1.52 3.052 0 CA-C-O 119.101 -0.476 . . . . 0.0 111.864 -178.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -93.1 -56.43 2.97 Favored 'General case' 0 N--CA 1.525 3.315 0 CA-C-N 118.112 0.415 . . . . 0.0 110.608 -178.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 65.5 mt-30 -102.55 128.75 49.07 Favored 'General case' 0 N--CA 1.528 3.456 0 C-N-CA 122.7 0.4 . . . . 0.0 110.091 -178.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 38.9 ttt180 -159.24 -53.72 0.06 Allowed 'General case' 0 N--CA 1.524 3.271 0 CA-C-O 119.247 -0.406 . . . . 0.0 110.95 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -78.59 168.97 18.98 Favored 'General case' 0 N--CA 1.535 3.783 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -178.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -79.24 145.43 33.58 Favored 'General case' 0 N--CA 1.53 3.564 0 C-N-CA 122.89 0.476 . . . . 0.0 110.914 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -100.38 -69.03 0.78 Allowed 'General case' 0 N--CA 1.524 3.242 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 519' ' ' TRP . . . . . 0.416 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 72.1 t-105 -42.69 -29.27 0.29 Allowed 'General case' 1 N--CA 1.546 4.354 0 C-N-CA 124.373 1.069 . . . . 0.0 113.509 179.676 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 520' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -94.34 -29.15 15.17 Favored 'General case' 0 N--CA 1.529 3.476 0 CA-C-O 117.769 -1.11 . . . . 0.0 113.863 -172.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 37.0 mtm180 -64.26 -23.77 67.42 Favored 'General case' 0 N--CA 1.533 3.686 0 N-CA-C 106.266 -1.753 . . . . 0.0 106.266 171.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . 0.445 ' CD2' ' HG ' ' A' ' 51' ' ' LEU . 1.9 m-85 -77.61 -38.74 47.46 Favored 'General case' 0 N--CA 1.514 2.739 0 N-CA-C 106.7 -1.593 . . . . 0.0 106.7 173.323 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.75 -24.31 34.08 Favored 'Isoleucine or valine' 1 N--CA 1.551 4.622 0 CA-C-O 116.924 -1.512 . . . . 0.0 112.627 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -77.48 -42.14 36.88 Favored 'General case' 1 N--CA 1.542 4.136 0 CA-C-N 121.463 1.938 . . . . 0.0 108.443 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.79 -28.99 67.26 Favored 'General case' 1 N--CA 1.539 4.003 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 175.473 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -72.25 -32.78 66.99 Favored 'General case' 0 N--CA 1.524 3.243 0 CA-C-O 118.511 -0.757 . . . . 0.0 109.459 177.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 31.1 ttmt -71.6 -28.88 64.11 Favored 'General case' 0 N--CA 1.517 2.901 0 CA-C-O 118.388 -0.815 . . . . 0.0 110.641 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -71.71 -35.94 70.37 Favored 'General case' 0 N--CA 1.533 3.702 0 CA-C-N 119.052 0.842 . . . . 0.0 108.98 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 529' ' ' ALA . . . . . . . . . . . . . . . -89.44 -9.38 50.4 Favored 'General case' 0 CA--C 1.578 2.028 0 CA-C-O 118.358 -0.829 . . . . 0.0 110.209 178.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -82.07 -34.41 29.42 Favored 'General case' 0 N--CA 1.533 3.678 0 CA-C-N 120.411 1.459 . . . . 0.0 108.574 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -61.69 -41.0 96.99 Favored 'General case' 0 N--CA 1.538 3.926 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 177.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 66.2 m-80 -95.42 -88.9 0.25 Allowed 'General case' 0 N--CA 1.514 2.736 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 176.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.8 p30 153.54 49.74 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.062 0 C-N-CA 127.764 2.426 . . . . 0.0 108.228 177.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 10.0 mt -101.73 2.05 38.09 Favored 'General case' 0 N--CA 1.529 3.523 0 C-N-CA 124.561 1.144 . . . . 0.0 111.197 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 535' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -80.64 0.48 34.06 Favored 'General case' 0 N--CA 1.511 2.617 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 174.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 536' ' ' LEU . . . . . . . . . . . . . 46.7 mt -93.38 -49.62 0.28 Allowed Pre-proline 0 N--CA 1.509 2.48 0 CA-C-O 116.673 -1.632 . . . . 0.0 109.492 -176.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 537' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -63.16 -36.42 58.13 Favored 'Trans proline' 0 C--N 1.397 3.11 0 N-CA-C 106.539 -2.139 . . . . 0.0 106.539 171.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.28 -49.8 74.93 Favored 'General case' 0 N--CA 1.531 3.594 0 C-N-CA 124.21 1.004 . . . . 0.0 109.19 174.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 13.2 mt -66.17 -21.54 66.33 Favored 'General case' 1 N--CA 1.54 4.04 0 CA-C-O 118.086 -0.959 . . . . 0.0 112.599 -178.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 21.9 t30 -70.77 -12.31 61.47 Favored 'General case' 0 N--CA 1.534 3.752 0 CA-C-N 119.297 0.953 . . . . 0.0 111.514 178.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -117.29 -37.4 3.53 Favored 'General case' 0 N--CA 1.52 3.059 0 CA-C-N 119.212 0.914 . . . . 0.0 110.344 -178.662 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 6.7 ptt? -96.95 9.77 41.02 Favored 'General case' 1 N--CA 1.544 4.234 0 CA-C-N 119.618 1.099 . . . . 0.0 112.796 -179.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 1.5 tp -132.05 -93.42 0.37 Allowed 'General case' 0 N--CA 1.53 3.547 0 CA-C-N 119.898 1.226 . . . . 0.0 111.995 178.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 1.2 p 147.3 135.7 0.0 OUTLIER Pre-proline 1 N--CA 1.566 5.352 0 C-N-CA 127.101 2.161 . . . . 0.0 107.511 -178.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -60.15 -33.98 94.61 Favored 'Trans proline' 0 N--CA 1.519 3.01 0 C-N-CA 122.734 2.289 . . . . 0.0 112.137 178.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -64.47 -34.73 78.89 Favored 'General case' 0 N--CA 1.536 3.864 0 CA-C-O 118.856 -0.592 . . . . 0.0 111.651 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -75.5 -29.78 59.62 Favored 'General case' 0 N--CA 1.524 3.259 0 CA-C-O 117.46 -1.257 . . . . 0.0 111.133 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 548' ' ' ARG . . . . . 0.42 ' HB2' ' HB2' ' A' ' 19' ' ' TRP . 32.9 ptt180 -76.3 -24.44 54.37 Favored 'General case' 0 N--CA 1.532 3.627 0 CA-C-N 120.238 1.381 . . . . 0.0 109.152 175.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -64.29 -43.25 95.35 Favored 'General case' 0 N--CA 1.536 3.855 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 173.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -73.02 -21.66 60.78 Favored 'General case' 0 N--CA 1.517 2.904 0 CA-C-O 117.104 -1.427 . . . . 0.0 110.649 176.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 551' ' ' LEU . . . . . 0.484 HD22 ' CG ' ' A' ' 22' ' ' PHE . 10.9 tp -75.29 -23.39 57.38 Favored 'General case' 0 N--CA 1.521 3.095 0 CA-C-N 120.287 1.403 . . . . 0.0 107.909 174.711 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -73.71 -59.57 4.02 Favored Glycine 0 N--CA 1.499 2.889 0 N-CA-C 108.67 -1.772 . . . . 0.0 108.67 178.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 1.7 t -65.17 -26.13 68.03 Favored 'General case' 0 N--CA 1.535 3.813 0 CA-C-N 117.95 0.875 . . . . 0.0 111.363 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 45.7 mtt180 -62.2 -52.99 61.56 Favored 'General case' 1 N--CA 1.543 4.195 0 N-CA-C 107.063 -1.458 . . . . 0.0 107.063 176.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 18.0 t -71.96 -14.91 17.78 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.547 0 CA-C-O 118.15 -0.929 . . . . 0.0 110.553 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 76.1 mtt-85 -77.56 -46.76 21.29 Favored 'General case' 0 N--CA 1.527 3.382 0 CA-C-N 119.88 1.218 . . . . 0.0 110.725 178.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 557' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.15 -23.98 22.1 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.669 0 CA-C-N 119.622 1.101 . . . . 0.0 110.524 -177.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 558' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -87.1 -53.21 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.871 0 CA-C-N 119.943 1.247 . . . . 0.0 107.698 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -58.56 -24.64 61.21 Favored 'General case' 0 N--CA 1.533 3.675 0 CA-C-O 118.516 -0.754 . . . . 0.0 110.969 178.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -91.25 -27.34 18.51 Favored 'General case' 0 N--CA 1.525 3.282 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.385 178.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 1.9 mp -69.57 -43.93 71.87 Favored 'General case' 1 N--CA 1.541 4.108 0 CA-C-N 119.409 1.004 . . . . 0.0 109.156 178.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 42.7 mt -58.29 -21.62 49.6 Favored 'General case' 0 N--CA 1.537 3.897 0 C-N-CA 123.762 0.825 . . . . 0.0 112.226 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 12.3 mmm180 -80.23 -47.94 13.85 Favored 'General case' 0 N--CA 1.53 3.567 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 67.08 38.57 92.53 Favored Glycine 1 N--CA 1.525 4.613 0 CA-C-O 118.783 -1.009 . . . . 0.0 113.647 177.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -97.76 -57.36 2.25 Favored 'General case' 0 N--CA 1.517 2.908 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 178.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 16.3 ptt? -170.52 79.52 0.09 Allowed 'General case' 0 N--CA 1.536 3.839 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 178.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 75.7 m -137.4 3.67 2.59 Favored 'General case' 0 N--CA 1.516 2.826 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -176.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -88.88 -76.51 0.4 Allowed 'General case' 0 N--CA 1.524 3.247 0 CA-C-N 119.981 1.264 . . . . 0.0 111.583 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.97 -33.85 17.08 Favored 'General case' 0 N--CA 1.532 3.675 0 CA-C-N 118.995 0.816 . . . . 0.0 112.879 -177.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -83.49 -3.5 57.67 Favored 'General case' 0 N--CA 1.522 3.138 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -178.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 24.2 tp -82.5 -45.47 14.66 Favored 'General case' 0 N--CA 1.53 3.532 0 CA-C-N 119.744 1.156 . . . . 0.0 111.507 -178.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -41.43 -32.4 0.32 Allowed 'General case' 1 N--CA 1.55 4.536 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -177.796 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -73.51 -40.34 64.14 Favored 'General case' 0 N--CA 1.532 3.647 0 CA-C-N 118.454 0.57 . . . . 0.0 111.393 -177.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -51.69 -61.56 2.18 Favored 'General case' 0 N--CA 1.53 3.53 0 C-N-CA 123.989 0.916 . . . . 0.0 113.191 -178.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -114.77 -50.98 2.76 Favored 'General case' 0 N--CA 1.536 3.827 0 CA-C-N 118.718 0.69 . . . . 0.0 110.934 -179.098 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 130.91 80.3 0.21 Allowed Glycine 1 N--CA 1.518 4.154 0 N-CA-C 109.988 -1.245 . . . . 0.0 109.988 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -136.6 99.77 4.16 Favored 'General case' 0 N--CA 1.52 3.041 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 178.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -41.32 168.24 0.01 OUTLIER Glycine 1 N--CA 1.541 5.653 0 C-N-CA 124.952 1.263 . . . . 0.0 115.319 -176.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 579' ' ' ILE . . . . . 0.478 HG21 ' H41' ' E' ' 5' ' ' ' DC' . 0.6 OUTLIER -80.51 -22.37 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.108 0 CA-C-N 118.273 1.036 . . . . 0.0 108.453 178.625 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -67.08 -39.86 86.87 Favored 'General case' 0 N--CA 1.53 3.561 0 CA-C-N 119.619 1.099 . . . . 0.0 110.139 177.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.33 -39.14 33.51 Favored 'General case' 1 N--CA 1.544 4.248 0 CA-C-N 118.759 0.709 . . . . 0.0 112.027 -179.832 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 2.0 tt -65.53 -36.99 78.95 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.502 0 C-N-CA 123.502 0.721 . . . . 0.0 111.597 -176.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 69.9 p -96.92 -31.75 12.4 Favored 'General case' 0 N--CA 1.512 2.672 0 CA-C-O 118.175 -0.917 . . . . 0.0 111.132 -178.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 20.9 ptt180 -70.17 -21.39 63.06 Favored 'General case' 0 N--CA 1.535 3.789 0 CA-C-N 119.613 1.097 . . . . 0.0 109.424 175.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -68.1 -35.36 83.41 Favored Glycine 1 N--CA 1.519 4.21 0 N-CA-C 108.046 -2.022 . . . . 0.0 108.046 174.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 5.5 t -61.77 -41.27 97.48 Favored 'General case' 1 N--CA 1.54 4.028 0 CA-C-N 117.701 0.75 . . . . 0.0 110.226 177.094 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -59.65 -23.2 62.84 Favored 'General case' 1 N--CA 1.541 4.099 0 C-N-CA 123.528 0.731 . . . . 0.0 112.157 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 75.3 m -62.12 -46.68 87.96 Favored 'General case' 0 N--CA 1.535 3.797 0 C-N-CA 123.535 0.734 . . . . 0.0 110.828 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 52.3 mt -59.96 -49.41 77.77 Favored 'General case' 0 N--CA 1.524 3.256 0 C-N-CA 124.206 1.002 . . . . 0.0 111.505 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -54.63 -26.31 32.18 Favored 'General case' 1 N--CA 1.547 4.397 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -178.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -86.76 -43.44 12.54 Favored 'General case' 0 N--CA 1.515 2.823 0 CA-C-N 118.395 0.543 . . . . 0.0 110.328 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -57.72 161.8 5.86 Favored Pre-proline 1 N--CA 1.54 4.066 0 CA-C-O 118.247 -0.882 . . . . 0.0 112.545 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -80.08 162.38 23.23 Favored 'Trans proline' 0 C--N 1.378 2.13 0 C-N-CA 121.918 1.745 . . . . 0.0 110.779 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -83.72 -25.87 7.6 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.894 0 CA-C-O 117.471 -1.252 . . . . 0.0 112.077 -178.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -63.6 -41.2 98.35 Favored 'General case' 0 N--CA 1.519 2.993 0 CA-C-N 120.428 1.467 . . . . 0.0 110.398 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 6.8 mp -98.83 -14.82 19.49 Favored 'General case' 0 N--CA 1.514 2.745 0 C-N-CA 123.557 0.743 . . . . 0.0 111.636 178.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -32.42 74.06 Favored 'General case' 1 N--CA 1.542 4.171 0 N-CA-C 102.807 -3.034 . . . . 0.0 102.807 166.8 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -57.12 -36.34 70.54 Favored 'General case' 0 N--CA 1.517 2.875 0 C-N-CA 124.885 1.274 . . . . 0.0 110.796 175.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 599' ' ' TRP . . . . . 0.427 ' HA ' ' HB2' ' B' ' 602' ' ' GLU . 44.2 t90 -61.13 -36.12 78.9 Favored 'General case' 0 N--CA 1.536 3.872 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 177.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 10.3 mp -56.58 -38.94 72.67 Favored 'General case' 1 N--CA 1.544 4.255 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 176.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -68.39 -29.88 68.68 Favored 'General case' 0 N--CA 1.537 3.885 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 175.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 602' ' ' GLU . . . . . 0.427 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.6 OUTLIER -69.14 -26.63 64.98 Favored 'General case' 1 N--CA 1.542 4.142 0 C-N-CA 124.411 1.084 . . . . 0.0 110.595 176.622 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.87 -14.33 8.56 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.639 0 CA-C-O 117.85 -1.071 . . . . 0.0 112.262 -175.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 7.0 mp -92.13 -57.53 2.68 Favored 'General case' 0 N--CA 1.522 3.156 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 173.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 6.1 mp -93.31 -99.85 0.14 Allowed 'General case' 0 N--CA 1.521 3.105 0 CA-C-O 117.693 -1.146 . . . . 0.0 108.159 177.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt 178.17 -50.39 0.01 OUTLIER 'General case' 1 N--CA 1.544 4.229 0 CA-C-N 120.487 1.494 . . . . 0.0 109.588 178.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 68.4 m . . . . . 0 N--CA 1.527 3.393 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.065 -179.472 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.135 0 CA-C-O 117.879 -1.058 . . . . 0.0 109.356 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.509 2.478 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.424 -9.396 4 C4'-C3'-C2' 116.749 13.549 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.42 -9.834 3 O4'-C1'-N19 120.098 15.372 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.425 -9.284 4 O4'-C1'-N19 119.103 14.128 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . 0.466 ' N6 ' HG22 ' B' ' 579' ' ' ILE . . . . . . . . 5 C3'--C2' 1.421 -9.718 4 O4'-C1'-N19 120.381 15.726 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' E' E ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.687 5 O4'-C1'-N19 118.823 13.779 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.401 -11.733 5 O4'-C1'-N19 119.234 14.293 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' E' E ' 7' ' ' ' DA' . . . . . 0.436 H2'' " H5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.396 -12.219 3 C4'-C3'-C2' 112.975 9.775 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' E' E ' 8' ' ' ' DG' . . . . . 0.436 " H5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 O3'--C3' 1.563 10.149 3 O4'-C1'-N19 119.407 14.508 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.407 -11.137 4 O4'-C1'-N19 118.228 13.035 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.471 3 C4'-C3'-C2' 116.811 13.611 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.412 -10.616 4 O4'-C1'-N19 118.86 13.825 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.407 -11.149 5 O4'-C1'-N19 119.47 14.587 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' E' E ' 13' ' ' ' DC' . . . . . 0.497 H2'' " O5'" ' E' ' 14' ' ' ' DT' . . . . . . . . 6 O3'--C3' 1.55 9.173 3 O4'-C1'-N19 119.869 15.087 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' E' E ' 14' ' ' ' DT' . . . . . 0.497 " O5'" H2'' ' E' ' 13' ' ' ' DC' . . . . . . . . 6 C3'--C2' 1.405 -11.256 6 O4'-C1'-N19 119.866 15.082 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' E' E ' 15' ' ' ' DA' . . . . . 0.403 ' H62' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.413 -10.495 4 O4'-C1'-N19 120.223 15.529 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.416 -10.168 4 O4'-C1'-N19 120.087 15.359 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.566 10.369 4 O4'-C1'-N19 120.291 15.614 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.567 5 O4'-C1'-N19 120.299 15.624 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.496 5 O4'-C1'-N19 120.593 15.992 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.51 6.903 4 O4'-C1'-N19 119.186 14.232 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.565 10.308 2 O4'-C1'-N19 119.716 14.895 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.573 10.958 5 O4'-C1'-N19 119.363 14.453 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.275 5 O4'-C1'-N19 120.39 15.737 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' F' F ' 4' ' ' ' DA' . . . . . 0.405 ' N6 ' HG23 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.416 -10.216 5 O4'-C1'-N19 119.779 14.974 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' F' F ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.573 10.923 4 O4'-C1'-N19 118.451 13.313 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.407 -11.062 4 O4'-C1'-N19 119.253 14.316 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.412 -11.613 4 N19-C1'-C2' 129.516 9.572 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.392 4 O4'-C1'-N19 119.46 14.575 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -10.956 4 O4'-C1'-N19 120.477 15.847 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.406 -11.249 4 O4'-C1'-N19 119.042 14.053 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.176 4 O4'-C1'-N19 119.873 15.092 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.42 -9.835 2 O4'-C1'-N19 119.506 14.633 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.204 4 O4'-C1'-N19 119.283 14.353 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' F' F ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.566 10.413 3 O4'-C1'-N19 119.201 14.251 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' F' F ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.265 6 O4'-C1'-N19 119.294 14.368 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.415 -10.273 6 O4'-C1'-N19 120.203 15.504 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.949 4 O4'-C1'-N19 118.983 13.979 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.563 4 O4'-C1'-N19 119.92 15.15 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.746 4 O4'-C1'-N19 119.97 15.213 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 O4'--C1' 1.514 7.199 4 O4'-C1'-N19 119.046 14.058 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 . . . . . 0 N--CA 1.5 2.074 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 58.0 m -105.49 112.36 64.76 Favored Pre-proline 0 N--CA 1.515 2.786 0 CA-C-O 117.862 -1.066 . . . . 0.0 108.813 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -66.73 -35.45 28.09 Favored 'Trans proline' 0 C--N 1.391 2.807 0 C-N-CA 122.17 1.913 . . . . 0.0 111.373 178.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -104.81 133.41 49.67 Favored 'General case' 0 N--CA 1.526 3.364 0 C-N-CA 123.575 0.75 . . . . 0.0 109.994 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 37.4 p -134.79 -52.76 0.8 Allowed 'General case' 0 N--CA 1.527 3.404 0 C-N-CA 123.363 0.665 . . . . 0.0 109.3 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -132.28 155.93 47.45 Favored 'General case' 0 N--CA 1.524 3.271 0 C-N-CA 123.308 0.643 . . . . 0.0 111.074 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.25 134.75 42.66 Favored 'General case' 0 N--CA 1.532 3.653 0 C-N-CA 122.732 0.413 . . . . 0.0 110.764 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 25.9 ttm -115.18 133.92 55.61 Favored 'General case' 0 N--CA 1.525 3.319 0 C-N-CA 123.074 0.55 . . . . 0.0 110.592 -179.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 59.94 158.39 0.03 OUTLIER 'General case' 1 N--CA 1.539 4.016 0 C-N-CA 124.553 1.141 . . . . 0.0 113.356 178.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -115.01 138.56 50.72 Favored 'General case' 0 N--CA 1.524 3.247 0 C-N-CA 123.476 0.71 . . . . 0.0 109.858 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -91.81 115.45 28.07 Favored 'General case' 0 N--CA 1.52 3.04 0 N-CA-C 107.52 -1.289 . . . . 0.0 107.52 178.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 78.1 mtm180 -106.75 125.52 51.11 Favored 'General case' 0 N--CA 1.521 3.106 0 C-N-CA 122.8 0.44 . . . . 0.0 109.86 -178.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 23.1 m-70 -115.35 98.2 6.61 Favored 'General case' 0 N--CA 1.52 3.029 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 179.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -112.62 -38.91 4.47 Favored 'General case' 0 N--CA 1.522 3.171 0 CA-C-O 118.699 -0.667 . . . . 0.0 112.174 -176.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -124.37 -88.21 0.61 Allowed 'General case' 0 N--CA 1.527 3.408 0 CA-C-N 118.496 0.589 . . . . 0.0 112.289 -176.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.433 ' CE3' HD21 ' B' ' 551' ' ' LEU . 73.0 t-105 -51.18 -43.97 61.43 Favored 'General case' 1 N--CA 1.54 4.074 0 CA-C-N 119.193 0.906 . . . . 0.0 111.215 -178.548 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -83.77 -23.29 31.58 Favored 'General case' 0 N--CA 1.517 2.893 0 CA-C-O 117.542 -1.218 . . . . 0.0 111.695 -176.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -58.4 -28.74 65.49 Favored 'General case' 0 N--CA 1.536 3.868 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 173.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.512 ' CG ' HD22 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -85.5 -36.14 20.73 Favored 'General case' 0 N--CA 1.504 2.232 0 CA-C-O 115.766 -2.064 . . . . 0.0 109.347 174.068 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 48.6 t -71.24 -27.47 29.42 Favored 'Isoleucine or valine' 1 N--CA 1.576 5.833 0 CA-C-N 121.762 2.074 . . . . 0.0 112.754 -175.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -77.39 -50.1 13.48 Favored 'General case' 0 N--CA 1.533 3.718 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 179.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.65 -25.45 68.13 Favored 'General case' 0 N--CA 1.539 3.996 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 174.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.407 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -70.06 -38.66 75.84 Favored 'General case' 0 N--CA 1.517 2.885 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 178.093 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.1 tttt -64.36 -22.57 67.0 Favored 'General case' 0 N--CA 1.527 3.388 0 CA-C-O 118.452 -0.785 . . . . 0.0 111.049 177.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -72.27 -39.66 68.19 Favored 'General case' 0 N--CA 1.53 3.564 0 CA-C-N 119.003 0.82 . . . . 0.0 108.868 176.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.429 ' HB2' ' N ' ' A' ' 35' ' ' HIS . . . -91.05 -6.33 54.02 Favored 'General case' 0 N--CA 1.506 2.332 0 CA-C-O 118.573 -0.727 . . . . 0.0 110.793 177.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.04 -33.86 26.38 Favored 'General case' 0 N--CA 1.533 3.69 0 CA-C-N 120.41 1.459 . . . . 0.0 109.005 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -65.11 -42.66 93.77 Favored 'General case' 0 N--CA 1.531 3.604 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 176.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 63.3 m-80 -86.87 -89.35 0.12 Allowed 'General case' 0 N--CA 1.516 2.864 0 N-CA-C 106.563 -1.643 . . . . 0.0 106.563 176.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 150.54 52.47 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.909 0 C-N-CA 128.013 2.525 . . . . 0.0 107.959 177.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.9 mt -114.62 11.88 17.07 Favored 'General case' 0 N--CA 1.527 3.384 0 C-N-CA 124.698 1.199 . . . . 0.0 110.245 -178.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.429 ' N ' ' HB2' ' A' ' 29' ' ' ALA . 46.8 p-80 -80.61 0.85 32.28 Favored 'General case' 0 N--CA 1.51 2.556 0 C-N-CA 123.505 0.722 . . . . 0.0 109.225 175.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.408 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 22.4 mt -93.06 -50.82 0.27 Allowed Pre-proline 0 N--CA 1.511 2.592 0 CA-C-O 116.971 -1.49 . . . . 0.0 109.207 -175.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.408 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 7.6 Cg_exo -61.34 -35.16 85.46 Favored 'Trans proline' 0 C--N 1.396 3.068 0 N-CA-C 106.425 -2.183 . . . . 0.0 106.425 170.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -64.76 -39.21 93.24 Favored 'General case' 0 N--CA 1.512 2.645 0 C-N-CA 124.057 0.943 . . . . 0.0 109.974 176.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.08 -22.53 61.35 Favored 'General case' 1 N--CA 1.546 4.372 0 CA-C-N 119.533 1.06 . . . . 0.0 111.791 -179.862 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -96.31 21.82 8.56 Favored 'General case' 1 N--CA 1.539 4.003 0 CA-C-N 119.926 1.239 . . . . 0.0 110.049 176.454 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -127.08 -45.63 1.55 Allowed 'General case' 0 N--CA 1.519 2.993 0 CA-C-O 118.056 -0.973 . . . . 0.0 109.361 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 9.9 ptt? -116.86 11.01 14.32 Favored 'General case' 1 N--CA 1.551 4.618 0 CA-C-N 119.711 1.142 . . . . 0.0 112.32 179.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.7 mp -122.86 -94.05 0.5 Allowed 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 177.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 157.31 169.28 0.02 OUTLIER Pre-proline 1 N--CA 1.566 5.358 0 C-N-CA 125.476 1.511 . . . . 0.0 110.041 178.894 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -69.0 -37.73 10.56 Favored 'Trans proline' 0 C--N 1.39 2.735 0 C-N-CA 122.066 1.844 . . . . 0.0 107.586 172.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -66.19 -18.57 65.43 Favored 'General case' 0 N--CA 1.527 3.395 0 CA-C-O 117.942 -1.027 . . . . 0.0 110.895 176.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -71.09 -37.57 72.41 Favored 'General case' 0 N--CA 1.529 3.478 0 CA-C-N 119.613 1.097 . . . . 0.0 108.613 178.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -84.91 -15.89 42.96 Favored 'General case' 0 N--CA 1.531 3.582 0 CA-C-O 118.117 -0.944 . . . . 0.0 109.826 175.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -73.07 -29.43 62.95 Favored 'General case' 0 N--CA 1.525 3.291 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 173.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -88.01 -36.28 17.1 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-O 117.918 -1.039 . . . . 0.0 109.725 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.439 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 23.1 tp -69.75 -22.8 63.33 Favored 'General case' 0 N--CA 1.537 3.879 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 173.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.47 -73.36 0.67 Allowed Glycine 0 N--CA 1.496 2.7 0 C-N-CA 125.294 1.426 . . . . 0.0 111.277 177.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.9 m -72.06 -24.56 61.54 Favored 'General case' 0 N--CA 1.536 3.86 0 CA-C-O 118.144 -0.932 . . . . 0.0 112.785 -177.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 76.9 mtm-85 -68.15 -50.27 55.63 Favored 'General case' 0 N--CA 1.531 3.593 0 CA-C-N 120.074 1.306 . . . . 0.0 107.628 177.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 11.5 t -65.98 -17.9 23.06 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.823 0 CA-C-O 118.217 -0.897 . . . . 0.0 109.88 177.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.7 mtt-85 -69.08 -56.92 6.24 Favored 'General case' 0 N--CA 1.529 3.515 0 CA-C-N 119.741 1.155 . . . . 0.0 111.444 177.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.9 -25.63 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.757 0 CA-C-N 119.825 1.193 . . . . 0.0 112.087 -177.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -83.71 -53.54 11.02 Favored 'Isoleucine or valine' 1 N--CA 1.549 4.517 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 -179.653 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -61.6 -18.73 60.58 Favored 'General case' 0 N--CA 1.527 3.392 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.063 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -96.56 -23.26 16.61 Favored 'General case' 0 N--CA 1.526 3.344 0 CA-C-O 118.174 -0.917 . . . . 0.0 110.305 176.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.6 mt -75.76 -51.74 11.99 Favored 'General case' 0 N--CA 1.534 3.758 0 CA-C-N 119.535 1.062 . . . . 0.0 108.979 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 36.1 mt -54.32 -26.4 29.4 Favored 'General case' 0 N--CA 1.538 3.953 0 C-N-CA 124.163 0.985 . . . . 0.0 113.293 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 30.1 mmm180 -77.86 -45.68 23.58 Favored 'General case' 0 N--CA 1.531 3.584 0 CA-C-N 118.755 0.707 . . . . 0.0 111.278 -178.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.15 56.51 2.41 Favored Glycine 0 N--CA 1.515 3.96 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -98.71 -40.27 8.24 Favored 'General case' 0 N--CA 1.526 3.364 0 CA-C-O 118.713 -0.66 . . . . 0.0 110.074 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 76.8 mtp 121.18 69.0 0.0 OUTLIER 'General case' 1 N--CA 1.544 4.264 0 C-N-CA 128.075 2.55 . . . . 0.0 104.997 -178.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 23.4 m -117.8 38.48 3.62 Favored 'General case' 0 N--CA 1.52 3.03 0 CA-C-N 115.109 -0.951 . . . . 0.0 110.771 -177.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -113.16 -46.38 3.09 Favored 'General case' 0 N--CA 1.521 3.107 0 C-N-CA 123.751 0.82 . . . . 0.0 110.194 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -104.49 -56.59 2.16 Favored 'General case' 0 N--CA 1.528 3.429 0 C-N-CA 123.547 0.739 . . . . 0.0 110.968 -178.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -75.28 -0.18 18.73 Favored 'General case' 0 N--CA 1.519 2.983 0 N-CA-C 114.063 1.135 . . . . 0.0 114.063 -176.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 24.6 tp -85.35 -47.06 10.38 Favored 'General case' 0 N--CA 1.527 3.392 0 CA-C-N 119.906 1.23 . . . . 0.0 112.458 -178.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -42.65 -30.58 0.38 Allowed 'General case' 1 N--CA 1.552 4.635 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 -176.739 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -71.86 -41.13 68.44 Favored 'General case' 0 N--CA 1.535 3.793 0 CA-C-N 118.829 0.74 . . . . 0.0 111.234 -178.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -47.57 -53.35 14.83 Favored 'General case' 0 N--CA 1.533 3.702 0 C-N-CA 125.078 1.351 . . . . 0.0 113.438 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.1 pp -125.06 -39.67 2.22 Favored 'General case' 0 N--CA 1.536 3.85 0 CA-C-O 118.717 -0.659 . . . . 0.0 111.938 -178.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 112.72 64.78 0.47 Allowed Glycine 1 N--CA 1.523 4.487 0 CA-C-N 118.976 0.807 . . . . 0.0 111.621 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -127.48 108.95 11.26 Favored 'General case' 0 N--CA 1.523 3.211 0 N-CA-C 106.047 -1.835 . . . . 0.0 106.047 176.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -34.65 165.37 0.01 OUTLIER Glycine 1 N--CA 1.536 5.356 0 C-N-CA 125.863 1.696 . . . . 0.0 116.658 -176.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.405 HG23 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.3 OUTLIER -78.64 -23.67 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.903 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 177.89 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.403 ' HB3' ' H62' ' E' ' 15' ' ' ' DA' . . . -61.85 -34.37 75.85 Favored 'General case' 0 N--CA 1.521 3.076 0 CA-C-O 117.689 -1.148 . . . . 0.0 109.835 177.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 17.8 p -74.89 -56.62 4.57 Favored 'General case' 0 N--CA 1.53 3.568 0 CA-C-N 119.342 0.974 . . . . 0.0 111.965 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -62.06 -24.54 34.88 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.173 0 CA-C-O 118.174 -0.917 . . . . 0.0 113.469 -176.829 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 71.9 p -101.07 -26.27 13.76 Favored 'General case' 0 N--CA 1.51 2.567 0 CA-C-O 117.955 -1.021 . . . . 0.0 110.913 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 26.2 ptt180 -75.77 -22.83 56.07 Favored 'General case' 0 N--CA 1.535 3.806 0 CA-C-N 119.82 1.191 . . . . 0.0 108.545 174.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -68.15 -32.22 76.09 Favored Glycine 0 N--CA 1.516 3.979 0 N-CA-C 109.043 -1.623 . . . . 0.0 109.043 175.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 6.6 t -63.68 -31.5 72.69 Favored 'General case' 0 N--CA 1.536 3.869 0 CA-C-N 118.18 0.99 . . . . 0.0 110.117 177.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -59.65 -33.41 71.5 Favored 'General case' 1 N--CA 1.545 4.291 0 C-N-CA 123.604 0.762 . . . . 0.0 110.311 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.15 -31.98 73.44 Favored 'General case' 0 N--CA 1.538 3.932 0 C-N-CA 123.791 0.837 . . . . 0.0 111.3 179.564 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 38.8 mt -57.26 -44.21 83.7 Favored 'General case' 0 N--CA 1.531 3.619 0 C-N-CA 123.759 0.824 . . . . 0.0 111.232 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -65.99 -20.29 66.14 Favored 'General case' 0 N--CA 1.537 3.921 0 CA-C-O 118.193 -0.908 . . . . 0.0 112.901 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.57 -32.06 18.32 Favored 'General case' 0 N--CA 1.523 3.183 0 CA-C-N 119.323 0.965 . . . . 0.0 113.133 -178.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.87 153.23 88.84 Favored Pre-proline 1 N--CA 1.54 4.07 0 CA-C-O 118.087 -0.959 . . . . 0.0 113.527 -178.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -87.41 171.59 6.29 Favored 'Trans proline' 0 C--N 1.387 2.576 0 C-N-CA 122.695 2.263 . . . . 0.0 111.084 177.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.4 t -87.76 -27.22 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.306 0 CA-C-O 117.803 -1.094 . . . . 0.0 111.216 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -62.14 -41.4 98.23 Favored 'General case' 0 N--CA 1.518 2.942 0 CA-C-N 120.187 1.358 . . . . 0.0 109.598 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.8 mp -98.84 -9.96 23.59 Favored 'General case' 0 N--CA 1.507 2.417 0 C-N-CA 123.569 0.748 . . . . 0.0 111.666 178.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -35.99 82.75 Favored 'General case' 1 N--CA 1.545 4.298 0 N-CA-C 102.528 -3.138 . . . . 0.0 102.528 166.894 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -52.6 -35.25 53.95 Favored 'General case' 0 N--CA 1.52 3.036 0 C-N-CA 124.316 1.047 . . . . 0.0 111.499 175.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 43.1 t90 -67.68 -39.26 84.49 Favored 'General case' 0 N--CA 1.53 3.563 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 177.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 10.4 mp -55.61 -30.13 60.35 Favored 'General case' 0 N--CA 1.536 3.853 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 176.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -74.3 -37.79 63.55 Favored 'General case' 0 N--CA 1.532 3.652 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 175.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.59 -21.4 65.59 Favored 'General case' 0 N--CA 1.535 3.797 0 CA-C-O 118.325 -0.845 . . . . 0.0 111.581 177.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -119.73 -8.14 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.838 0 CA-C-O 117.884 -1.055 . . . . 0.0 113.247 -176.131 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 8.2 mp -105.68 -51.31 3.02 Favored 'General case' 0 N--CA 1.531 3.602 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 176.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.0 tt -65.02 -47.62 76.79 Favored 'General case' 0 N--CA 1.536 3.855 0 C-N-CA 124.141 0.976 . . . . 0.0 110.381 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 37.8 tttm -67.2 -49.31 65.07 Favored 'General case' 0 N--CA 1.533 3.686 0 C-N-CA 122.997 0.519 . . . . 0.0 111.551 -178.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 7.0 t . . . . . 0 N--CA 1.526 3.353 0 CA-C-O 118.09 -0.957 . . . . 0.0 110.035 -179.432 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 . . . . . 0 N--CA 1.511 2.579 0 CA-C-O 118.523 -0.751 . . . . 0.0 111.801 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 73.7 m -69.73 135.39 88.0 Favored Pre-proline 0 N--CA 1.532 3.65 0 CA-C-O 117.51 -1.233 . . . . 0.0 110.468 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -75.09 -41.53 0.63 Allowed 'Trans proline' 0 C--N 1.384 2.43 0 C-N-CA 122.822 2.348 . . . . 0.0 112.211 -178.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 84.74 -67.59 0.04 OUTLIER 'General case' 0 N--CA 1.538 3.934 0 C-N-CA 125.976 1.71 . . . . 0.0 107.651 -176.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 50.8 m 63.32 140.99 0.02 OUTLIER 'General case' 0 N--CA 1.535 3.784 0 C-N-CA 124.806 1.242 . . . . 0.0 112.034 178.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -120.87 -51.54 2.13 Favored 'General case' 0 N--CA 1.521 3.123 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -146.72 -51.45 0.21 Allowed 'General case' 0 N--CA 1.52 3.063 0 C-N-CA 122.954 0.502 . . . . 0.0 110.082 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 21.6 mtp -95.02 120.96 36.12 Favored 'General case' 0 N--CA 1.52 3.033 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -137.28 -52.49 0.67 Allowed 'General case' 0 N--CA 1.521 3.091 0 C-N-CA 123.156 0.582 . . . . 0.0 109.547 -179.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -100.04 -56.56 2.34 Favored 'General case' 0 N--CA 1.52 3.039 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -168.24 -88.78 0.01 OUTLIER 'General case' 0 N--CA 1.536 3.84 0 CA-C-O 118.461 -0.781 . . . . 0.0 111.076 179.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 16.8 tpp180 65.59 116.59 0.03 OUTLIER 'General case' 0 N--CA 1.536 3.846 0 CA-C-N 119.714 1.143 . . . . 0.0 109.487 -178.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -102.79 134.89 45.44 Favored 'General case' 0 N--CA 1.527 3.4 0 C-N-CA 123.225 0.61 . . . . 0.0 110.704 -178.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -112.46 134.87 53.76 Favored 'General case' 0 N--CA 1.529 3.498 0 C-N-CA 123.36 0.664 . . . . 0.0 109.94 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -127.37 -66.03 0.91 Allowed 'General case' 0 N--CA 1.524 3.259 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 519' ' ' TRP . . . . . 0.407 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 71.0 t-105 -42.81 -28.33 0.24 Allowed 'General case' 1 N--CA 1.552 4.639 0 C-N-CA 124.388 1.075 . . . . 0.0 113.685 -179.694 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 520' ' ' LEU . . . . . 0.402 ' CD2' ' N ' ' B' ' 520' ' ' LEU . 2.2 mm? -96.09 -29.92 13.83 Favored 'General case' 0 N--CA 1.527 3.392 0 CA-C-O 117.895 -1.05 . . . . 0.0 113.449 -172.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 23.3 mtp180 -62.23 -26.17 68.23 Favored 'General case' 1 N--CA 1.54 4.055 0 N-CA-C 105.485 -2.043 . . . . 0.0 105.485 171.651 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . 0.439 ' CD2' ' HG ' ' A' ' 51' ' ' LEU . 1.8 m-85 -78.11 -39.77 40.33 Favored 'General case' 0 N--CA 1.515 2.8 0 N-CA-C 107.397 -1.334 . . . . 0.0 107.397 174.253 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 37.1 t -66.55 -23.36 31.29 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.259 0 CA-C-N 119.96 1.254 . . . . 0.0 112.493 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -78.01 -52.01 9.45 Favored 'General case' 0 N--CA 1.532 3.654 0 CA-C-N 120.345 1.429 . . . . 0.0 108.19 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 1.2 tp -68.16 -23.04 64.83 Favored 'General case' 0 N--CA 1.53 3.528 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 176.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -71.23 -36.16 71.72 Favored 'General case' 0 N--CA 1.522 3.157 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 176.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 527' ' ' LYS . . . . . 0.405 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 27.3 ttmt -66.21 -21.69 66.32 Favored 'General case' 0 N--CA 1.516 2.872 0 CA-C-O 118.383 -0.818 . . . . 0.0 111.003 177.029 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -72.43 -39.41 67.87 Favored 'General case' 0 N--CA 1.53 3.566 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 529' ' ' ALA . . . . . 0.453 ' HB2' ' N ' ' B' ' 535' ' ' HIS . . . -91.63 -7.83 48.94 Favored 'General case' 0 N--CA 1.506 2.362 0 CA-C-O 118.317 -0.849 . . . . 0.0 110.802 177.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 530' ' ' TYR . . . . . 0.405 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.6 OUTLIER -81.69 -33.06 31.41 Favored 'General case' 0 N--CA 1.531 3.596 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 177.513 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -54.61 -49.31 70.76 Favored 'General case' 0 N--CA 1.536 3.833 0 C-N-CA 124.557 1.143 . . . . 0.0 108.255 176.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -93.38 -85.12 0.28 Allowed 'General case' 0 N--CA 1.515 2.816 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 177.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.9 p30 153.53 45.83 0.0 OUTLIER 'General case' 1 N--CA 1.559 4.989 0 C-N-CA 127.707 2.403 . . . . 0.0 108.44 177.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 6.3 mt -103.26 13.31 34.16 Favored 'General case' 0 N--CA 1.518 2.953 0 C-N-CA 124.854 1.262 . . . . 0.0 110.068 -179.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 535' ' ' HIS . . . . . 0.453 ' N ' ' HB2' ' B' ' 529' ' ' ALA . 37.1 p-80 -84.37 4.15 32.63 Favored 'General case' 0 N--CA 1.512 2.657 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 174.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 536' ' ' LEU . . . . . 0.421 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 26.9 mt -94.83 -50.79 0.25 Allowed Pre-proline 0 N--CA 1.502 2.128 0 CA-C-O 116.302 -1.809 . . . . 0.0 108.296 -176.205 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 537' ' ' PRO . . . . . 0.421 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 5.7 Cg_exo -67.18 -32.32 34.04 Favored 'Trans proline' 0 C--N 1.4 3.244 0 C-N-CA 122.109 1.873 . . . . 0.0 107.485 170.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 538' ' ' LEU . . . . . 0.422 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 0.3 OUTLIER -65.86 -40.21 91.47 Favored 'General case' 0 N--CA 1.528 3.448 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 174.812 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 7.7 mt -67.76 -23.14 65.2 Favored 'General case' 1 N--CA 1.54 4.067 0 CA-C-O 118.289 -0.863 . . . . 0.0 109.965 176.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -76.71 -29.03 56.09 Favored 'General case' 0 N--CA 1.523 3.202 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 177.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 5.5 tp -70.84 -43.99 67.36 Favored 'General case' 0 N--CA 1.532 3.63 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 177.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -96.96 47.95 1.05 Allowed 'General case' 0 CA--C 1.61 3.251 0 N-CA-C 101.44 -3.541 . . . . 0.0 101.44 171.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -29.34 -91.08 0.0 OUTLIER 'General case' 0 N--CA 1.534 3.766 0 C-N-CA 127.698 2.399 . . . . 0.0 116.246 -171.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 38.0 p 44.08 85.56 0.16 Allowed Pre-proline 0 N--CA 1.531 3.602 0 C-N-CA 124.988 1.315 . . . . 0.0 112.783 -178.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -67.43 -27.89 39.49 Favored 'Trans proline' 0 C--N 1.395 2.994 0 C-N-CA 122.417 2.078 . . . . 0.0 110.032 177.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -58.68 -17.45 22.68 Favored 'General case' 0 N--CA 1.538 3.939 0 CA-C-O 118.491 -0.766 . . . . 0.0 111.169 176.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -66.55 -49.69 65.62 Favored 'General case' 0 N--CA 1.527 3.423 0 CA-C-N 119.25 0.932 . . . . 0.0 108.819 178.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 24.4 ptt-85 -80.55 -11.62 59.63 Favored 'General case' 0 N--CA 1.522 3.165 0 CA-C-O 118.097 -0.954 . . . . 0.0 112.295 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -72.15 -53.58 12.3 Favored 'General case' 0 N--CA 1.534 3.729 0 N-CA-C 106.533 -1.655 . . . . 0.0 106.533 174.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -82.91 -12.33 57.45 Favored 'General case' 0 N--CA 1.508 2.459 0 CA-C-O 117.301 -1.333 . . . . 0.0 111.926 178.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 551' ' ' LEU . . . . . 0.512 HD22 ' CG ' ' A' ' 22' ' ' PHE . 18.8 tp -82.2 -31.6 30.28 Favored 'General case' 0 N--CA 1.528 3.443 0 CA-C-N 121.088 1.767 . . . . 0.0 107.69 175.173 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -72.3 -53.66 8.69 Favored Glycine 0 N--CA 1.496 2.69 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 178.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 5.3 m -71.03 -28.41 64.37 Favored 'General case' 0 N--CA 1.534 3.741 0 CA-C-O 117.96 -1.019 . . . . 0.0 111.973 -178.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -68.33 -55.24 12.76 Favored 'General case' 1 N--CA 1.543 4.205 0 N-CA-C 106.546 -1.65 . . . . 0.0 106.546 176.2 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 38.3 t -59.07 -18.61 14.02 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.999 0 CA-C-O 117.937 -1.03 . . . . 0.0 110.428 176.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 5.2 mmm180 -79.81 -44.11 21.18 Favored 'General case' 0 N--CA 1.526 3.356 0 CA-C-O 117.436 -1.269 . . . . 0.0 111.862 178.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 557' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.72 -20.63 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.569 0 CA-C-N 121.365 1.893 . . . . 0.0 110.715 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 558' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -88.92 -51.04 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.871 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -60.0 -23.58 63.77 Favored 'General case' 0 N--CA 1.53 3.569 0 CA-C-O 118.892 -0.575 . . . . 0.0 110.483 177.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -95.93 -23.15 17.0 Favored 'General case' 0 N--CA 1.523 3.191 0 CA-C-O 117.875 -1.059 . . . . 0.0 111.151 178.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 6.1 tp -80.84 -60.04 2.45 Favored 'General case' 0 N--CA 1.529 3.496 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 178.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 38.8 mt -39.11 -37.44 0.39 Allowed 'General case' 1 N--CA 1.549 4.482 0 C-N-CA 126.051 1.74 . . . . 0.0 112.415 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 29.6 mmm180 -83.47 -53.41 5.72 Favored 'General case' 0 N--CA 1.519 3.002 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 79.3 54.02 4.2 Favored Glycine 0 N--CA 1.509 3.537 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 178.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -83.15 -63.02 1.44 Allowed 'General case' 0 N--CA 1.518 2.954 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 178.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 19.0 ttm 176.75 85.29 0.01 OUTLIER 'General case' 1 N--CA 1.539 4.011 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 177.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 58.8 m -141.54 36.24 1.65 Allowed 'General case' 0 N--CA 1.518 2.944 0 C-N-CA 122.706 0.403 . . . . 0.0 111.463 -177.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -100.4 -47.75 4.8 Favored 'General case' 0 N--CA 1.522 3.157 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 177.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 1.9 mmt-85 -107.91 -31.79 7.85 Favored 'General case' 0 N--CA 1.522 3.159 0 C-N-CA 123.787 0.835 . . . . 0.0 112.059 -178.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -92.77 -13.23 29.53 Favored 'General case' 0 N--CA 1.519 2.994 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 -176.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 14.5 tp -75.1 -45.7 39.45 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-N 120.644 1.566 . . . . 0.0 111.348 -177.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.79 -33.49 16.69 Favored 'General case' 1 N--CA 1.547 4.421 0 CA-C-N 119.71 1.141 . . . . 0.0 113.208 -179.913 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -64.97 -36.06 83.19 Favored 'General case' 1 N--CA 1.541 4.082 0 C-N-CA 122.93 0.492 . . . . 0.0 111.566 -178.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -49.2 -57.55 6.54 Favored 'General case' 0 N--CA 1.53 3.546 0 C-N-CA 124.573 1.149 . . . . 0.0 113.141 -178.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -132.96 -38.91 0.97 Allowed 'General case' 0 N--CA 1.534 3.726 0 CA-C-O 118.526 -0.75 . . . . 0.0 111.848 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 130.7 63.67 0.1 OUTLIER Glycine 1 N--CA 1.52 4.271 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 179.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -114.81 98.55 6.91 Favored 'General case' 0 N--CA 1.518 2.934 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -42.16 168.82 0.01 OUTLIER Glycine 1 N--CA 1.541 5.645 0 C-N-CA 125.012 1.292 . . . . 0.0 115.493 -176.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 579' ' ' ILE . . . . . 0.466 HG22 ' N6 ' ' E' ' 4' ' ' ' DA' . 1.9 mt -83.66 -14.19 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.335 0 CA-C-O 117.61 -1.186 . . . . 0.0 109.002 178.341 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -69.86 -36.63 75.67 Favored 'General case' 0 N--CA 1.525 3.313 0 CA-C-N 120.091 1.314 . . . . 0.0 108.973 175.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.1 p -79.49 -36.54 38.51 Favored 'General case' 1 N--CA 1.541 4.109 0 CA-C-N 118.924 0.784 . . . . 0.0 111.825 178.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -69.66 -36.54 71.0 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.414 0 C-N-CA 123.379 0.672 . . . . 0.0 111.736 -175.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 81.4 p -99.57 -28.1 13.38 Favored 'General case' 0 N--CA 1.515 2.777 0 CA-C-O 117.974 -1.012 . . . . 0.0 111.396 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 11.1 ptt180 -75.94 -19.41 58.79 Favored 'General case' 0 N--CA 1.531 3.579 0 CA-C-N 120.081 1.309 . . . . 0.0 108.217 174.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -62.03 -36.42 92.87 Favored Glycine 1 N--CA 1.517 4.052 0 N-CA-C 108.645 -1.782 . . . . 0.0 108.645 175.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 84.3 p -63.3 -36.84 85.0 Favored 'General case' 0 N--CA 1.537 3.89 0 CA-C-N 117.976 0.888 . . . . 0.0 109.792 176.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -56.75 -32.47 65.62 Favored 'General case' 1 N--CA 1.546 4.361 0 C-N-CA 123.638 0.775 . . . . 0.0 111.535 179.094 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 8.7 m -61.39 -41.11 96.59 Favored 'General case' 1 N--CA 1.542 4.174 0 C-N-CA 123.39 0.676 . . . . 0.0 110.527 179.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 51.4 mt -58.93 -45.32 90.66 Favored 'General case' 0 N--CA 1.525 3.286 0 C-N-CA 123.907 0.883 . . . . 0.0 111.11 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? -62.0 -24.49 67.07 Favored 'General case' 1 N--CA 1.539 4.005 0 CA-C-O 118.549 -0.739 . . . . 0.0 112.038 179.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -78.16 -40.38 38.06 Favored 'General case' 0 N--CA 1.516 2.84 0 CA-C-N 118.729 0.695 . . . . 0.0 110.755 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -65.28 159.24 67.66 Favored Pre-proline 0 N--CA 1.537 3.918 0 CA-C-O 118.535 -0.745 . . . . 0.0 112.673 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -79.42 179.76 6.1 Favored 'Trans proline' 0 C--N 1.381 2.257 0 C-N-CA 122.105 1.87 . . . . 0.0 110.834 178.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.2 t -97.25 -27.03 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.083 0 CA-C-O 117.676 -1.154 . . . . 0.0 111.683 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -63.22 -40.52 97.69 Favored 'General case' 0 N--CA 1.515 2.804 0 CA-C-N 120.045 1.293 . . . . 0.0 110.559 -178.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 6.9 mp -98.76 -15.84 19.17 Favored 'General case' 0 N--CA 1.51 2.56 0 C-N-CA 123.388 0.675 . . . . 0.0 111.76 178.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -29.98 69.44 Favored 'General case' 1 N--CA 1.54 4.058 0 N-CA-C 103.328 -2.841 . . . . 0.0 103.328 168.05 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -54.62 -38.24 66.58 Favored 'General case' 0 N--CA 1.52 3.043 0 C-N-CA 124.099 0.96 . . . . 0.0 110.039 174.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 599' ' ' TRP . . . . . . . . . . . . . 45.1 t90 -63.46 -38.11 89.88 Favored 'General case' 0 N--CA 1.534 3.729 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 176.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.6 -34.87 52.88 Favored 'General case' 1 N--CA 1.541 4.077 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 177.019 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -71.69 -38.32 70.6 Favored 'General case' 1 N--CA 1.54 4.073 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 175.287 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -60.11 -23.21 63.67 Favored 'General case' 1 N--CA 1.542 4.137 0 C-N-CA 123.857 0.863 . . . . 0.0 110.815 176.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -115.81 7.11 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.466 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -176.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 73.0 mt -118.88 -61.19 1.68 Allowed 'General case' 0 N--CA 1.529 3.519 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.41 -56.33 22.46 Favored 'General case' 0 N--CA 1.538 3.934 0 C-N-CA 124.691 1.197 . . . . 0.0 111.681 -178.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 70.9 tttt -98.78 -40.45 8.13 Favored 'General case' 0 N--CA 1.53 3.563 0 CA-C-O 118.656 -0.688 . . . . 0.0 110.797 -178.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 90.1 p . . . . . 0 N--CA 1.539 3.994 0 C-N-CA 124.943 1.297 . . . . 0.0 113.419 -179.223 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 10.4 t-105 . . . . . 0 N--CA 1.496 1.854 0 CA-C-O 118.554 -0.736 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.505 2.311 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.758 5 O4'-C1'-N19 119.404 14.505 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.682 5 O4'-C1'-N19 120.032 15.29 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.618 2 O4'-C1'-N19 119.33 14.412 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.419 -9.929 5 O4'-C1'-N19 119.488 14.609 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' E' E ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.568 10.562 4 C4'-C3'-C2' 117.048 13.848 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.401 -11.666 4 O4'-C1'-N19 119.795 14.994 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' E' E ' 7' ' ' ' DA' . . . . . 0.481 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 5 C3'--C2' 1.391 -12.72 5 N19-C1'-C2' 131.975 11.109 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' E' E ' 8' ' ' ' DG' . . . . . 0.481 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 5 C3'--C2' 1.413 -10.531 4 O4'-C1'-N19 118.088 12.86 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.414 -10.383 5 O4'-C1'-N19 120.143 15.429 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.71 6 O4'-C1'-N19 119.222 14.277 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.732 2 O4'-C1'-N19 119.311 14.389 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.626 3 O4'-C1'-N19 119.459 14.574 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.579 11.369 5 O4'-C1'-N19 118.859 13.824 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' E' E ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.409 -10.886 5 O4'-C1'-N19 118.699 13.623 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' E' E ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.426 -9.181 3 O4'-C1'-N19 119.567 14.709 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.429 4 O4'-C1'-N19 119.672 14.84 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.573 10.9 4 O4'-C1'-N19 119.618 14.772 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.418 4 O4'-C1'-N19 119.741 14.926 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.424 -9.435 3 O4'-C1'-N19 119.727 14.908 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.51 6.947 4 O4'-C1'-N19 119.524 14.655 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.566 10.414 3 C4'-C3'-C2' 116.95 13.75 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -11.035 3 O4'-C1'-N19 119.819 15.023 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.667 5 O4'-C1'-N19 118.776 13.72 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' F' F ' 4' ' ' ' DA' . . . . . 0.423 ' N6 ' HG23 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.415 -10.35 2 O4'-C1'-N19 119.072 14.09 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' F' F ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.574 10.967 4 O4'-C1'-N19 119.055 14.069 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.399 -11.922 6 O4'-C1'-N19 119.177 14.221 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.418 -9.999 3 C4'-C3'-C2' 113.739 10.539 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.411 -10.74 5 O4'-C1'-N19 119.898 15.123 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.394 5 O4'-C1'-N19 119.309 14.386 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.411 -10.686 3 O4'-C1'-N19 119.506 14.632 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.423 -9.529 4 O4'-C1'-N19 120.047 15.308 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.424 -9.44 4 O4'-C1'-N19 119.523 14.654 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.421 -9.676 4 O4'-C1'-N19 119.379 14.473 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' F' F ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.407 -11.11 5 O4'-C1'-N19 118.788 13.735 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' F' F ' 15' ' ' ' DA' . . . . . 0.416 ' H62' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.425 -9.25 3 O4'-C1'-N19 119.739 14.924 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.416 -10.24 5 O4'-C1'-N19 120.082 15.352 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.208 4 O4'-C1'-N19 119.251 14.314 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.156 4 O4'-C1'-N19 119.989 15.237 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.597 5 O4'-C1'-N19 119.149 14.187 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.508 6.793 3 O4'-C1'-N19 119.685 14.857 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 . . . . . 0 N--CA 1.509 2.483 0 CA-C-O 119.106 -0.473 . . . . 0.0 110.764 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.4 t -90.31 -49.12 0.37 Allowed Pre-proline 0 N--CA 1.53 3.533 0 CA-C-O 116.54 -1.695 . . . . 0.0 112.666 -179.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_endo -65.36 139.87 61.45 Favored 'Trans proline' 0 C--N 1.395 3.014 0 C-N-CA 122.51 2.14 . . . . 0.0 112.503 -178.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -120.71 126.2 49.59 Favored 'General case' 0 N--CA 1.522 3.142 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.8 t -141.51 142.9 33.57 Favored 'General case' 0 N--CA 1.526 3.352 0 C-N-CA 122.942 0.497 . . . . 0.0 110.736 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -138.1 132.53 32.19 Favored 'General case' 0 N--CA 1.516 2.87 0 C-N-CA 122.641 0.377 . . . . 0.0 111.029 -179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 62.69 134.69 0.01 OUTLIER 'General case' 0 N--CA 1.532 3.636 0 C-N-CA 125.04 1.336 . . . . 0.0 113.17 178.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 16.1 ptt? -160.57 126.24 3.94 Favored 'General case' 0 N--CA 1.531 3.608 0 C-N-CA 123.358 0.663 . . . . 0.0 109.484 178.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -148.85 139.95 23.07 Favored 'General case' 0 N--CA 1.524 3.238 0 C-N-CA 122.385 0.274 . . . . 0.0 111.68 -178.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -146.54 -48.42 0.2 Allowed 'General case' 0 N--CA 1.526 3.329 0 C-N-CA 123.087 0.555 . . . . 0.0 109.986 179.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -129.95 131.19 45.87 Favored 'General case' 0 N--CA 1.521 3.11 0 C-N-CA 123.039 0.535 . . . . 0.0 109.807 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.0 mtp-105 -125.32 -57.71 1.47 Allowed 'General case' 0 N--CA 1.521 3.093 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 71.5 m80 -152.31 129.77 11.4 Favored 'General case' 0 N--CA 1.534 3.751 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -111.46 -79.91 0.58 Allowed 'General case' 0 N--CA 1.526 3.374 0 CA-C-O 118.881 -0.58 . . . . 0.0 110.449 -179.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -146.72 -64.86 0.29 Allowed 'General case' 0 N--CA 1.528 3.452 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 -179.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 29.7 t-105 -46.91 -40.55 14.35 Favored 'General case' 0 N--CA 1.533 3.681 0 C-N-CA 125.081 1.353 . . . . 0.0 110.888 176.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -88.41 -26.6 22.06 Favored 'General case' 0 N--CA 1.531 3.582 0 CA-C-O 118.154 -0.927 . . . . 0.0 111.251 -179.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.2 mtt-85 -56.17 -20.78 19.27 Favored 'General case' 0 N--CA 1.537 3.89 0 CA-C-N 119.618 1.099 . . . . 0.0 108.138 173.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.407 ' HB2' HG22 ' B' ' 555' ' ' VAL . 57.4 t80 -96.3 -34.42 11.6 Favored 'General case' 0 N--CA 1.509 2.518 0 CA-C-O 116.799 -1.572 . . . . 0.0 109.2 171.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 64.5 t -70.69 -63.26 1.01 Allowed 'Isoleucine or valine' 1 N--CA 1.569 5.515 0 CA-C-N 121.713 2.052 . . . . 0.0 110.81 -177.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -55.6 -39.5 70.82 Favored 'General case' 1 N--CA 1.547 4.383 0 CA-C-N 119.006 0.821 . . . . 0.0 110.537 -179.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.84 -31.79 72.64 Favored 'General case' 1 N--CA 1.543 4.188 0 C-N-CA 123.081 0.552 . . . . 0.0 109.558 177.17 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.97 -34.8 78.93 Favored 'General case' 0 N--CA 1.53 3.545 0 CA-C-O 118.747 -0.644 . . . . 0.0 109.741 177.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 54.0 tttt -67.83 -24.67 65.3 Favored 'General case' 0 N--CA 1.526 3.334 0 CA-C-O 118.589 -0.719 . . . . 0.0 111.132 177.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -69.61 -43.38 72.86 Favored 'General case' 1 N--CA 1.541 4.083 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 176.396 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.409 ' HB2' ' N ' ' A' ' 35' ' ' HIS . . . -81.67 -9.6 59.61 Favored 'General case' 0 N--CA 1.501 2.115 0 CA-C-O 118.407 -0.806 . . . . 0.0 110.424 177.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -78.74 -34.72 45.58 Favored 'General case' 0 N--CA 1.525 3.281 0 CA-C-N 120.234 1.379 . . . . 0.0 109.448 179.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 -62.42 -41.27 98.58 Favored 'General case' 0 N--CA 1.537 3.903 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -92.31 -86.95 0.23 Allowed 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 106.927 -1.509 . . . . 0.0 106.927 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.8 p30 148.59 51.98 0.0 OUTLIER 'General case' 1 N--CA 1.561 5.124 0 C-N-CA 128.387 2.675 . . . . 0.0 107.24 177.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.4 mt -111.14 11.7 21.9 Favored 'General case' 0 N--CA 1.526 3.371 0 C-N-CA 124.649 1.179 . . . . 0.0 110.858 -177.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.409 ' N ' ' HB2' ' A' ' 29' ' ' ALA . 54.6 p-80 -84.09 3.84 32.95 Favored 'General case' 0 N--CA 1.507 2.398 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.421 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 20.0 mt -92.16 -50.75 0.29 Allowed Pre-proline 0 N--CA 1.505 2.276 0 CA-C-O 116.868 -1.539 . . . . 0.0 108.348 -176.108 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.421 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 7.3 Cg_exo -62.49 -36.24 66.72 Favored 'Trans proline' 0 C--N 1.395 2.979 0 N-CA-C 106.438 -2.178 . . . . 0.0 106.438 170.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.4 -44.02 79.89 Favored 'General case' 0 N--CA 1.528 3.428 0 C-N-CA 123.881 0.872 . . . . 0.0 110.439 175.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.68 -28.32 58.63 Favored 'General case' 1 N--CA 1.542 4.126 0 N-CA-C 113.96 1.096 . . . . 0.0 113.96 -176.176 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 30.1 p30 -88.39 6.1 39.02 Favored 'General case' 0 N--CA 1.536 3.853 0 CA-C-N 119.845 1.202 . . . . 0.0 112.36 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.85 -43.74 2.55 Favored 'General case' 0 N--CA 1.519 2.999 0 CA-C-N 118.942 0.792 . . . . 0.0 110.003 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -35.76 74.59 Favored 'General case' 0 N--CA 1.534 3.726 0 CA-C-N 119.006 0.821 . . . . 0.0 111.924 -176.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tt -135.3 -77.58 0.44 Allowed 'General case' 0 N--CA 1.504 2.271 0 CA-C-O 118.54 -0.743 . . . . 0.0 110.972 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.1 p -167.24 172.91 3.3 Favored Pre-proline 1 N--CA 1.55 4.559 0 C-N-CA 124.012 0.925 . . . . 0.0 111.284 -177.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -68.68 -18.69 42.33 Favored 'Trans proline' 0 CA--C 1.588 3.207 0 C-N-CA 121.999 1.799 . . . . 0.0 108.761 172.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -63.09 -15.39 56.51 Favored 'General case' 0 N--CA 1.529 3.493 0 CA-C-O 118.303 -0.856 . . . . 0.0 111.196 176.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -67.02 -38.62 86.27 Favored 'General case' 0 N--CA 1.53 3.572 0 CA-C-N 119.344 0.975 . . . . 0.0 108.917 177.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 19.0 ptt180 -86.26 -14.29 44.24 Favored 'General case' 0 N--CA 1.533 3.696 0 CA-C-O 118.229 -0.891 . . . . 0.0 109.775 174.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -73.38 -27.59 61.56 Favored 'General case' 0 N--CA 1.533 3.679 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 173.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.22 -46.59 8.33 Favored 'General case' 0 N--CA 1.509 2.486 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.48 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 18.9 tp -64.01 -23.65 67.41 Favored 'General case' 1 N--CA 1.54 4.054 0 CA-C-N 120.0 1.273 . . . . 0.0 107.714 174.069 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.41 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -67.46 -77.53 0.32 Allowed Glycine 0 N--CA 1.504 3.231 0 C-N-CA 125.449 1.499 . . . . 0.0 111.845 176.669 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.8 m -69.82 -26.66 64.35 Favored 'General case' 0 N--CA 1.538 3.964 0 CA-C-O 118.328 -0.844 . . . . 0.0 113.005 -176.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -70.73 -47.77 58.0 Favored 'General case' 0 N--CA 1.533 3.71 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 178.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 22.7 t -65.8 -18.73 24.45 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.168 0 CA-C-N 120.008 1.277 . . . . 0.0 109.373 174.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.9 mtp180 -72.58 -46.83 52.38 Favored 'General case' 0 N--CA 1.529 3.515 0 CA-C-O 117.555 -1.212 . . . . 0.0 111.826 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.409 ' HB ' HG23 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -74.41 -24.39 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.609 0 CA-C-N 121.147 1.794 . . . . 0.0 111.359 -178.896 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -86.26 -52.46 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.999 0 CA-C-N 120.144 1.338 . . . . 0.0 107.984 -178.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -60.2 -30.53 69.43 Favored 'General case' 0 N--CA 1.529 3.522 0 C-N-CA 123.387 0.675 . . . . 0.0 109.796 178.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -76.6 -33.53 58.42 Favored 'General case' 0 N--CA 1.529 3.501 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 176.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.7 mp -75.8 -24.84 55.96 Favored 'General case' 0 N--CA 1.529 3.514 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 176.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 22.7 mt -76.99 -26.5 53.96 Favored 'General case' 0 N--CA 1.52 3.068 0 C-N-CA 123.774 0.83 . . . . 0.0 109.482 177.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? -77.38 -44.9 27.71 Favored 'General case' 0 N--CA 1.522 3.132 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 179.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.67 52.07 6.76 Favored Glycine 1 N--CA 1.516 4.029 0 CA-C-O 119.239 -0.756 . . . . 0.0 111.607 177.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -95.19 -42.04 8.77 Favored 'General case' 0 N--CA 1.523 3.223 0 CA-C-N 117.888 0.844 . . . . 0.0 109.519 178.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 5.0 ttt 119.95 82.14 0.0 OUTLIER 'General case' 1 N--CA 1.545 4.288 0 C-N-CA 127.61 2.364 . . . . 0.0 105.309 -179.319 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 19.8 m -139.39 49.13 1.83 Allowed 'General case' 0 N--CA 1.514 2.751 0 CA-C-O 122.036 0.922 . . . . 0.0 110.135 -177.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -110.83 -49.13 3.06 Favored 'General case' 0 N--CA 1.52 3.057 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 178.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -91.35 -46.63 7.92 Favored 'General case' 0 N--CA 1.522 3.147 0 C-N-CA 123.776 0.83 . . . . 0.0 109.076 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -76.46 -10.47 59.42 Favored 'General case' 0 N--CA 1.518 2.941 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -179.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 43.0 tp -83.72 -50.94 7.67 Favored 'General case' 0 N--CA 1.531 3.587 0 CA-C-O 117.591 -1.195 . . . . 0.0 113.325 -177.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -37.9 -36.6 0.2 Allowed 'General case' 1 N--CA 1.549 4.506 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 -176.354 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -66.02 -38.32 88.14 Favored 'General case' 1 N--CA 1.542 4.139 0 CA-C-N 118.569 0.622 . . . . 0.0 111.847 -177.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -50.65 -34.09 24.97 Favored 'General case' 0 N--CA 1.532 3.66 0 C-N-CA 124.427 1.091 . . . . 0.0 113.675 -178.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 pp -151.01 -44.52 0.12 Allowed 'General case' 0 N--CA 1.53 3.558 0 CA-C-N 119.045 0.839 . . . . 0.0 112.108 -179.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 114.47 81.68 1.01 Allowed Glycine 1 N--CA 1.517 4.053 0 N-CA-C 110.895 -0.882 . . . . 0.0 110.895 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -106.14 -50.65 3.12 Favored 'General case' 0 N--CA 1.522 3.165 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 177.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 119.2 158.58 10.73 Favored Glycine 1 N--CA 1.516 4.001 0 N-CA-C 110.112 -1.195 . . . . 0.0 110.112 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.423 HG23 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.5 OUTLIER -81.01 -18.53 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.984 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 177.501 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.78 -36.05 77.83 Favored 'General case' 0 N--CA 1.518 2.928 0 CA-C-O 117.658 -1.163 . . . . 0.0 110.111 177.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 10.5 p -76.77 -50.82 12.64 Favored 'General case' 0 N--CA 1.534 3.739 0 CA-C-N 119.604 1.093 . . . . 0.0 111.895 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.409 HG23 ' HB ' ' A' ' 57' ' ' ILE . 0.1 OUTLIER -64.7 -28.54 45.05 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.038 0 CA-C-O 118.102 -0.951 . . . . 0.0 113.087 -176.833 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 44.4 p -99.77 -29.13 12.8 Favored 'General case' 0 N--CA 1.515 2.81 0 CA-C-N 119.456 1.025 . . . . 0.0 111.294 -178.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.3 ptt180 -73.85 -24.73 59.8 Favored 'General case' 0 N--CA 1.535 3.815 0 CA-C-N 119.651 1.114 . . . . 0.0 108.892 175.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.62 -32.32 82.82 Favored Glycine 1 N--CA 1.519 4.196 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 175.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 6.4 t -65.77 -42.37 90.92 Favored 'General case' 1 N--CA 1.54 4.028 0 CA-C-N 117.899 0.85 . . . . 0.0 110.126 177.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -64.14 -30.29 71.36 Favored 'General case' 0 N--CA 1.537 3.913 0 C-N-CA 123.395 0.678 . . . . 0.0 111.115 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.2 m -67.57 -38.3 83.89 Favored 'General case' 0 N--CA 1.532 3.654 0 C-N-CA 123.355 0.662 . . . . 0.0 110.576 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 21.5 mt -55.73 -44.89 77.97 Favored 'General case' 0 N--CA 1.53 3.564 0 C-N-CA 124.151 0.981 . . . . 0.0 111.387 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -28.29 69.25 Favored 'General case' 1 N--CA 1.542 4.139 0 CA-C-O 118.786 -0.626 . . . . 0.0 111.442 179.868 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -69.91 -39.95 75.86 Favored 'General case' 0 N--CA 1.52 3.033 0 CA-C-N 118.426 0.557 . . . . 0.0 110.849 179.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.44 161.11 6.14 Favored Pre-proline 1 N--CA 1.542 4.127 0 CA-C-O 118.428 -0.796 . . . . 0.0 112.712 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -79.68 156.67 24.55 Favored 'Trans proline' 0 C--N 1.377 2.059 0 C-N-CA 122.077 1.851 . . . . 0.0 110.931 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.6 t -88.8 -27.79 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.096 0 CA-C-O 117.734 -1.127 . . . . 0.0 111.947 -178.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -64.06 -34.93 79.14 Favored 'General case' 0 N--CA 1.516 2.857 0 CA-C-N 120.262 1.392 . . . . 0.0 109.987 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.1 mp -96.94 -19.61 18.68 Favored 'General case' 0 N--CA 1.51 2.538 0 C-N-CA 123.85 0.86 . . . . 0.0 110.776 177.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.29 -33.58 74.93 Favored 'General case' 1 N--CA 1.547 4.387 0 N-CA-C 104.521 -2.399 . . . . 0.0 104.521 169.721 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -51.17 -42.8 61.06 Favored 'General case' 0 N--CA 1.522 3.164 0 C-N-CA 124.535 1.134 . . . . 0.0 110.803 175.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.468 ' HA ' ' HB2' ' A' ' 102' ' ' GLU . 38.3 t90 -63.18 -36.04 82.3 Favored 'General case' 0 N--CA 1.532 3.662 0 N-CA-C 107.637 -1.246 . . . . 0.0 107.637 177.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.5 tt -50.77 -40.9 56.23 Favored 'General case' 0 N--CA 1.537 3.905 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 175.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -69.17 -37.21 78.07 Favored 'General case' 1 N--CA 1.545 4.313 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 176.028 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.468 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 1.3 mm-40 -58.02 -23.23 53.34 Favored 'General case' 1 N--CA 1.545 4.276 0 C-N-CA 123.662 0.785 . . . . 0.0 110.55 175.814 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -122.39 -0.64 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.314 0 CA-C-O 118.28 -0.867 . . . . 0.0 113.007 -176.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -112.31 -59.04 2.06 Favored 'General case' 0 N--CA 1.517 2.919 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 176.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.1 tt -54.06 -58.9 5.6 Favored 'General case' 1 N--CA 1.544 4.225 0 C-N-CA 124.776 1.23 . . . . 0.0 111.714 179.192 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -63.22 -30.36 71.52 Favored 'General case' 0 N--CA 1.539 3.981 0 CA-C-O 118.535 -0.745 . . . . 0.0 111.876 -178.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 70.4 m . . . . . 0 N--CA 1.524 3.228 0 CA-C-O 117.975 -1.012 . . . . 0.0 109.68 179.362 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 33.3 tt0 . . . . . 0 N--CA 1.501 2.104 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 40.9 p -120.37 142.37 33.73 Favored Pre-proline 0 N--CA 1.53 3.545 0 CA-C-O 117.641 -1.171 . . . . 0.0 110.674 179.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -62.54 121.22 9.09 Favored 'Trans proline' 0 C--N 1.394 2.96 0 C-N-CA 122.886 2.391 . . . . 0.0 110.75 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -97.78 124.77 42.29 Favored 'General case' 0 N--CA 1.519 2.984 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -179.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 72.5 m -133.62 -46.56 0.81 Allowed 'General case' 0 N--CA 1.525 3.309 0 C-N-CA 123.663 0.785 . . . . 0.0 109.128 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . 69.63 133.73 0.03 OUTLIER 'General case' 0 N--CA 1.531 3.6 0 C-N-CA 124.708 1.203 . . . . 0.0 111.44 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -140.52 -50.22 0.46 Allowed 'General case' 0 N--CA 1.521 3.118 0 C-N-CA 123.525 0.73 . . . . 0.0 109.26 179.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 16.8 mmt -100.36 137.35 38.91 Favored 'General case' 0 N--CA 1.525 3.296 0 C-N-CA 123.366 0.666 . . . . 0.0 109.614 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . 65.34 144.3 0.03 OUTLIER 'General case' 1 N--CA 1.542 4.166 0 C-N-CA 124.287 1.035 . . . . 0.0 111.869 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -83.66 -57.58 3.17 Favored 'General case' 0 N--CA 1.523 3.185 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 64.75 136.79 0.02 OUTLIER 'General case' 1 N--CA 1.548 4.43 0 C-N-CA 124.3 1.04 . . . . 0.0 111.085 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -131.46 131.32 43.42 Favored 'General case' 0 N--CA 1.531 3.595 0 CA-C-N 118.012 0.369 . . . . 0.0 111.693 -179.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 4.0 p-80 -121.58 117.87 27.83 Favored 'General case' 0 N--CA 1.526 3.375 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 177.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -91.79 125.99 36.71 Favored 'General case' 0 N--CA 1.529 3.507 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -177.265 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -139.54 -58.97 0.57 Allowed 'General case' 0 N--CA 1.524 3.256 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 178.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 519' ' ' TRP . . . . . 0.487 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 64.5 t-105 -47.02 -26.67 1.09 Allowed 'General case' 1 N--CA 1.542 4.137 0 C-N-CA 124.261 1.024 . . . . 0.0 112.588 177.056 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 520' ' ' LEU . . . . . 0.406 ' N ' ' CD2' ' B' ' 520' ' ' LEU . 2.1 mm? -96.13 -28.23 14.68 Favored 'General case' 0 N--CA 1.529 3.494 0 CA-C-O 117.558 -1.21 . . . . 0.0 113.105 -173.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 55.4 ttt180 -61.71 -25.45 67.43 Favored 'General case' 1 N--CA 1.542 4.174 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 170.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . 0.487 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.6 m-85 -77.93 -41.97 34.57 Favored 'General case' 0 N--CA 1.51 2.557 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 174.088 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 86.0 t -65.17 -18.22 23.39 Favored 'Isoleucine or valine' 1 N--CA 1.574 5.775 0 CA-C-N 120.116 1.325 . . . . 0.0 111.918 178.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -78.13 -57.06 3.99 Favored 'General case' 0 N--CA 1.534 3.726 0 CA-C-N 120.406 1.457 . . . . 0.0 107.338 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.1 -24.68 67.28 Favored 'General case' 0 N--CA 1.537 3.881 0 O-C-N 123.248 0.343 . . . . 0.0 110.287 175.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -73.06 -36.77 66.94 Favored 'General case' 0 N--CA 1.516 2.868 0 CA-C-O 118.171 -0.918 . . . . 0.0 109.452 178.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 3.5 tttt -68.42 -22.89 64.59 Favored 'General case' 0 N--CA 1.528 3.455 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.037 178.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -71.91 -44.07 64.3 Favored 'General case' 0 N--CA 1.532 3.647 0 CA-C-N 119.282 0.946 . . . . 0.0 108.809 177.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 529' ' ' ALA . . . . . . . . . . . . . . . -82.13 -13.51 57.12 Favored 'General case' 0 N--CA 1.511 2.575 0 CA-C-O 119.028 -0.51 . . . . 0.0 110.934 178.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -78.51 -30.89 47.38 Favored 'General case' 0 N--CA 1.534 3.742 0 CA-C-N 119.566 1.076 . . . . 0.0 109.65 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -66.1 -44.44 84.34 Favored 'General case' 0 N--CA 1.535 3.793 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 177.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -87.76 -90.31 0.12 Allowed 'General case' 0 N--CA 1.515 2.781 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 176.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.1 p30 156.46 50.08 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.831 0 C-N-CA 127.041 2.136 . . . . 0.0 108.667 176.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 7.8 mt -107.46 5.19 26.99 Favored 'General case' 0 N--CA 1.518 2.961 0 C-N-CA 124.901 1.28 . . . . 0.0 110.569 -178.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 535' ' ' HIS . . . . . . . . . . . . . 50.5 p-80 -77.84 3.73 13.62 Favored 'General case' 0 N--CA 1.522 3.132 0 O-C-N 121.824 -0.548 . . . . 0.0 109.6 174.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 536' ' ' LEU . . . . . 0.428 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 24.5 mt -93.21 -52.57 0.26 Allowed Pre-proline 0 N--CA 1.504 2.264 0 CA-C-O 116.783 -1.58 . . . . 0.0 108.42 -176.055 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 537' ' ' PRO . . . . . 0.428 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 4.8 Cg_exo -60.75 -33.32 93.2 Favored 'Trans proline' 0 C--N 1.397 3.124 0 C-N-CA 122.152 1.901 . . . . 0.0 107.942 171.312 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 7.5 mp -62.01 -49.06 77.54 Favored 'General case' 0 N--CA 1.536 3.865 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 174.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 29.4 mt -70.74 -11.5 60.98 Favored 'General case' 0 N--CA 1.534 3.757 0 CA-C-O 118.311 -0.852 . . . . 0.0 112.374 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -81.3 -15.74 54.54 Favored 'General case' 0 N--CA 1.52 3.072 0 CA-C-O 118.108 -0.949 . . . . 0.0 110.996 177.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -117.68 -30.3 5.5 Favored 'General case' 0 N--CA 1.525 3.325 0 CA-C-N 119.774 1.17 . . . . 0.0 112.497 -177.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 4.6 ptt? -101.64 10.87 39.76 Favored 'General case' 1 N--CA 1.544 4.254 0 CA-C-N 120.286 1.403 . . . . 0.0 112.726 -179.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 1.3 tt -128.72 -95.77 0.41 Allowed 'General case' 0 N--CA 1.528 3.459 0 CA-C-O 117.477 -1.249 . . . . 0.0 112.372 178.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 162.75 177.77 0.03 OUTLIER Pre-proline 1 N--CA 1.585 6.319 0 CA-C-N 120.916 1.689 . . . . 0.0 109.549 -176.698 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -57.09 -21.45 42.49 Favored 'Trans proline' 1 N--CA 1.538 4.104 0 C-N-CA 122.31 2.007 . . . . 0.0 111.225 173.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -64.46 -0.37 1.31 Allowed 'General case' 0 N--CA 1.532 3.632 0 C-N-CA 123.613 0.765 . . . . 0.0 111.47 175.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -55.45 -79.8 0.02 OUTLIER 'General case' 0 N--CA 1.521 3.112 0 CA-C-O 116.608 -1.663 . . . . 0.0 108.632 178.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 25.4 ptt180 -88.07 -8.95 54.76 Favored 'General case' 0 N--CA 1.523 3.198 0 CA-C-N 121.878 2.126 . . . . 0.0 111.976 177.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -68.94 -54.88 12.99 Favored 'General case' 0 N--CA 1.534 3.753 0 CA-C-N 120.569 1.532 . . . . 0.0 107.676 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -85.33 -30.24 23.85 Favored 'General case' 0 N--CA 1.513 2.713 0 CA-C-O 117.843 -1.075 . . . . 0.0 111.809 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 551' ' ' LEU . . . . . . . . . . . . . 14.0 tp -67.88 -36.38 80.16 Favored 'General case' 1 N--CA 1.542 4.171 0 CA-C-N 121.136 1.789 . . . . 0.0 109.787 178.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -74.38 -55.71 5.47 Favored Glycine 0 N--CA 1.496 2.693 0 CA-C-O 118.642 -1.088 . . . . 0.0 112.563 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.6 m -76.74 -22.59 53.62 Favored 'General case' 1 N--CA 1.543 4.22 0 CA-C-N 118.953 1.377 . . . . 0.0 113.588 -176.034 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 554' ' ' ARG . . . . . 0.4 ' O ' HD11 ' B' ' 557' ' ' ILE . 9.7 mpt_? -81.14 -41.9 21.74 Favored 'General case' 0 N--CA 1.538 3.941 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 176.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 555' ' ' VAL . . . . . 0.407 HG22 ' HB2' ' A' ' 22' ' ' PHE . 93.1 t -64.49 -18.54 23.36 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.958 0 O-C-N 121.182 -0.949 . . . . 0.0 108.684 173.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -76.47 -43.45 39.77 Favored 'General case' 0 N--CA 1.522 3.137 0 CA-C-O 116.958 -1.496 . . . . 0.0 111.657 176.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 557' ' ' ILE . . . . . 0.4 HD11 ' O ' ' B' ' 554' ' ' ARG . 0.0 OUTLIER -72.96 -24.01 20.74 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.526 0 CA-C-N 121.938 2.153 . . . . 0.0 110.555 -179.3 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 558' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -82.31 -44.24 19.52 Favored 'Isoleucine or valine' 1 N--CA 1.546 4.336 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 -179.806 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -64.02 -28.78 70.04 Favored 'General case' 0 N--CA 1.528 3.463 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -89.51 -19.34 25.16 Favored 'General case' 0 N--CA 1.525 3.291 0 CA-C-O 118.467 -0.778 . . . . 0.0 110.421 177.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 32.5 tp -76.12 -47.17 25.43 Favored 'General case' 0 N--CA 1.532 3.673 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 1.5 tt -46.98 -33.87 5.07 Favored 'General case' 1 N--CA 1.547 4.385 0 C-N-CA 125.09 1.356 . . . . 0.0 110.972 178.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 19.6 mmm180 -81.4 -58.85 2.85 Favored 'General case' 0 N--CA 1.518 2.973 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 178.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 51.67 37.83 43.05 Favored Glycine 1 N--CA 1.535 5.238 0 C-N-CA 124.322 0.963 . . . . 0.0 112.909 178.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -99.48 -51.8 3.67 Favored 'General case' 0 N--CA 1.519 2.996 0 CA-C-N 117.777 0.789 . . . . 0.0 109.148 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 8.2 ptt? -157.35 44.48 0.36 Allowed 'General case' 0 N--CA 1.53 3.531 0 CA-C-O 121.659 0.742 . . . . 0.0 109.795 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 28.1 m -135.36 37.72 2.93 Favored 'General case' 0 N--CA 1.517 2.922 0 C-N-CA 123.554 0.742 . . . . 0.0 109.793 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -109.84 -54.85 2.51 Favored 'General case' 0 N--CA 1.514 2.741 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -97.37 -43.61 7.23 Favored 'General case' 0 N--CA 1.524 3.272 0 C-N-CA 122.957 0.503 . . . . 0.0 110.998 -179.196 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -79.21 -12.59 59.97 Favored 'General case' 0 N--CA 1.523 3.203 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -177.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 17.9 tp -70.81 -44.11 67.25 Favored 'General case' 0 N--CA 1.532 3.669 0 CA-C-N 119.749 1.159 . . . . 0.0 111.493 -178.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -40.66 -29.6 0.1 Allowed 'General case' 1 N--CA 1.558 4.939 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -179.64 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -69.68 -48.7 58.79 Favored 'General case' 0 N--CA 1.538 3.958 0 CA-C-N 119.04 0.836 . . . . 0.0 109.336 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -55.3 -39.23 69.67 Favored 'General case' 0 N--CA 1.53 3.537 0 C-N-CA 124.908 1.283 . . . . 0.0 112.609 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 42.0 mt -114.34 -60.32 1.9 Allowed 'General case' 0 N--CA 1.53 3.555 0 C-N-CA 122.88 0.472 . . . . 0.0 111.457 -177.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 114.41 28.51 3.0 Favored Glycine 1 N--CA 1.522 4.412 0 CA-C-O 118.495 -1.17 . . . . 0.0 111.307 -178.406 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -101.28 115.94 31.66 Favored 'General case' 0 N--CA 1.517 2.882 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 178.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -38.5 166.26 0.01 OUTLIER Glycine 1 N--CA 1.536 5.358 0 C-N-CA 125.303 1.43 . . . . 0.0 115.414 -177.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -79.78 -17.7 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.963 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 177.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 580' ' ' ALA . . . . . 0.416 ' HB3' ' H62' ' F' ' 15' ' ' ' DA' . . . -65.62 -20.08 66.17 Favored 'General case' 0 N--CA 1.519 3.018 0 CA-C-O 116.996 -1.478 . . . . 0.0 111.192 176.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.2 p -101.59 -35.82 8.99 Favored 'General case' 1 N--CA 1.542 4.152 0 CA-C-N 120.811 1.642 . . . . 0.0 111.208 178.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 2.9 tt -66.51 -39.06 83.03 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.565 0 C-N-CA 123.32 0.648 . . . . 0.0 110.575 -177.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 77.8 p -96.08 -19.58 19.32 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 118.301 -0.857 . . . . 0.0 110.437 178.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 10.5 ttp180 -64.69 -31.3 72.47 Favored 'General case' 1 N--CA 1.549 4.503 0 N-CA-C 106.688 -1.597 . . . . 0.0 106.688 172.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -66.46 -36.96 92.27 Favored Glycine 0 N--CA 1.514 3.835 0 N-CA-C 110.215 -1.154 . . . . 0.0 110.215 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 59.7 p -61.85 -30.14 70.65 Favored 'General case' 1 N--CA 1.55 4.537 0 CA-C-N 118.614 1.207 . . . . 0.0 112.407 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -66.93 -28.8 68.59 Favored 'General case' 0 N--CA 1.539 3.977 0 CA-C-N 118.681 0.673 . . . . 0.0 110.624 178.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 14.9 m -64.04 -34.98 79.25 Favored 'General case' 0 N--CA 1.533 3.721 0 C-N-CA 123.512 0.725 . . . . 0.0 111.692 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 13.4 mt -56.36 -41.73 76.63 Favored 'General case' 0 N--CA 1.536 3.831 0 C-N-CA 123.947 0.899 . . . . 0.0 111.776 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.96 -19.57 65.24 Favored 'General case' 1 N--CA 1.543 4.205 0 CA-C-O 118.359 -0.829 . . . . 0.0 112.787 -179.23 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -108.27 -21.92 12.56 Favored 'General case' 0 N--CA 1.521 3.098 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 -178.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -66.36 160.99 62.06 Favored Pre-proline 0 N--CA 1.538 3.972 0 CA-C-N 119.598 1.09 . . . . 0.0 112.424 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -83.82 148.47 12.31 Favored 'Trans proline' 0 C--N 1.379 2.162 0 C-N-CA 122.272 1.981 . . . . 0.0 108.935 178.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -82.91 -28.03 8.12 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.948 0 CA-C-O 117.858 -1.068 . . . . 0.0 112.045 -178.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -61.88 -37.8 85.91 Favored 'General case' 0 N--CA 1.519 3.013 0 CA-C-N 120.183 1.356 . . . . 0.0 110.513 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 6.9 mp -99.84 -17.86 17.43 Favored 'General case' 0 N--CA 1.513 2.679 0 C-N-CA 123.887 0.875 . . . . 0.0 111.269 179.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.12 -36.65 82.41 Favored 'General case' 1 N--CA 1.545 4.301 0 N-CA-C 103.823 -2.658 . . . . 0.0 103.823 170.022 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -56.92 -39.3 74.21 Favored 'General case' 0 N--CA 1.513 2.714 0 C-N-CA 124.405 1.082 . . . . 0.0 111.79 175.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 599' ' ' TRP . . . . . 0.449 ' HA ' ' HB2' ' B' ' 602' ' ' GLU . 63.6 t90 -63.31 -32.76 74.26 Favored 'General case' 0 N--CA 1.531 3.604 0 CA-C-O 117.832 -1.08 . . . . 0.0 108.331 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 46.5 mt -55.3 -37.94 68.0 Favored 'General case' 1 N--CA 1.541 4.077 0 CA-C-N 119.162 0.892 . . . . 0.0 109.167 176.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -73.05 -30.31 63.63 Favored 'General case' 0 N--CA 1.529 3.48 0 O-C-N 123.935 0.772 . . . . 0.0 109.532 176.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 602' ' ' GLU . . . . . 0.449 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.6 OUTLIER -65.17 -27.4 68.68 Favored 'General case' 1 N--CA 1.542 4.137 0 C-N-CA 123.928 0.891 . . . . 0.0 110.076 175.495 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.21 -4.44 11.01 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.245 0 CA-C-O 118.08 -0.962 . . . . 0.0 112.365 -177.081 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -94.39 -59.68 1.89 Allowed 'General case' 0 N--CA 1.512 2.632 0 N-CA-C 104.349 -2.464 . . . . 0.0 104.349 175.263 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.64 -70.21 0.32 Allowed 'General case' 0 N--CA 1.526 3.367 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 176.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 44.3 tttm 59.37 98.72 0.02 OUTLIER 'General case' 0 N--CA 1.522 3.173 0 C-N-CA 125.289 1.436 . . . . 0.0 111.489 178.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 39.3 p . . . . . 0 N--CA 1.526 3.346 0 CA-C-O 118.45 -0.786 . . . . 0.0 109.444 179.739 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.075 0 CA-C-O 118.402 -0.808 . . . . 0.0 108.866 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.506 2.332 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.87 3 O4'-C1'-N19 119.377 14.471 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.882 4 O4'-C1'-N19 120.472 15.84 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.423 -9.494 3 O4'-C1'-N19 120.346 15.683 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . 0.457 ' H61' HG23 ' B' ' 579' ' ' ILE . . . . . . . . 5 C3'--C2' 1.419 -9.93 4 O4'-C1'-N19 119.789 14.986 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' E' E ' 5' ' ' ' DC' . . . . . 0.502 ' H41' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 5 O3'--C3' 1.567 10.464 3 O4'-C1'-N19 118.581 13.476 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.409 -10.891 3 O4'-C1'-N19 119.521 14.652 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' E' E ' 7' ' ' ' DA' . . . . . 0.593 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.398 -12.045 4 C4'-C3'-C2' 111.885 8.685 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' E' E ' 8' ' ' ' DG' . . . . . 0.593 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.416 -10.167 4 O4'-C1'-N19 119.903 15.128 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.932 6 O4'-C1'-N19 119.322 14.403 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.705 2 O4'-C1'-N19 119.383 14.479 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.413 -10.456 4 O4'-C1'-N19 121.152 16.69 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.759 5 O4'-C1'-N19 119.287 14.359 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.407 -11.097 3 O4'-C1'-N19 119.907 15.133 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' E' E ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.117 3 C4'-C3'-C2' 117.11 13.91 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' E' E ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -10.005 7 O4'-C1'-N19 119.469 14.587 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.419 -9.876 5 O4'-C1'-N19 119.704 14.88 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.564 10.195 3 O4'-C1'-N19 120.113 15.391 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.412 -10.592 4 O4'-C1'-N19 120.57 15.963 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.463 5 O4'-C1'-N19 120.047 15.308 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.512 7.104 4 O4'-C1'-N19 119.477 14.596 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.564 10.202 3 C4'-C3'-C2' 117.089 13.889 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.37 3 O4'-C1'-N19 119.553 14.691 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.41 -10.842 5 O4'-C1'-N19 119.907 15.134 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' F' F ' 4' ' ' ' DA' . . . . . 0.442 ' N6 ' HG22 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.418 -10.027 3 O4'-C1'-N19 119.859 15.074 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' F' F ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.782 5 O4'-C1'-N19 118.726 13.658 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.407 -11.142 3 O4'-C1'-N19 120.241 15.552 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.412 -11.606 4 N19-C1'-C2' 129.658 9.661 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.427 -9.135 3 O4'-C1'-N19 119.228 14.285 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.574 10.989 4 O4'-C1'-N19 119.134 14.167 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.413 -10.496 3 O4'-C1'-N19 119.169 14.211 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.416 -10.15 5 O4'-C1'-N19 120.547 15.934 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.058 2 O4'-C1'-N19 119.931 15.164 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.581 11.564 5 O4'-C1'-N19 118.39 13.238 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' F' F ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.37 3 O4'-C1'-N19 119.004 14.005 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' F' F ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.33 6 O4'-C1'-N19 119.905 15.132 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.415 -10.283 4 O4'-C1'-N19 119.712 14.89 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.33 4 O4'-C1'-N19 119.376 14.47 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.177 2 O4'-C1'-N19 120.052 15.315 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -10.964 5 O4'-C1'-N19 118.894 13.867 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 O4'--C1' 1.517 7.433 5 O4'-C1'-N19 119.89 15.113 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 . . . . . 0 N--CA 1.506 2.362 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.9 t -144.46 143.42 21.72 Favored Pre-proline 0 N--CA 1.521 3.086 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.973 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -66.32 135.91 41.61 Favored 'Trans proline' 0 C--N 1.388 2.651 0 C-N-CA 123.128 2.552 . . . . 0.0 112.078 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -112.4 144.34 42.0 Favored 'General case' 0 N--CA 1.529 3.512 0 C-N-CA 123.6 0.76 . . . . 0.0 110.47 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 66.5 m 64.9 133.48 0.02 OUTLIER 'General case' 1 N--CA 1.542 4.127 0 C-N-CA 124.582 1.153 . . . . 0.0 111.18 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -147.18 130.83 16.88 Favored 'General case' 0 N--CA 1.522 3.142 0 C-N-CA 122.744 0.418 . . . . 0.0 110.357 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -115.57 136.18 53.33 Favored 'General case' 0 N--CA 1.526 3.344 0 C-N-CA 123.176 0.59 . . . . 0.0 110.464 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 3.7 mpp? -103.93 -50.94 3.26 Favored 'General case' 0 N--CA 1.52 3.074 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 179.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -138.71 -61.44 0.58 Allowed 'General case' 0 N--CA 1.523 3.175 0 C-N-CA 122.983 0.513 . . . . 0.0 109.655 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 64.63 134.44 0.02 OUTLIER 'General case' 0 N--CA 1.532 3.666 0 C-N-CA 124.752 1.221 . . . . 0.0 111.867 179.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 7.8 mm100 -142.47 116.59 9.45 Favored 'General case' 0 N--CA 1.521 3.109 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.45 133.91 0.01 OUTLIER 'General case' 0 N--CA 1.539 3.988 0 C-N-CA 125.166 1.386 . . . . 0.0 111.65 -179.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.4 t-160 -167.46 -40.23 0.02 OUTLIER 'General case' 0 N--CA 1.534 3.731 0 CA-C-O 118.614 -0.708 . . . . 0.0 112.638 -178.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -76.18 -35.49 59.1 Favored 'General case' 0 N--CA 1.534 3.76 0 N-CA-C 114.792 1.404 . . . . 0.0 114.792 -174.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -103.91 -96.04 0.32 Allowed 'General case' 0 N--CA 1.532 3.664 0 CA-C-N 120.316 1.416 . . . . 0.0 111.95 -177.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.609 ' HA ' HD21 ' B' ' 551' ' ' LEU . 64.8 t-105 -49.07 -42.53 39.02 Favored 'General case' 0 N--CA 1.527 3.415 0 CA-C-N 119.629 1.104 . . . . 0.0 112.919 -177.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.401 ' N ' ' CD2' ' A' ' 20' ' ' LEU . 2.3 mm? -81.2 -24.7 37.29 Favored 'General case' 0 N--CA 1.528 3.451 0 CA-C-O 117.595 -1.193 . . . . 0.0 112.859 -175.007 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -61.38 -29.53 69.97 Favored 'General case' 0 N--CA 1.532 3.675 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 173.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.407 ' CG ' HD22 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -85.24 -29.76 24.39 Favored 'General case' 0 N--CA 1.519 3.004 0 CA-C-O 116.203 -1.856 . . . . 0.0 109.723 174.913 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 86.1 t -72.79 -31.01 34.84 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.239 0 CA-C-N 121.908 2.14 . . . . 0.0 111.315 -177.289 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -73.82 -49.68 24.04 Favored 'General case' 0 N--CA 1.532 3.633 0 CA-C-N 119.335 0.97 . . . . 0.0 108.5 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.0 mp -70.15 -18.56 63.22 Favored 'General case' 0 N--CA 1.531 3.611 0 CA-C-O 119.515 -0.279 . . . . 0.0 110.323 176.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.09 -33.65 65.72 Favored 'General case' 0 N--CA 1.526 3.33 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 175.256 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -64.51 -22.49 66.98 Favored 'General case' 0 N--CA 1.521 3.084 0 CA-C-O 118.502 -0.761 . . . . 0.0 110.849 175.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -72.51 -46.03 56.56 Favored 'General case' 0 N--CA 1.534 3.757 0 CA-C-N 119.114 0.87 . . . . 0.0 108.864 177.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.93 -10.09 59.76 Favored 'General case' 0 N--CA 1.51 2.537 0 CA-C-O 118.645 -0.693 . . . . 0.0 110.988 178.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -81.01 -34.83 32.6 Favored 'General case' 0 N--CA 1.53 3.565 0 CA-C-N 119.995 1.27 . . . . 0.0 109.061 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -61.4 -40.81 95.74 Favored 'General case' 0 N--CA 1.534 3.757 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 177.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -94.38 -88.66 0.24 Allowed 'General case' 0 N--CA 1.512 2.66 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 177.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.7 p30 151.63 53.32 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.871 0 C-N-CA 127.737 2.415 . . . . 0.0 107.795 177.072 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.5 mt -112.91 9.86 18.91 Favored 'General case' 0 N--CA 1.529 3.518 0 C-N-CA 124.176 0.99 . . . . 0.0 111.246 -178.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.46 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 53.7 p-80 -82.4 4.57 23.56 Favored 'General case' 0 N--CA 1.516 2.827 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 174.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.476 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 19.7 mt -93.75 -52.13 0.25 Allowed Pre-proline 0 N--CA 1.511 2.577 0 CA-C-O 116.892 -1.527 . . . . 0.0 108.689 -176.133 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.476 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 3.5 Cg_exo -65.38 -31.07 52.86 Favored 'Trans proline' 0 C--N 1.392 2.839 0 N-CA-C 106.615 -2.11 . . . . 0.0 106.615 170.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.46 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.1 OUTLIER -65.67 -37.95 87.93 Favored 'General case' 0 N--CA 1.522 3.141 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 175.823 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.46 -19.44 60.95 Favored 'General case' 1 N--CA 1.545 4.295 0 CA-C-N 119.826 1.194 . . . . 0.0 111.083 176.708 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -88.56 9.14 24.97 Favored 'General case' 0 N--CA 1.528 3.445 0 CA-C-N 119.099 0.863 . . . . 0.0 110.785 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -127.33 -49.35 1.42 Allowed 'General case' 0 N--CA 1.522 3.14 0 CA-C-N 119.494 1.043 . . . . 0.0 111.188 -178.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.53 -18.25 27.01 Favored 'General case' 1 N--CA 1.541 4.118 0 CA-C-N 120.113 1.324 . . . . 0.0 112.182 -178.275 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.2 mp -111.86 -87.69 0.54 Allowed 'General case' 0 N--CA 1.501 2.102 0 CA-C-O 117.833 -1.079 . . . . 0.0 108.294 -179.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 160.33 166.62 0.04 OUTLIER Pre-proline 1 N--CA 1.557 4.883 0 C-N-CA 125.148 1.379 . . . . 0.0 109.452 -179.193 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -68.62 -36.64 14.16 Favored 'Trans proline' 0 N--CA 1.512 2.575 0 C-N-CA 122.322 2.015 . . . . 0.0 107.723 173.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -62.52 -23.15 66.81 Favored 'General case' 0 N--CA 1.53 3.561 0 C-N-CA 123.953 0.901 . . . . 0.0 110.533 176.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -71.88 -35.54 69.81 Favored 'General case' 0 N--CA 1.521 3.096 0 CA-C-O 117.539 -1.22 . . . . 0.0 109.772 178.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.8 ptt180 -81.04 -19.2 44.37 Favored 'General case' 1 N--CA 1.539 4.001 0 CA-C-N 119.905 1.23 . . . . 0.0 108.519 174.067 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -68.91 -30.95 69.54 Favored 'General case' 0 N--CA 1.528 3.431 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 173.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -88.57 -29.53 19.95 Favored 'General case' 0 N--CA 1.514 2.735 0 CA-C-O 117.739 -1.124 . . . . 0.0 110.74 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 26.7 tp -73.72 -21.26 60.28 Favored 'General case' 1 N--CA 1.539 4.013 0 CA-C-N 120.875 1.67 . . . . 0.0 106.69 173.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.43 -67.3 1.9 Allowed Glycine 0 N--CA 1.501 3.021 0 C-N-CA 125.26 1.41 . . . . 0.0 110.768 177.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.0 m -67.96 -27.46 66.61 Favored 'General case' 0 N--CA 1.532 3.669 0 CA-C-O 118.102 -0.952 . . . . 0.0 112.366 -178.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 17.1 mtm180 -70.52 -48.01 57.63 Favored 'General case' 0 N--CA 1.531 3.581 0 CA-C-N 119.594 1.088 . . . . 0.0 108.526 178.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.3 t -67.97 -15.71 20.06 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.074 0 O-C-N 120.742 -1.224 . . . . 0.0 109.618 174.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 66.4 mtt-85 -78.25 -42.94 29.64 Favored 'General case' 0 N--CA 1.53 3.557 0 CA-C-N 120.213 1.369 . . . . 0.0 111.565 178.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -24.32 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.6 0 CA-C-N 121.533 1.969 . . . . 0.0 110.379 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -86.94 -51.21 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.928 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 -179.549 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -58.86 -25.14 63.01 Favored 'General case' 0 N--CA 1.536 3.851 0 CA-C-O 118.96 -0.543 . . . . 0.0 110.2 177.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -96.62 -20.94 17.94 Favored 'General case' 0 N--CA 1.525 3.32 0 CA-C-O 118.1 -0.953 . . . . 0.0 111.073 178.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 5.3 mt -73.56 -55.4 6.35 Favored 'General case' 0 N--CA 1.539 3.978 0 CA-C-N 119.799 1.181 . . . . 0.0 108.232 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 42.4 mt -50.58 -30.92 14.41 Favored 'General case' 1 N--CA 1.543 4.2 0 C-N-CA 124.099 0.96 . . . . 0.0 112.434 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 28.6 mmm180 -82.97 -45.52 14.0 Favored 'General case' 0 N--CA 1.525 3.32 0 CA-C-N 118.213 0.46 . . . . 0.0 110.169 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.68 59.34 5.26 Favored Glycine 1 N--CA 1.522 4.383 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -116.36 -52.64 2.57 Favored 'General case' 0 N--CA 1.521 3.104 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 14.0 ptm -162.92 79.86 0.48 Allowed 'General case' 0 N--CA 1.529 3.516 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 96.1 p -133.87 1.62 3.32 Favored 'General case' 0 N--CA 1.518 2.956 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 -176.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -113.93 -63.99 1.37 Allowed 'General case' 0 N--CA 1.532 3.64 0 CA-C-N 120.212 1.369 . . . . 0.0 111.323 -178.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 15.5 mtt180 -103.99 -41.48 5.84 Favored 'General case' 0 N--CA 1.533 3.698 0 CA-C-N 118.525 0.602 . . . . 0.0 110.639 -178.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -74.65 -5.79 45.03 Favored 'General case' 0 N--CA 1.515 2.791 0 CA-C-O 118.389 -0.815 . . . . 0.0 112.82 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 35.2 tp -93.89 -49.5 5.78 Favored 'General case' 0 N--CA 1.527 3.398 0 CA-C-N 120.064 1.302 . . . . 0.0 113.094 -177.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -44.94 -29.46 0.83 Allowed 'General case' 1 N--CA 1.546 4.351 0 CA-C-N 120.026 1.284 . . . . 0.0 114.003 -177.54 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 15.9 t30 -80.48 -38.31 30.14 Favored 'General case' 0 N--CA 1.531 3.621 0 CA-C-O 119.02 -0.514 . . . . 0.0 112.022 -178.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -53.37 -58.83 5.71 Favored 'General case' 0 N--CA 1.532 3.655 0 N-CA-C 114.077 1.139 . . . . 0.0 114.077 -177.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.95 -39.31 2.73 Favored 'General case' 0 N--CA 1.538 3.948 0 CA-C-N 118.993 0.815 . . . . 0.0 111.808 -178.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 125.11 86.05 0.64 Allowed Glycine 1 N--CA 1.523 4.477 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -149.97 104.82 3.33 Favored 'General case' 0 N--CA 1.522 3.146 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 178.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -45.31 169.07 0.03 OUTLIER Glycine 1 N--CA 1.54 5.617 0 C-N-CA 124.268 0.937 . . . . 0.0 114.389 -177.34 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.442 HG22 ' N6 ' ' F' ' 4' ' ' ' DA' . 1.8 mt -80.35 -13.72 12.98 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.759 0 CA-C-N 119.055 1.427 . . . . 0.0 109.613 179.119 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.38 -37.26 74.51 Favored 'General case' 0 N--CA 1.524 3.249 0 CA-C-N 120.025 1.284 . . . . 0.0 110.491 177.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 3.2 p -78.97 -44.88 21.49 Favored 'General case' 0 N--CA 1.535 3.809 0 CA-C-N 119.296 0.953 . . . . 0.0 111.563 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.5 pt -70.41 -14.72 18.41 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.873 0 CA-C-O 117.658 -1.163 . . . . 0.0 114.09 -176.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 66.7 p -111.68 -35.78 5.66 Favored 'General case' 0 N--CA 1.517 2.925 0 CA-C-N 120.132 1.333 . . . . 0.0 110.134 178.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -70.17 -23.92 63.06 Favored 'General case' 0 N--CA 1.529 3.515 0 CA-C-N 119.04 0.837 . . . . 0.0 109.357 176.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.26 -32.66 84.51 Favored Glycine 1 N--CA 1.522 4.38 0 N-CA-C 109.336 -1.505 . . . . 0.0 109.336 175.58 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.7 t -70.46 -34.19 72.14 Favored 'General case' 0 N--CA 1.532 3.65 0 CA-C-N 118.146 0.973 . . . . 0.0 110.467 177.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -65.83 -22.78 66.57 Favored 'General case' 0 N--CA 1.535 3.806 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.66 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.1 m -67.38 -37.18 82.76 Favored 'General case' 0 N--CA 1.531 3.624 0 CA-C-N 118.611 0.641 . . . . 0.0 110.539 179.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.0 mt -55.12 -51.79 65.32 Favored 'General case' 0 N--CA 1.525 3.31 0 C-N-CA 124.292 1.037 . . . . 0.0 112.362 -179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 6.7 ptpt -68.46 -9.28 47.68 Favored 'General case' 0 N--CA 1.536 3.84 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 -178.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.23 -44.81 10.59 Favored 'General case' 0 N--CA 1.521 3.089 0 CA-C-N 119.675 1.125 . . . . 0.0 110.262 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.69 167.03 1.11 Allowed Pre-proline 1 N--CA 1.546 4.374 0 CA-C-O 117.861 -1.066 . . . . 0.0 112.088 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -74.31 -179.93 5.23 Favored 'Trans proline' 0 C--N 1.384 2.446 0 C-N-CA 121.055 1.17 . . . . 0.0 110.951 178.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.7 t -102.23 -30.07 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.91 0 CA-C-O 117.506 -1.235 . . . . 0.0 111.683 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -63.02 -40.92 99.21 Favored 'General case' 0 N--CA 1.517 2.907 0 CA-C-N 119.952 1.251 . . . . 0.0 110.839 -177.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.0 mp -97.84 -20.08 17.73 Favored 'General case' 0 N--CA 1.512 2.649 0 C-N-CA 123.417 0.687 . . . . 0.0 111.445 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.59 -28.63 67.92 Favored 'General case' 0 N--CA 1.536 3.866 0 N-CA-C 103.798 -2.668 . . . . 0.0 103.798 169.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -56.76 -39.84 74.76 Favored 'General case' 0 N--CA 1.515 2.822 0 C-N-CA 124.179 0.991 . . . . 0.0 110.046 173.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.414 ' HA ' ' HB2' ' A' ' 102' ' ' GLU . 54.5 t90 -64.66 -34.69 78.89 Favored 'General case' 0 N--CA 1.524 3.267 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.15 -37.57 47.05 Favored 'General case' 1 N--CA 1.542 4.174 0 CA-C-N 119.279 0.945 . . . . 0.0 108.514 175.589 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -69.11 -40.34 78.41 Favored 'General case' 1 N--CA 1.539 4.021 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 175.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.414 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 2.9 mt-10 -58.78 -22.86 59.2 Favored 'General case' 1 N--CA 1.549 4.5 0 C-N-CA 123.499 0.72 . . . . 0.0 111.031 175.893 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -116.44 -2.65 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.508 0 CA-C-O 118.193 -0.908 . . . . 0.0 112.056 -176.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.31 -57.36 2.28 Favored 'General case' 0 N--CA 1.515 2.814 0 N-CA-C 104.176 -2.527 . . . . 0.0 104.176 174.645 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 47.2 mt -65.35 -44.41 87.78 Favored 'General case' 0 N--CA 1.535 3.804 0 C-N-CA 124.935 1.294 . . . . 0.0 109.411 175.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 42.9 tttm 90.37 -45.39 0.02 OUTLIER 'General case' 1 N--CA 1.541 4.076 0 C-N-CA 126.454 1.902 . . . . 0.0 110.226 -179.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 38.2 p . . . . . 0 N--CA 1.526 3.373 0 CA-C-O 118.556 -0.735 . . . . 0.0 110.089 179.789 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 . . . . . 0 N--CA 1.502 2.154 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 37.3 p -72.9 145.65 86.81 Favored Pre-proline 0 N--CA 1.532 3.634 0 CA-C-O 118.025 -0.988 . . . . 0.0 111.695 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -71.63 131.18 18.2 Favored 'Trans proline' 0 C--N 1.387 2.599 0 C-N-CA 122.829 2.353 . . . . 0.0 111.576 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -86.59 133.88 33.68 Favored 'General case' 0 N--CA 1.528 3.437 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 178.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 7.8 m 74.92 111.71 0.07 Allowed 'General case' 0 N--CA 1.538 3.932 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -107.83 144.26 35.26 Favored 'General case' 0 N--CA 1.526 3.34 0 C-N-CA 123.028 0.531 . . . . 0.0 111.671 -178.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -123.65 145.66 48.79 Favored 'General case' 0 N--CA 1.524 3.263 0 C-N-CA 123.494 0.718 . . . . 0.0 110.752 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 60.2 mtt -76.97 120.7 22.45 Favored 'General case' 0 N--CA 1.526 3.33 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 178.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -131.2 129.6 41.9 Favored 'General case' 0 N--CA 1.515 2.777 0 C-N-CA 122.719 0.408 . . . . 0.0 110.444 -178.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -112.67 -47.59 3.06 Favored 'General case' 0 N--CA 1.514 2.762 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -117.99 -23.96 7.24 Favored 'General case' 0 N--CA 1.528 3.437 0 CA-C-O 118.149 -0.929 . . . . 0.0 112.329 -179.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 6.7 mmt180 -67.5 151.29 47.61 Favored 'General case' 1 N--CA 1.54 4.051 0 CA-C-N 119.632 1.105 . . . . 0.0 112.328 -179.025 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 4.3 t-80 84.48 -57.36 0.11 Allowed 'General case' 1 N--CA 1.539 4.009 0 C-N-CA 125.894 1.678 . . . . 0.0 110.173 179.135 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -79.12 116.8 19.63 Favored 'General case' 0 N--CA 1.522 3.169 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 179.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -146.64 -82.35 0.13 Allowed 'General case' 0 N--CA 1.527 3.422 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 519' ' ' TRP . . . . . 0.417 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 60.7 t-105 -44.33 -26.32 0.32 Allowed 'General case' 1 N--CA 1.551 4.603 0 C-N-CA 124.188 0.995 . . . . 0.0 113.236 178.216 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 520' ' ' LEU . . . . . 0.407 ' CD2' ' N ' ' B' ' 520' ' ' LEU . 2.4 mm? -95.39 -32.18 13.05 Favored 'General case' 0 N--CA 1.523 3.212 0 CA-C-O 117.655 -1.164 . . . . 0.0 113.815 -172.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -63.83 -23.28 67.29 Favored 'General case' 0 N--CA 1.529 3.495 0 N-CA-C 106.047 -1.834 . . . . 0.0 106.047 172.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . 0.417 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.7 m-85 -77.93 -42.06 34.33 Favored 'General case' 0 N--CA 1.505 2.302 0 N-CA-C 106.555 -1.646 . . . . 0.0 106.555 174.082 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 79.0 t -67.34 -20.27 26.41 Favored 'Isoleucine or valine' 1 N--CA 1.563 5.194 0 CA-C-O 117.665 -1.159 . . . . 0.0 112.374 179.008 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -77.15 -54.39 6.58 Favored 'General case' 0 N--CA 1.533 3.713 0 CA-C-N 120.37 1.441 . . . . 0.0 108.43 -178.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 5.1 mp -70.96 -17.42 62.66 Favored 'General case' 0 N--CA 1.527 3.416 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 175.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.08 -38.32 78.95 Favored 'General case' 0 N--CA 1.516 2.828 0 N-CA-C 107.162 -1.421 . . . . 0.0 107.162 175.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 527' ' ' LYS . . . . . 0.635 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 8.4 tptm -68.85 -19.9 64.27 Favored 'General case' 0 N--CA 1.516 2.87 0 CA-C-O 118.029 -0.986 . . . . 0.0 111.473 176.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -66.95 -38.56 86.36 Favored 'General case' 1 N--CA 1.541 4.122 0 CA-C-N 119.798 1.181 . . . . 0.0 108.325 174.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 529' ' ' ALA . . . . . 0.422 ' HB2' ' N ' ' B' ' 535' ' ' HIS . . . -89.37 -14.35 35.77 Favored 'General case' 0 N--CA 1.504 2.272 0 CA-C-O 118.52 -0.752 . . . . 0.0 111.012 177.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 530' ' ' TYR . . . . . 0.635 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.7 OUTLIER -75.9 -32.02 59.46 Favored 'General case' 0 N--CA 1.538 3.974 0 CA-C-N 120.098 1.317 . . . . 0.0 109.683 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -65.09 -44.24 89.5 Favored 'General case' 0 N--CA 1.534 3.755 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 177.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -90.63 -87.47 0.19 Allowed 'General case' 0 N--CA 1.518 2.928 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 177.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.8 p30 152.71 52.88 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.827 0 C-N-CA 127.406 2.282 . . . . 0.0 108.025 177.222 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 5.6 mt -111.45 9.38 21.37 Favored 'General case' 0 N--CA 1.529 3.485 0 C-N-CA 124.718 1.207 . . . . 0.0 110.858 -178.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 535' ' ' HIS . . . . . 0.422 ' N ' ' HB2' ' B' ' 529' ' ' ALA . 47.9 p-80 -83.82 1.66 41.98 Favored 'General case' 0 N--CA 1.517 2.879 0 C-N-CA 123.501 0.72 . . . . 0.0 109.499 175.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 536' ' ' LEU . . . . . 0.427 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 42.8 mt -95.17 -51.01 0.24 Allowed Pre-proline 0 N--CA 1.497 1.878 0 CA-C-O 116.507 -1.711 . . . . 0.0 108.488 -176.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 537' ' ' PRO . . . . . 0.427 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 4.5 Cg_exo -66.94 -33.73 31.91 Favored 'Trans proline' 0 C--N 1.394 2.943 0 N-CA-C 107.51 -1.765 . . . . 0.0 107.51 172.096 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.16 -44.14 93.04 Favored 'General case' 0 N--CA 1.522 3.165 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 175.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 43.3 mt -76.5 -11.38 59.87 Favored 'General case' 0 N--CA 1.535 3.804 0 CA-C-O 118.183 -0.913 . . . . 0.0 112.41 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -83.96 -0.66 52.41 Favored 'General case' 0 N--CA 1.526 3.343 0 CA-C-N 119.56 1.073 . . . . 0.0 109.428 174.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -114.46 -50.09 2.81 Favored 'General case' 0 N--CA 1.51 2.536 0 C-N-CA 124.979 1.312 . . . . 0.0 108.416 -179.312 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 4.7 ptm -95.85 7.55 46.02 Favored 'General case' 0 N--CA 1.534 3.738 0 CA-C-O 118.266 -0.874 . . . . 0.0 112.89 -178.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -130.39 -102.14 0.3 Allowed 'General case' 0 N--CA 1.531 3.612 0 CA-C-N 120.274 1.397 . . . . 0.0 113.187 -179.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 165.04 156.38 0.08 OUTLIER Pre-proline 1 N--CA 1.571 5.621 0 CA-C-N 121.425 1.921 . . . . 0.0 110.562 -178.118 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -74.11 -45.7 0.35 Allowed 'Trans proline' 0 C--N 1.388 2.615 0 C-N-CA 123.194 2.596 . . . . 0.0 110.076 177.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -56.33 -28.22 58.3 Favored 'General case' 1 N--CA 1.54 4.037 0 CA-C-O 118.759 -0.639 . . . . 0.0 112.025 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -75.61 -34.66 60.6 Favored 'General case' 0 N--CA 1.524 3.228 0 CA-C-O 117.766 -1.111 . . . . 0.0 110.927 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 9.5 ptt-85 -71.95 -28.55 63.53 Favored 'General case' 0 N--CA 1.534 3.768 0 CA-C-N 119.902 1.228 . . . . 0.0 109.909 177.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -64.29 -48.61 75.02 Favored 'General case' 1 N--CA 1.54 4.048 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 175.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -76.83 -8.91 58.22 Favored 'General case' 0 N--CA 1.52 3.064 0 CA-C-O 118.155 -0.926 . . . . 0.0 111.398 177.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 551' ' ' LEU . . . . . 0.609 HD21 ' HA ' ' A' ' 19' ' ' TRP . 4.2 tp -78.88 -40.38 32.54 Favored 'General case' 0 N--CA 1.519 3.02 0 CA-C-N 120.141 1.337 . . . . 0.0 108.143 176.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -73.85 -42.47 38.18 Favored Glycine 0 N--CA 1.513 3.797 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 3.3 m -71.38 -35.45 71.09 Favored 'General case' 0 N--CA 1.532 3.633 0 CA-C-N 117.612 0.706 . . . . 0.0 110.878 -178.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -67.54 -45.68 74.98 Favored 'General case' 0 N--CA 1.537 3.883 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 177.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 44.0 t -66.55 -17.87 23.22 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.059 0 CA-C-O 117.703 -1.141 . . . . 0.0 109.622 175.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -81.83 -40.08 23.03 Favored 'General case' 0 N--CA 1.519 2.985 0 CA-C-O 116.943 -1.503 . . . . 0.0 111.703 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 557' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.02 -23.82 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.31 0 CA-C-N 122.277 2.308 . . . . 0.0 109.955 179.057 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 558' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -85.56 -48.0 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.981 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -61.93 -22.46 65.63 Favored 'General case' 0 N--CA 1.532 3.626 0 CA-C-O 118.801 -0.619 . . . . 0.0 109.856 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -87.79 -29.98 20.59 Favored 'General case' 0 N--CA 1.522 3.159 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 13.5 mt -66.4 -46.58 76.1 Favored 'General case' 1 N--CA 1.542 4.144 0 CA-C-N 118.9 0.773 . . . . 0.0 109.305 178.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 33.1 mt -54.41 -27.02 33.95 Favored 'General case' 0 N--CA 1.537 3.906 0 C-N-CA 123.685 0.794 . . . . 0.0 111.762 178.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 1.9 mmm-85 -79.78 -52.07 8.39 Favored 'General case' 0 N--CA 1.526 3.348 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 59.62 72.07 0.67 Allowed Glycine 1 N--CA 1.527 4.728 0 CA-C-O 119.341 -0.699 . . . . 0.0 112.833 178.001 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -145.76 -56.31 0.3 Allowed 'General case' 0 N--CA 1.525 3.305 0 N-CA-C 108.558 -0.905 . . . . 0.0 108.558 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 46.2 mtt -144.59 61.41 1.33 Allowed 'General case' 0 N--CA 1.526 3.363 0 N-CA-C 106.174 -1.787 . . . . 0.0 106.174 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 65.0 m -131.12 4.26 4.41 Favored 'General case' 0 N--CA 1.52 3.027 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -175.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -96.03 -80.15 0.43 Allowed 'General case' 0 N--CA 1.524 3.241 0 CA-C-N 119.81 1.186 . . . . 0.0 110.28 -179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.62 -34.3 11.0 Favored 'General case' 0 N--CA 1.539 3.996 0 CA-C-N 119.578 1.081 . . . . 0.0 111.515 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -70.45 -10.1 58.25 Favored 'General case' 0 N--CA 1.518 2.971 0 CA-C-O 118.358 -0.83 . . . . 0.0 112.793 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 14.8 tp -89.6 -43.67 10.61 Favored 'General case' 0 N--CA 1.527 3.395 0 CA-C-N 119.767 1.167 . . . . 0.0 111.106 -178.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -38.48 -32.31 0.07 Allowed 'General case' 1 N--CA 1.558 4.939 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 -178.96 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -74.27 -46.95 38.08 Favored 'General case' 0 N--CA 1.529 3.507 0 CA-C-N 118.183 0.447 . . . . 0.0 110.278 -179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -46.81 -45.8 20.31 Favored 'General case' 0 N--CA 1.534 3.769 0 C-N-CA 124.94 1.296 . . . . 0.0 113.891 -178.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 1.8 pp -132.39 -44.04 0.93 Allowed 'General case' 0 N--CA 1.535 3.813 0 CA-C-N 118.68 0.673 . . . . 0.0 112.067 -178.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 109.69 81.65 1.28 Allowed Glycine 1 N--CA 1.525 4.603 0 N-CA-C 110.975 -0.85 . . . . 0.0 110.975 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -111.06 -50.99 2.9 Favored 'General case' 0 N--CA 1.522 3.161 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 114.16 163.36 14.74 Favored Glycine 1 N--CA 1.528 4.787 0 N-CA-C 110.219 -1.152 . . . . 0.0 110.219 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 579' ' ' ILE . . . . . 0.502 HG21 ' H41' ' E' ' 5' ' ' ' DC' . 0.6 OUTLIER -82.9 -21.02 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.377 0 CA-C-N 119.54 1.67 . . . . 0.0 108.229 177.828 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -68.88 -54.58 14.78 Favored 'General case' 0 N--CA 1.519 2.979 0 CA-C-N 119.578 1.081 . . . . 0.0 109.57 177.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -69.26 -36.75 77.43 Favored 'General case' 1 N--CA 1.539 4.018 0 CA-C-N 118.662 0.665 . . . . 0.0 112.699 -179.026 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 2.1 tt -64.3 -38.18 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.874 0 CA-C-N 118.543 0.61 . . . . 0.0 110.682 -177.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 80.6 p -98.98 -8.75 24.97 Favored 'General case' 0 N--CA 1.509 2.499 0 CA-C-O 118.604 -0.712 . . . . 0.0 111.023 178.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 10.3 ttp180 -72.95 -36.95 67.26 Favored 'General case' 0 N--CA 1.538 3.934 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 174.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -63.32 -38.44 96.44 Favored Glycine 1 N--CA 1.52 4.288 0 N-CA-C 109.075 -1.61 . . . . 0.0 109.075 176.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 19.6 m -58.75 -41.23 86.03 Favored 'General case' 1 N--CA 1.543 4.186 0 C-N-CA 123.217 0.607 . . . . 0.0 111.196 178.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -63.39 -32.47 73.9 Favored 'General case' 1 N--CA 1.539 4.009 0 C-N-CA 123.268 0.627 . . . . 0.0 111.026 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 15.7 m -68.2 -42.05 80.46 Favored 'General case' 0 N--CA 1.534 3.735 0 C-N-CA 123.059 0.544 . . . . 0.0 109.833 178.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 22.1 mt -58.9 -41.06 86.32 Favored 'General case' 0 N--CA 1.53 3.535 0 C-N-CA 124.387 1.075 . . . . 0.0 111.601 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -65.62 -27.08 68.13 Favored 'General case' 0 N--CA 1.539 3.979 0 CA-C-O 118.575 -0.726 . . . . 0.0 112.427 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -95.49 -25.0 16.4 Favored 'General case' 0 N--CA 1.523 3.195 0 CA-C-O 118.524 -0.751 . . . . 0.0 112.606 -179.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -61.59 164.31 9.78 Favored Pre-proline 0 N--CA 1.537 3.903 0 CA-C-N 119.132 0.878 . . . . 0.0 111.758 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -77.48 146.91 24.88 Favored 'Trans proline' 0 C--N 1.381 2.26 0 C-N-CA 121.751 1.634 . . . . 0.0 108.84 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 594' ' ' VAL . . . . . 0.461 ' HA ' ' HB3' ' B' ' 597' ' ' ARG . 2.8 t -80.95 -25.55 10.78 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.826 0 CA-C-O 117.514 -1.232 . . . . 0.0 112.64 -177.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -63.74 -38.42 91.02 Favored 'General case' 0 N--CA 1.519 3.003 0 CA-C-N 120.386 1.448 . . . . 0.0 110.783 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 6.8 mp -99.68 -18.01 17.49 Favored 'General case' 0 N--CA 1.513 2.689 0 C-N-CA 123.958 0.903 . . . . 0.0 111.064 179.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . 0.461 ' HB3' ' HA ' ' B' ' 594' ' ' VAL . 0.0 OUTLIER -63.66 -32.49 73.99 Favored 'General case' 1 N--CA 1.547 4.376 0 N-CA-C 103.635 -2.728 . . . . 0.0 103.635 168.69 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -59.19 -38.77 80.65 Favored 'General case' 0 N--CA 1.521 3.116 0 C-N-CA 125.081 1.352 . . . . 0.0 110.835 174.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 599' ' ' TRP . . . . . . . . . . . . . 48.0 t90 -59.4 -34.48 72.5 Favored 'General case' 0 N--CA 1.535 3.776 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 75.6 mt -52.91 -39.86 63.1 Favored 'General case' 0 N--CA 1.539 3.998 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 177.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -70.73 -33.31 70.71 Favored 'General case' 0 N--CA 1.529 3.478 0 O-C-N 123.927 0.767 . . . . 0.0 109.399 176.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -61.71 -23.68 66.28 Favored 'General case' 1 N--CA 1.546 4.374 0 C-N-CA 123.473 0.709 . . . . 0.0 109.858 174.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -117.7 10.47 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.708 0 C-N-CA 123.766 0.826 . . . . 0.0 112.352 -177.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -115.36 -57.82 2.2 Favored 'General case' 0 N--CA 1.512 2.634 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 177.334 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 4.9 tt -54.4 -55.7 26.1 Favored 'General case' 0 N--CA 1.539 3.996 0 C-N-CA 125.281 1.432 . . . . 0.0 111.689 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -76.77 -57.93 3.57 Favored 'General case' 0 N--CA 1.529 3.521 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 7.4 t . . . . . 0 N--CA 1.528 3.432 0 CA-C-O 118.132 -0.937 . . . . 0.0 110.385 179.897 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.007 0 CA-C-O 117.495 -1.241 . . . . 0.0 109.052 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.16 0 CA-C-O 118.322 -0.846 . . . . 0.0 108.739 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.425 -9.282 2 C4'-C3'-C2' 117.254 14.054 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.429 -8.885 4 O4'-C1'-N19 119.553 14.691 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.424 -9.445 3 O4'-C1'-N19 119.053 14.066 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . 0.405 ' H61' HG22 ' B' ' 579' ' ' ILE . . . . . . . . 5 C3'--C2' 1.413 -10.475 2 O4'-C1'-N19 119.344 14.429 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' E' E ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.791 5 O4'-C1'-N19 118.883 13.854 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 O3'--C3' 1.566 10.368 5 O4'-C1'-N19 119.335 14.419 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' E' E ' 7' ' ' ' DA' . . . . . 0.584 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.395 -12.281 4 C4'-C3'-C2' 112.0 8.8 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' E' E ' 8' ' ' ' DG' . . . . . 0.584 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 5 O3'--C3' 1.551 9.223 4 O4'-C1'-N19 119.504 14.629 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.632 6 C4'-C3'-C2' 116.726 13.526 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.404 -11.401 2 O4'-C1'-N19 119.991 15.238 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.418 -9.996 4 O4'-C1'-N19 120.96 16.45 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.262 4 O4'-C1'-N19 119.241 14.301 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.427 -9.104 4 O4'-C1'-N19 118.54 13.425 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' E' E ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.218 3 O4'-C1'-N19 119.019 14.024 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' E' E ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.476 6 O4'-C1'-N19 119.466 14.583 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.416 -10.177 4 O4'-C1'-N19 120.13 15.412 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.564 10.21 2 O4'-C1'-N19 120.336 15.671 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.42 4 O4'-C1'-N19 120.349 15.686 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.206 5 O4'-C1'-N19 119.786 14.982 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.515 7.301 3 O4'-C1'-N19 119.847 15.059 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.571 3 C4'-C3'-C2' 117.046 13.846 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.404 -11.431 6 O4'-C1'-N19 119.449 14.561 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.642 3 O4'-C1'-N19 120.382 15.727 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' F' F ' 4' ' ' ' DA' . . . . . 0.506 ' N6 ' HG23 ' A' ' 79' ' ' ILE . . . . . . . . 5 C3'--C2' 1.415 -10.293 4 O4'-C1'-N19 120.301 15.626 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' F' F ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.57 10.674 4 O4'-C1'-N19 118.409 13.261 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.402 -11.561 3 O4'-C1'-N19 119.186 14.233 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.413 -11.464 4 N19-C1'-C2' 130.051 9.907 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.416 -10.225 4 O4'-C1'-N19 119.85 15.062 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.568 10.522 3 O4'-C1'-N19 120.047 15.308 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.379 5 O4'-C1'-N19 118.534 13.418 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.179 4 O4'-C1'-N19 121.376 16.97 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.419 -9.923 3 O4'-C1'-N19 118.836 13.795 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -9.995 4 O4'-C1'-N19 119.152 14.189 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' F' F ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.675 6 O4'-C1'-N19 118.396 13.245 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' F' F ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.419 -9.864 5 O4'-C1'-N19 119.822 15.028 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.417 -10.122 4 O4'-C1'-N19 120.115 15.394 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.234 2 O4'-C1'-N19 119.539 14.674 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.478 5 O4'-C1'-N19 118.528 13.41 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.416 -10.166 4 O4'-C1'-N19 119.309 14.386 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.515 7.295 4 O4'-C1'-N19 119.06 14.075 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 . . . . . 0 N--CA 1.498 1.967 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 67.5 p -128.12 99.39 25.07 Favored Pre-proline 0 N--CA 1.518 2.957 0 CA-C-O 118.628 -0.701 . . . . 0.0 110.058 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -75.29 130.09 12.67 Favored 'Trans proline' 0 C--N 1.391 2.774 0 C-N-CA 122.866 2.377 . . . . 0.0 109.785 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -82.06 127.75 33.41 Favored 'General case' 0 N--CA 1.525 3.289 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 68.0 m -151.84 123.37 7.85 Favored 'General case' 0 N--CA 1.52 3.062 0 C-N-CA 122.673 0.389 . . . . 0.0 110.103 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 64.48 135.49 0.02 OUTLIER 'General case' 0 N--CA 1.538 3.942 0 C-N-CA 124.74 1.216 . . . . 0.0 111.875 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -153.09 -45.57 0.1 Allowed 'General case' 0 N--CA 1.523 3.2 0 C-N-CA 122.743 0.417 . . . . 0.0 111.136 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 25.4 ttp 70.46 140.26 0.04 OUTLIER 'General case' 0 N--CA 1.539 3.984 0 C-N-CA 124.384 1.074 . . . . 0.0 110.364 -179.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -118.5 134.0 55.42 Favored 'General case' 0 N--CA 1.516 2.848 0 C-N-CA 123.221 0.608 . . . . 0.0 110.802 -179.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -88.89 -55.44 3.69 Favored 'General case' 0 N--CA 1.524 3.259 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -128.18 149.19 50.55 Favored 'General case' 0 N--CA 1.522 3.164 0 C-N-CA 123.465 0.706 . . . . 0.0 109.754 178.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -97.66 -46.05 6.14 Favored 'General case' 0 N--CA 1.523 3.195 0 CA-C-O 119.026 -0.512 . . . . 0.0 110.276 -179.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 24.1 t60 -100.11 124.31 45.36 Favored 'General case' 0 N--CA 1.523 3.196 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -105.81 128.62 53.84 Favored 'General case' 0 N--CA 1.52 3.066 0 C-N-CA 123.555 0.742 . . . . 0.0 109.233 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -127.75 -67.63 0.81 Allowed 'General case' 0 N--CA 1.519 2.988 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.551 ' CE3' ' HG ' ' B' ' 551' ' ' LEU . 71.2 t-105 -52.31 -25.19 8.93 Favored 'General case' 0 N--CA 1.538 3.931 0 CA-C-O 118.083 -0.961 . . . . 0.0 111.794 177.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -90.2 -30.76 17.38 Favored 'General case' 0 N--CA 1.53 3.573 0 CA-C-O 118.253 -0.88 . . . . 0.0 112.153 -176.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.06 -27.47 68.92 Favored 'General case' 0 N--CA 1.534 3.735 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 173.452 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.538 ' HB3' HD22 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -88.28 -28.5 21.04 Favored 'General case' 0 N--CA 1.511 2.62 0 CA-C-O 116.359 -1.782 . . . . 0.0 108.245 174.968 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 69.5 t -72.15 -22.89 21.26 Favored 'Isoleucine or valine' 1 N--CA 1.567 5.393 0 CA-C-N 122.241 2.291 . . . . 0.0 111.045 179.286 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -77.93 -51.46 10.37 Favored 'General case' 0 N--CA 1.53 3.536 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 178.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.61 -27.79 69.48 Favored 'General case' 0 N--CA 1.536 3.83 0 O-C-N 123.267 0.354 . . . . 0.0 110.609 176.555 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.95 -33.25 63.84 Favored 'General case' 0 N--CA 1.524 3.274 0 CA-C-O 118.214 -0.898 . . . . 0.0 109.033 177.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -68.98 -24.09 64.19 Favored 'General case' 0 N--CA 1.524 3.261 0 CA-C-O 118.378 -0.82 . . . . 0.0 110.74 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -73.44 -43.32 60.61 Favored 'General case' 0 N--CA 1.533 3.722 0 CA-C-N 119.166 0.894 . . . . 0.0 108.893 177.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.453 ' HB2' ' N ' ' A' ' 35' ' ' HIS . . . -85.85 -8.64 57.94 Favored 'General case' 0 N--CA 1.508 2.463 0 CA-C-O 118.314 -0.85 . . . . 0.0 110.71 178.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -80.16 -27.45 39.0 Favored 'General case' 0 N--CA 1.53 3.55 0 CA-C-N 120.032 1.287 . . . . 0.0 107.672 177.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -62.53 -48.84 77.76 Favored 'General case' 0 N--CA 1.531 3.602 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 176.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -91.82 -89.92 0.18 Allowed 'General case' 0 N--CA 1.514 2.738 0 N-CA-C 106.29 -1.744 . . . . 0.0 106.29 177.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 p30 156.18 50.16 0.0 OUTLIER 'General case' 1 N--CA 1.555 4.805 0 C-N-CA 127.489 2.316 . . . . 0.0 107.809 177.493 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.7 mt -107.05 10.36 30.29 Favored 'General case' 0 N--CA 1.53 3.525 0 C-N-CA 124.644 1.178 . . . . 0.0 110.606 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.491 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 42.2 p-80 -85.06 5.14 30.8 Favored 'General case' 0 N--CA 1.507 2.38 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 175.3 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.438 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 26.5 mt -93.95 -51.47 0.26 Allowed Pre-proline 0 N--CA 1.506 2.361 0 CA-C-O 116.8 -1.572 . . . . 0.0 108.773 -176.13 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.438 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 4.0 Cg_exo -65.57 -34.5 41.96 Favored 'Trans proline' 0 C--N 1.397 3.13 0 N-CA-C 106.1 -2.308 . . . . 0.0 106.1 170.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.491 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.3 OUTLIER -63.27 -37.7 88.26 Favored 'General case' 0 N--CA 1.518 2.938 0 C-N-CA 124.078 0.951 . . . . 0.0 109.337 176.363 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.43 -25.89 62.51 Favored 'General case' 1 N--CA 1.551 4.579 0 CA-C-N 120.06 1.3 . . . . 0.0 110.186 176.945 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -72.36 -19.28 61.65 Favored 'General case' 0 N--CA 1.526 3.354 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.366 177.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.5 pp -101.48 -46.32 5.02 Favored 'General case' 0 N--CA 1.53 3.527 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 -177.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 6.2 ptp -105.23 -2.29 24.28 Favored 'General case' 1 N--CA 1.54 4.05 0 CA-C-O 117.994 -1.003 . . . . 0.0 112.332 -176.259 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.43 -87.01 0.53 Allowed 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 117.843 -1.075 . . . . 0.0 109.065 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 154.55 163.4 0.0 OUTLIER Pre-proline 1 N--CA 1.564 5.256 0 C-N-CA 125.71 1.604 . . . . 0.0 109.888 179.672 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -71.84 -36.59 6.02 Favored 'Trans proline' 0 C--N 1.383 2.36 0 C-N-CA 122.827 2.351 . . . . 0.0 108.033 173.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -70.43 -16.61 62.96 Favored 'General case' 0 N--CA 1.525 3.288 0 CA-C-O 117.928 -1.034 . . . . 0.0 110.536 176.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -71.57 -35.25 70.52 Favored 'General case' 0 N--CA 1.527 3.415 0 CA-C-N 119.629 1.104 . . . . 0.0 108.364 176.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 10.1 ptt180 -85.5 -19.23 31.51 Favored 'General case' 0 N--CA 1.527 3.405 0 CA-C-O 118.477 -0.773 . . . . 0.0 109.549 175.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -70.01 -33.0 71.45 Favored 'General case' 0 N--CA 1.534 3.727 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 174.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -88.7 -31.56 18.41 Favored 'General case' 0 N--CA 1.506 2.359 0 CA-C-O 117.719 -1.134 . . . . 0.0 110.094 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.487 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 12.3 tp -70.58 -23.28 62.56 Favored 'General case' 0 N--CA 1.535 3.818 0 CA-C-N 120.856 1.662 . . . . 0.0 107.588 175.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.97 -69.97 1.31 Allowed Glycine 0 N--CA 1.502 3.089 0 C-N-CA 124.802 1.191 . . . . 0.0 111.181 176.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.9 m -67.09 -24.7 65.97 Favored 'General case' 1 N--CA 1.542 4.145 0 CA-C-N 117.897 0.848 . . . . 0.0 112.505 -177.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 84.0 mtt180 -70.0 -50.51 40.87 Favored 'General case' 0 N--CA 1.527 3.401 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 176.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 23.1 t -63.53 -17.77 20.73 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.103 0 CA-C-O 118.073 -0.965 . . . . 0.0 110.209 175.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 57.4 mtt-85 -70.8 -56.36 6.5 Favored 'General case' 0 N--CA 1.528 3.427 0 CA-C-N 119.635 1.107 . . . . 0.0 111.09 177.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.76 -24.48 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.91 0 CA-C-N 119.871 1.214 . . . . 0.0 112.202 -177.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -83.26 -48.91 17.17 Favored 'Isoleucine or valine' 1 N--CA 1.55 4.531 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 -179.803 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -63.13 -21.78 66.42 Favored 'General case' 0 N--CA 1.528 3.458 0 CA-C-O 118.693 -0.67 . . . . 0.0 110.418 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -90.65 -23.76 20.68 Favored 'General case' 0 N--CA 1.529 3.505 0 CA-C-O 118.137 -0.935 . . . . 0.0 110.27 177.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 14.5 tp -81.57 -53.09 6.55 Favored 'General case' 0 N--CA 1.522 3.132 0 CA-C-N 119.515 1.052 . . . . 0.0 109.12 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 28.9 mt -48.12 -29.58 3.76 Favored 'General case' 1 N--CA 1.541 4.117 0 C-N-CA 124.99 1.316 . . . . 0.0 112.96 -178.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 19.5 mmm-85 -89.98 -42.24 11.28 Favored 'General case' 0 N--CA 1.528 3.447 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.07 85.37 0.76 Allowed Glycine 0 N--CA 1.513 3.783 0 N-CA-C 110.071 -1.211 . . . . 0.0 110.071 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -156.7 -57.56 0.09 Allowed 'General case' 0 N--CA 1.521 3.103 0 CA-C-N 117.398 0.599 . . . . 0.0 110.546 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 36.1 mtt -139.49 80.65 1.79 Allowed 'General case' 0 N--CA 1.513 2.675 0 CA-C-O 121.976 0.893 . . . . 0.0 108.939 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.3 t -135.53 2.92 3.0 Favored 'General case' 0 N--CA 1.525 3.299 0 CA-C-N 115.582 -0.735 . . . . 0.0 112.747 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -120.41 -77.88 0.59 Allowed 'General case' 0 N--CA 1.525 3.322 0 CA-C-N 119.912 1.233 . . . . 0.0 113.147 -178.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -103.53 -44.21 5.18 Favored 'General case' 0 N--CA 1.53 3.556 0 CA-C-N 119.336 0.971 . . . . 0.0 112.019 -176.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -71.81 -9.8 58.83 Favored 'General case' 0 N--CA 1.513 2.703 0 CA-C-O 117.761 -1.114 . . . . 0.0 112.553 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 24.4 tp -80.79 -52.24 7.74 Favored 'General case' 0 N--CA 1.523 3.223 0 CA-C-N 120.185 1.357 . . . . 0.0 112.273 -178.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -43.81 -30.87 0.72 Allowed 'General case' 1 N--CA 1.547 4.414 0 CA-C-N 119.353 0.979 . . . . 0.0 113.358 -177.809 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -82.28 -38.66 24.07 Favored 'General case' 0 N--CA 1.527 3.377 0 CA-C-O 118.795 -0.621 . . . . 0.0 111.551 -178.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -47.34 -56.77 6.21 Favored 'General case' 1 N--CA 1.539 4.004 0 C-N-CA 124.365 1.066 . . . . 0.0 113.155 -178.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -124.03 -43.35 2.1 Favored 'General case' 0 N--CA 1.534 3.747 0 CA-C-O 118.777 -0.63 . . . . 0.0 111.088 -179.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 128.9 76.8 0.19 Allowed Glycine 1 N--CA 1.521 4.31 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -140.12 114.22 9.02 Favored 'General case' 0 N--CA 1.52 3.072 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 178.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -47.06 171.43 0.03 OUTLIER Glycine 1 N--CA 1.542 5.748 0 C-N-CA 124.202 0.906 . . . . 0.0 113.781 -178.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.506 HG23 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.9 OUTLIER -81.7 -18.77 11.27 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.684 0 CA-C-N 118.871 1.336 . . . . 0.0 108.404 178.473 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.39 -45.78 78.85 Favored 'General case' 0 N--CA 1.52 3.036 0 CA-C-N 119.972 1.26 . . . . 0.0 110.774 177.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -72.57 -39.31 67.53 Favored 'General case' 0 N--CA 1.536 3.83 0 CA-C-N 119.335 0.97 . . . . 0.0 112.524 -178.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.1 pt -71.33 -26.03 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.968 0 CA-C-N 119.255 0.934 . . . . 0.0 111.541 -179.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 73.1 p -102.2 -4.69 25.38 Favored 'General case' 0 N--CA 1.517 2.895 0 CA-C-N 119.125 0.875 . . . . 0.0 110.228 174.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -80.13 -33.02 38.95 Favored 'General case' 0 N--CA 1.533 3.689 0 N-CA-C 105.506 -2.035 . . . . 0.0 105.506 172.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -66.57 -28.59 73.83 Favored Glycine 1 N--CA 1.524 4.543 0 CA-C-O 118.407 -1.219 . . . . 0.0 110.634 176.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 90.7 p -64.21 -21.03 66.42 Favored 'General case' 1 N--CA 1.542 4.174 0 CA-C-N 119.015 1.407 . . . . 0.0 111.339 177.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -55.33 -23.42 23.69 Favored 'General case' 1 N--CA 1.544 4.244 0 CA-C-N 118.659 0.663 . . . . 0.0 110.549 176.055 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 78.5 p -45.33 -48.79 13.19 Favored 'General case' 1 N--CA 1.546 4.358 0 C-N-CA 125.709 1.603 . . . . 0.0 111.743 178.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.9 mt -67.69 -39.67 84.41 Favored 'General case' 0 N--CA 1.522 3.169 0 C-N-CA 124.195 0.998 . . . . 0.0 110.703 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.15 0.25 55.59 Favored 'General case' 0 N--CA 1.53 3.566 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -178.285 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -125.04 -61.88 1.26 Allowed 'General case' 0 N--CA 1.523 3.215 0 CA-C-N 120.218 1.372 . . . . 0.0 110.449 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.1 161.6 6.89 Favored Pre-proline 1 N--CA 1.54 4.066 0 C-N-CA 123.755 0.822 . . . . 0.0 113.146 -179.467 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.403 ' O ' ' HB2' ' A' ' 97' ' ' ARG . 41.3 Cg_endo -80.73 -179.14 4.92 Favored 'Trans proline' 0 C--N 1.38 2.214 0 C-N-CA 121.886 1.724 . . . . 0.0 110.437 178.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.1 t -99.67 -27.23 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.283 0 CA-C-O 117.864 -1.065 . . . . 0.0 111.65 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -61.73 -39.81 92.86 Favored 'General case' 0 N--CA 1.522 3.144 0 CA-C-N 119.989 1.268 . . . . 0.0 111.035 -178.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.6 mp -97.77 -18.11 18.98 Favored 'General case' 0 N--CA 1.511 2.624 0 C-N-CA 123.882 0.873 . . . . 0.0 110.817 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -62.37 -37.66 86.58 Favored 'General case' 1 N--CA 1.544 4.256 0 N-CA-C 103.826 -2.657 . . . . 0.0 103.826 168.725 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -53.83 -39.66 65.74 Favored 'General case' 0 N--CA 1.516 2.828 0 C-N-CA 125.102 1.361 . . . . 0.0 111.289 174.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 45.7 t90 -59.54 -36.59 76.43 Favored 'General case' 0 N--CA 1.533 3.703 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 44.3 mt -53.11 -40.2 63.98 Favored 'General case' 1 N--CA 1.546 4.35 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 176.502 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -68.85 -34.4 75.42 Favored 'General case' 0 N--CA 1.526 3.332 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 176.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -61.45 -25.42 67.22 Favored 'General case' 1 N--CA 1.548 4.433 0 C-N-CA 123.655 0.782 . . . . 0.0 110.051 174.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -116.79 6.14 7.2 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.34 0 C-N-CA 124.147 0.979 . . . . 0.0 112.093 -177.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 29.2 mt -112.68 -61.56 1.71 Allowed 'General case' 0 N--CA 1.521 3.098 0 N-CA-C 106.091 -1.818 . . . . 0.0 106.091 176.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.4 tp -49.73 -36.83 26.92 Favored 'General case' 0 N--CA 1.535 3.794 0 C-N-CA 125.138 1.375 . . . . 0.0 111.787 178.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.2 ttmp? -94.44 -57.38 2.51 Favored 'General case' 0 N--CA 1.52 3.06 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 68.5 m . . . . . 0 N--CA 1.526 3.335 0 CA-C-O 118.114 -0.946 . . . . 0.0 109.879 -179.83 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 . . . . . 0 N--CA 1.503 2.209 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 44.5 p -153.19 142.0 14.36 Favored Pre-proline 0 N--CA 1.529 3.481 0 CA-C-O 117.485 -1.245 . . . . 0.0 111.304 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -72.15 138.37 30.55 Favored 'Trans proline' 0 C--N 1.388 2.632 0 C-N-CA 122.557 2.171 . . . . 0.0 110.948 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 65.45 132.29 0.02 OUTLIER 'General case' 0 N--CA 1.538 3.963 0 C-N-CA 124.688 1.195 . . . . 0.0 110.896 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 8.0 t -80.83 131.25 35.37 Favored 'General case' 0 N--CA 1.525 3.298 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -77.97 -48.18 16.83 Favored 'General case' 0 N--CA 1.526 3.331 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . 66.46 128.9 0.02 OUTLIER 'General case' 0 N--CA 1.535 3.823 0 C-N-CA 124.567 1.147 . . . . 0.0 110.503 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 16.8 ptt? -111.76 -34.43 6.03 Favored 'General case' 0 N--CA 1.531 3.612 0 C-N-CA 123.249 0.619 . . . . 0.0 111.676 -179.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . 68.48 124.98 0.03 OUTLIER 'General case' 0 N--CA 1.536 3.849 0 C-N-CA 124.401 1.08 . . . . 0.0 109.711 -178.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -102.82 133.56 47.68 Favored 'General case' 0 N--CA 1.526 3.34 0 C-N-CA 122.873 0.469 . . . . 0.0 110.226 -178.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -88.5 121.37 30.82 Favored 'General case' 0 N--CA 1.524 3.264 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 178.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 48.5 mtp180 -103.28 -41.68 5.97 Favored 'General case' 0 N--CA 1.525 3.285 0 CA-C-O 118.646 -0.693 . . . . 0.0 111.51 -177.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 50.8 m-70 -142.43 131.06 22.59 Favored 'General case' 0 N--CA 1.528 3.461 0 CA-C-N 118.772 0.715 . . . . 0.0 110.033 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -98.14 -72.28 0.66 Allowed 'General case' 0 N--CA 1.519 2.979 0 CA-C-O 118.588 -0.72 . . . . 0.0 110.119 -179.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -149.18 -65.81 0.22 Allowed 'General case' 0 N--CA 1.52 3.043 0 CA-C-N 118.984 0.811 . . . . 0.0 110.976 -178.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 519' ' ' TRP . . . . . . . . . . . . . 69.0 t-105 -36.37 -55.28 0.82 Allowed 'General case' 1 N--CA 1.55 4.552 0 C-N-CA 124.951 1.3 . . . . 0.0 114.033 -176.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 520' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -73.85 -24.76 59.81 Favored 'General case' 0 N--CA 1.533 3.709 0 CA-C-O 117.275 -1.345 . . . . 0.0 114.518 -175.347 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.65 -25.71 64.96 Favored 'General case' 0 N--CA 1.534 3.752 0 N-CA-C 105.626 -1.99 . . . . 0.0 105.626 172.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . 0.487 ' CD2' ' HG ' ' A' ' 51' ' ' LEU . 3.2 m-85 -76.46 -35.25 58.56 Favored 'General case' 0 N--CA 1.515 2.814 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 172.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 80.1 t -69.09 -19.24 23.58 Favored 'Isoleucine or valine' 1 N--CA 1.55 4.526 0 CA-C-O 117.599 -1.191 . . . . 0.0 111.025 176.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -73.23 -52.53 13.7 Favored 'General case' 0 N--CA 1.535 3.81 0 CA-C-N 120.614 1.552 . . . . 0.0 107.985 -179.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 5.4 mp -67.98 -23.88 65.08 Favored 'General case' 0 N--CA 1.531 3.619 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 175.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.1 -34.17 77.04 Favored 'General case' 0 N--CA 1.522 3.138 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 175.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -69.31 -26.84 64.93 Favored 'General case' 0 N--CA 1.518 2.958 0 CA-C-O 118.297 -0.858 . . . . 0.0 110.385 176.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -67.98 -37.16 81.17 Favored 'General case' 0 N--CA 1.534 3.758 0 CA-C-N 119.125 0.875 . . . . 0.0 109.16 176.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 529' ' ' ALA . . . . . 0.427 ' HB2' ' N ' ' B' ' 535' ' ' HIS . . . -91.62 -8.74 46.4 Favored 'General case' 0 CA--C 1.582 2.187 0 CA-C-O 118.369 -0.825 . . . . 0.0 110.476 178.048 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.11 -33.62 33.16 Favored 'General case' 0 N--CA 1.533 3.716 0 CA-C-N 120.468 1.486 . . . . 0.0 108.977 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -62.14 -44.43 96.65 Favored 'General case' 0 N--CA 1.535 3.808 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 177.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 -89.74 -86.72 0.19 Allowed 'General case' 0 N--CA 1.522 3.148 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 177.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.9 p30 151.7 48.79 0.0 OUTLIER 'General case' 1 N--CA 1.559 5.023 0 C-N-CA 127.426 2.291 . . . . 0.0 108.688 177.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 6.5 mt -108.45 12.54 26.13 Favored 'General case' 0 N--CA 1.524 3.273 0 C-N-CA 124.665 1.186 . . . . 0.0 110.276 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 535' ' ' HIS . . . . . 0.427 ' N ' ' HB2' ' B' ' 529' ' ' ALA . 46.9 p-80 -83.93 4.38 29.88 Favored 'General case' 0 N--CA 1.516 2.829 0 C-N-CA 123.595 0.758 . . . . 0.0 109.076 175.362 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 536' ' ' LEU . . . . . 0.433 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 35.5 mt -97.12 -49.61 0.23 Allowed Pre-proline 0 N--CA 1.506 2.365 0 CA-C-O 116.526 -1.702 . . . . 0.0 109.125 -175.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 537' ' ' PRO . . . . . 0.433 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 2.9 Cg_exo -67.69 -34.38 25.12 Favored 'Trans proline' 0 C--N 1.394 2.963 0 C-N-CA 122.386 2.057 . . . . 0.0 107.417 171.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.78 -47.12 79.3 Favored 'General case' 0 N--CA 1.523 3.185 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 176.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 76.4 mt -77.67 -6.59 54.39 Favored 'General case' 0 N--CA 1.533 3.71 0 CA-C-O 118.702 -0.666 . . . . 0.0 111.228 178.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -63.76 -30.65 71.73 Favored 'General case' 0 N--CA 1.532 3.648 0 CA-C-N 119.584 1.084 . . . . 0.0 109.52 176.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -104.31 -50.9 3.23 Favored 'General case' 0 N--CA 1.509 2.489 0 CA-C-O 118.63 -0.7 . . . . 0.0 109.942 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 9.9 ptp -82.51 17.91 1.64 Allowed 'General case' 0 N--CA 1.533 3.698 0 CA-C-N 118.938 0.79 . . . . 0.0 112.859 -177.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 7.6 tp -138.85 -73.71 0.39 Allowed 'General case' 0 N--CA 1.528 3.428 0 CA-C-N 119.674 1.124 . . . . 0.0 111.542 174.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 66.5 p 116.73 152.82 0.0 OUTLIER Pre-proline 1 N--CA 1.571 5.591 0 C-N-CA 127.947 2.499 . . . . 0.0 111.02 -179.178 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -69.57 -40.91 5.03 Favored 'Trans proline' 0 C--N 1.396 3.052 0 C-N-CA 123.027 2.485 . . . . 0.0 110.04 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -57.9 -29.47 65.11 Favored 'General case' 1 N--CA 1.543 4.195 0 C-N-CA 123.422 0.689 . . . . 0.0 110.773 178.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -75.05 -36.54 61.82 Favored 'General case' 0 N--CA 1.521 3.116 0 CA-C-O 118.279 -0.867 . . . . 0.0 108.744 177.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 35.3 ptt180 -83.26 3.7 30.13 Favored 'General case' 0 N--CA 1.531 3.623 0 CA-C-N 118.993 0.815 . . . . 0.0 111.036 174.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -85.09 -48.96 8.67 Favored 'General case' 0 N--CA 1.519 2.99 0 N-CA-C 102.663 -3.088 . . . . 0.0 102.663 170.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -77.52 -11.91 59.91 Favored 'General case' 0 N--CA 1.504 2.253 0 CA-C-O 116.947 -1.501 . . . . 0.0 112.357 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 551' ' ' LEU . . . . . 0.551 ' HG ' ' CE3' ' A' ' 19' ' ' TRP . 0.0 OUTLIER -75.32 -39.02 59.91 Favored 'General case' 1 N--CA 1.54 4.032 0 CA-C-N 121.559 1.982 . . . . 0.0 106.457 174.682 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -66.6 -56.23 14.16 Favored Glycine 0 N--CA 1.495 2.629 0 N-CA-C 109.021 -1.632 . . . . 0.0 109.021 -178.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.6 m -64.57 -30.52 71.55 Favored 'General case' 1 N--CA 1.542 4.141 0 CA-C-O 118.495 -0.764 . . . . 0.0 112.302 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -65.97 -52.93 45.17 Favored 'General case' 1 N--CA 1.545 4.306 0 N-CA-C 107.184 -1.413 . . . . 0.0 107.184 177.126 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 28.1 t -64.15 -18.51 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.738 0 CA-C-O 117.88 -1.057 . . . . 0.0 110.176 177.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -79.42 -43.6 23.04 Favored 'General case' 0 N--CA 1.529 3.498 0 CA-C-O 117.554 -1.213 . . . . 0.0 111.499 179.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 557' ' ' ILE . . . . . 0.419 HD11 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -73.46 -23.89 19.89 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.248 0 CA-C-N 121.017 1.735 . . . . 0.0 110.678 -179.701 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 558' ' ' VAL . . . . . 0.419 ' N ' HD11 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -84.33 -50.62 14.87 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.809 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -179.444 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -61.34 -23.54 65.82 Favored 'General case' 0 N--CA 1.532 3.646 0 CA-C-O 118.797 -0.621 . . . . 0.0 110.049 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -96.89 -20.35 18.2 Favored 'General case' 0 N--CA 1.525 3.321 0 CA-C-O 117.541 -1.218 . . . . 0.0 111.757 179.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 3.3 pp -88.8 -33.39 17.44 Favored 'General case' 0 N--CA 1.538 3.961 0 CA-C-N 120.59 1.541 . . . . 0.0 110.102 179.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 1.1 tt -58.54 -36.57 74.07 Favored 'General case' 0 N--CA 1.537 3.906 0 C-N-CA 124.15 0.98 . . . . 0.0 110.301 178.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 11.8 mmm-85 -74.36 -52.25 12.72 Favored 'General case' 0 N--CA 1.532 3.644 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 70.76 89.09 0.1 OUTLIER Glycine 0 N--CA 1.513 3.81 0 CA-C-O 119.512 -0.604 . . . . 0.0 112.991 176.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -148.25 -54.23 0.2 Allowed 'General case' 0 N--CA 1.525 3.303 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 14.5 ptm -148.2 61.87 1.11 Allowed 'General case' 0 N--CA 1.525 3.297 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 6.8 t -123.84 1.47 8.72 Favored 'General case' 0 N--CA 1.522 3.153 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -88.17 -71.56 0.57 Allowed 'General case' 0 N--CA 1.522 3.131 0 CA-C-N 119.754 1.161 . . . . 0.0 110.67 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.53 -19.89 12.38 Favored 'General case' 0 N--CA 1.536 3.845 0 CA-C-O 118.338 -0.839 . . . . 0.0 112.36 -179.214 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -83.98 -7.7 59.34 Favored 'General case' 0 N--CA 1.518 2.957 0 CA-C-N 119.245 0.929 . . . . 0.0 113.251 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 60.6 tp -89.69 -50.02 6.31 Favored 'General case' 0 N--CA 1.535 3.811 0 CA-C-N 120.313 1.415 . . . . 0.0 113.635 -177.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -36.18 -33.56 0.04 OUTLIER 'General case' 1 N--CA 1.548 4.475 0 N-CA-C 116.173 1.916 . . . . 0.0 116.173 -175.03 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -66.21 -44.63 83.32 Favored 'General case' 1 N--CA 1.543 4.186 0 CA-C-N 118.724 0.693 . . . . 0.0 109.816 -179.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -62.78 -43.46 98.75 Favored 'General case' 0 N--CA 1.523 3.192 0 C-N-CA 124.77 1.228 . . . . 0.0 112.282 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 51.0 mt -102.68 -64.45 1.07 Allowed 'General case' 0 N--CA 1.533 3.685 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -176.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 101.86 45.43 1.77 Allowed Glycine 0 N--CA 1.512 3.745 0 N-CA-C 108.494 -1.843 . . . . 0.0 108.494 -176.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -93.44 -37.08 12.15 Favored 'General case' 0 N--CA 1.527 3.41 0 CA-C-N 117.475 0.637 . . . . 0.0 110.329 179.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 109.48 164.56 20.01 Favored Glycine 1 N--CA 1.523 4.456 0 N-CA-C 110.0 -1.24 . . . . 0.0 110.0 -178.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 579' ' ' ILE . . . . . 0.405 HG22 ' H61' ' E' ' 4' ' ' ' DA' . 1.9 mt -84.69 -16.88 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.719 0 CA-C-N 119.227 1.514 . . . . 0.0 108.36 177.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -69.66 -39.56 76.99 Favored 'General case' 0 N--CA 1.524 3.249 0 CA-C-N 119.874 1.215 . . . . 0.0 109.159 176.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 2.6 p -74.78 -40.55 61.1 Favored 'General case' 0 N--CA 1.537 3.879 0 CA-C-N 118.449 0.568 . . . . 0.0 111.527 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 2.8 tt -66.12 -37.35 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.518 0 C-N-CA 123.243 0.617 . . . . 0.0 112.336 -175.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 80.5 p -95.92 -33.12 12.3 Favored 'General case' 0 N--CA 1.515 2.812 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.221 -178.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -71.31 -21.57 62.05 Favored 'General case' 0 N--CA 1.529 3.509 0 CA-C-N 119.188 0.904 . . . . 0.0 109.333 176.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -69.37 -33.31 72.67 Favored Glycine 1 N--CA 1.517 4.052 0 N-CA-C 108.784 -1.726 . . . . 0.0 108.784 174.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 37.5 m -63.5 -39.34 94.2 Favored 'General case' 1 N--CA 1.544 4.234 0 CA-C-N 118.376 1.088 . . . . 0.0 110.166 177.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -60.13 -27.88 67.42 Favored 'General case' 1 N--CA 1.543 4.217 0 C-N-CA 123.614 0.766 . . . . 0.0 111.314 178.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 73.7 m -58.88 -44.73 91.2 Favored 'General case' 0 N--CA 1.537 3.914 0 C-N-CA 123.771 0.828 . . . . 0.0 111.57 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 33.5 mt -57.44 -42.65 82.87 Favored 'General case' 0 N--CA 1.528 3.457 0 C-N-CA 123.862 0.865 . . . . 0.0 111.127 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.54 -26.38 68.54 Favored 'General case' 1 N--CA 1.541 4.084 0 CA-C-O 118.638 -0.696 . . . . 0.0 111.889 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -76.54 -42.84 41.56 Favored 'General case' 0 N--CA 1.518 2.949 0 CA-C-N 118.598 0.635 . . . . 0.0 110.522 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -62.64 159.54 42.38 Favored Pre-proline 0 N--CA 1.536 3.844 0 CA-C-O 118.386 -0.816 . . . . 0.0 111.863 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -78.83 -176.46 3.3 Favored 'Trans proline' 0 C--N 1.377 2.059 0 C-N-CA 121.63 1.554 . . . . 0.0 110.981 178.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.4 t -96.68 -29.86 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.95 0 CA-C-O 117.8 -1.095 . . . . 0.0 111.099 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -65.83 -38.25 88.39 Favored 'General case' 0 N--CA 1.515 2.808 0 CA-C-N 119.63 1.104 . . . . 0.0 110.03 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 6.7 mp -98.51 -18.33 18.24 Favored 'General case' 0 N--CA 1.511 2.579 0 C-N-CA 123.776 0.831 . . . . 0.0 111.27 178.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.52 -30.14 69.73 Favored 'General case' 0 N--CA 1.535 3.783 0 N-CA-C 103.124 -2.917 . . . . 0.0 103.124 167.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -55.34 -38.87 69.31 Favored 'General case' 0 N--CA 1.518 2.942 0 C-N-CA 123.859 0.863 . . . . 0.0 110.174 173.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 599' ' ' TRP . . . . . 0.427 ' HA ' ' HB2' ' B' ' 602' ' ' GLU . 50.5 t90 -62.17 -37.39 85.04 Favored 'General case' 0 N--CA 1.527 3.388 0 CA-C-O 117.75 -1.119 . . . . 0.0 108.168 178.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 11.2 mp -54.19 -38.17 65.33 Favored 'General case' 1 N--CA 1.542 4.165 0 CA-C-N 119.226 0.921 . . . . 0.0 108.638 176.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -71.1 -32.53 69.15 Favored 'General case' 0 N--CA 1.531 3.624 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 176.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 602' ' ' GLU . . . . . 0.427 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 2.2 mm-40 -64.4 -22.17 66.87 Favored 'General case' 1 N--CA 1.544 4.265 0 C-N-CA 123.687 0.795 . . . . 0.0 110.133 174.899 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -121.05 3.45 6.51 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.495 0 C-N-CA 123.807 0.843 . . . . 0.0 112.295 -177.521 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -110.91 -56.95 2.3 Favored 'General case' 0 N--CA 1.514 2.761 0 N-CA-C 105.774 -1.936 . . . . 0.0 105.774 176.307 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 2.5 tt -63.42 -57.56 9.89 Favored 'General case' 0 N--CA 1.532 3.659 0 C-N-CA 124.901 1.281 . . . . 0.0 111.486 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 68.9 tttt -66.75 -63.1 1.14 Allowed 'General case' 0 N--CA 1.536 3.832 0 C-N-CA 122.92 0.488 . . . . 0.0 110.963 -177.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 37.1 p . . . . . 0 N--CA 1.525 3.322 0 CA-C-O 118.477 -0.773 . . . . 0.0 110.149 179.972 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.22 0 N-CA-C 108.874 -0.788 . . . . 0.0 108.874 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.504 2.251 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.424 -9.413 3 O4'-C1'-N19 119.796 14.995 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.914 4 O4'-C1'-N19 119.74 14.925 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.855 3 O4'-C1'-N19 119.723 14.904 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.444 5 O4'-C1'-N19 120.072 15.339 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' E' E ' 5' ' ' ' DC' . . . . . 0.42 ' H41' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 6 O3'--C3' 1.576 11.168 4 O4'-C1'-N19 118.589 13.486 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.411 -10.744 5 O4'-C1'-N19 119.691 14.864 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' E' E ' 7' ' ' ' DA' . . . . . 0.582 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.394 -12.399 3 C4'-C3'-C2' 113.165 9.965 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' E' E ' 8' ' ' ' DG' . . . . . 0.582 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.421 -9.661 4 O4'-C1'-N19 119.78 14.975 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.569 10.594 4 C4'-C3'-C2' 117.064 13.864 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.566 10.415 3 O4'-C1'-N19 119.271 14.338 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.384 4 O4'-C1'-N19 120.961 16.451 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.466 5 O4'-C1'-N19 119.25 14.312 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.413 -10.549 3 O4'-C1'-N19 119.868 15.084 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' E' E ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -9.959 6 O4'-C1'-N19 119.053 14.066 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' E' E ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.427 -9.084 4 O4'-C1'-N19 119.621 14.776 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.416 -10.17 4 O4'-C1'-N19 119.4 14.5 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.565 10.276 3 O4'-C1'-N19 120.019 15.274 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.609 5 O4'-C1'-N19 120.557 15.946 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.138 5 O4'-C1'-N19 119.871 15.089 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.512 7.046 3 O4'-C1'-N19 118.847 13.808 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.564 10.227 3 C4'-C3'-C2' 117.018 13.818 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.413 -10.543 3 O4'-C1'-N19 119.886 15.108 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.411 -10.676 5 O4'-C1'-N19 120.288 15.61 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' F' F ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.415 -10.257 4 O4'-C1'-N19 120.466 15.833 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' F' F ' 5' ' ' ' DC' . . . . . 0.436 ' H41' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 5 O3'--C3' 1.575 11.041 4 O4'-C1'-N19 118.876 13.845 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.403 -11.497 6 O4'-C1'-N19 119.47 14.587 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.424 -10.367 3 C4'-C3'-C2' 113.576 10.376 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.416 -10.201 5 O4'-C1'-N19 119.949 15.187 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.574 10.978 4 O4'-C1'-N19 118.771 13.713 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.684 3 O4'-C1'-N19 119.0 14.0 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.765 3 O4'-C1'-N19 119.946 15.183 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.525 4 O4'-C1'-N19 119.434 14.542 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.377 4 O4'-C1'-N19 119.382 14.477 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' F' F ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.565 10.271 3 C4'-C3'-C2' 117.078 13.878 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' F' F ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.16 6 O4'-C1'-N19 119.765 14.956 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.419 -9.893 4 O4'-C1'-N19 119.608 14.76 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.423 -9.516 3 O4'-C1'-N19 119.062 14.078 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.417 -10.071 4 O4'-C1'-N19 119.976 15.22 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -10.995 4 O4'-C1'-N19 120.347 15.684 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 C4'--C3' 1.599 7.137 5 O4'-C1'-N19 120.375 15.718 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 . . . . . 0 N--CA 1.501 2.102 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 40.8 p -114.52 125.57 29.01 Favored Pre-proline 0 N--CA 1.524 3.261 0 CA-C-O 117.346 -1.311 . . . . 0.0 109.773 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -74.35 138.5 24.83 Favored 'Trans proline' 0 C--N 1.388 2.628 0 C-N-CA 122.606 2.204 . . . . 0.0 111.231 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -110.63 138.48 46.96 Favored 'General case' 0 N--CA 1.529 3.501 0 C-N-CA 123.327 0.651 . . . . 0.0 110.039 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.2 t -95.37 139.01 32.26 Favored 'General case' 0 N--CA 1.527 3.392 0 C-N-CA 123.058 0.543 . . . . 0.0 111.16 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -135.43 131.83 36.7 Favored 'General case' 0 N--CA 1.528 3.44 0 C-N-CA 123.665 0.786 . . . . 0.0 109.364 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -96.9 -69.68 0.75 Allowed 'General case' 0 N--CA 1.526 3.362 0 CA-C-O 118.914 -0.565 . . . . 0.0 111.326 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 16.3 ttt -144.74 -58.01 0.36 Allowed 'General case' 0 N--CA 1.527 3.383 0 CA-C-N 118.683 0.674 . . . . 0.0 110.079 -178.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -117.52 149.51 40.5 Favored 'General case' 0 N--CA 1.521 3.118 0 C-N-CA 123.031 0.532 . . . . 0.0 111.856 -179.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 66.24 125.34 0.02 OUTLIER 'General case' 0 N--CA 1.532 3.635 0 C-N-CA 124.642 1.177 . . . . 0.0 110.951 178.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -127.2 -50.12 1.43 Allowed 'General case' 0 N--CA 1.522 3.164 0 C-N-CA 123.691 0.796 . . . . 0.0 108.975 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.73 119.5 20.42 Favored 'General case' 0 N--CA 1.522 3.151 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 179.1 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -113.02 72.93 0.79 Allowed 'General case' 0 N--CA 1.524 3.252 0 CA-C-O 121.536 0.684 . . . . 0.0 109.945 -177.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 6.9 mp0 -112.9 97.98 6.89 Favored 'General case' 0 N--CA 1.523 3.19 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -136.28 -84.63 0.36 Allowed 'General case' 0 N--CA 1.528 3.426 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 72.5 t-105 -52.99 -46.98 68.54 Favored 'General case' 0 N--CA 1.539 4.0 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 175.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -74.15 -27.38 60.81 Favored 'General case' 0 N--CA 1.514 2.736 0 O-C-N 125.339 1.649 . . . . 0.0 112.087 -177.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.0 ttt180 -56.95 -29.51 63.22 Favored 'General case' 1 N--CA 1.544 4.242 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 173.356 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.454 ' O ' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -83.57 -38.71 21.31 Favored 'General case' 0 CA--C 1.586 2.338 0 CA-C-O 116.387 -1.768 . . . . 0.0 109.003 173.733 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 19.2 t -70.15 -27.53 32.64 Favored 'Isoleucine or valine' 1 N--CA 1.574 5.73 0 CA-C-N 121.042 1.746 . . . . 0.0 112.985 -175.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -73.91 -50.52 19.75 Favored 'General case' 0 N--CA 1.535 3.814 0 CA-C-N 119.994 1.27 . . . . 0.0 108.258 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.2 mp -72.51 -15.62 61.79 Favored 'General case' 0 N--CA 1.528 3.447 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 175.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -70.44 -35.2 73.22 Favored 'General case' 0 N--CA 1.518 2.951 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 174.611 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.6 ttmt -64.03 -24.19 67.62 Favored 'General case' 0 N--CA 1.525 3.302 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.485 176.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -69.55 -41.23 76.17 Favored 'General case' 0 N--CA 1.534 3.766 0 CA-C-N 119.282 0.946 . . . . 0.0 108.583 176.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.43 ' HB2' ' N ' ' A' ' 35' ' ' HIS . . . -87.21 -7.99 57.34 Favored 'General case' 0 N--CA 1.504 2.263 0 CA-C-O 118.59 -0.719 . . . . 0.0 110.738 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.1 -31.83 25.06 Favored 'General case' 0 N--CA 1.534 3.743 0 CA-C-N 120.433 1.47 . . . . 0.0 109.059 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -64.5 -41.33 96.5 Favored 'General case' 0 N--CA 1.531 3.607 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 51.6 m-80 -92.75 -90.78 0.18 Allowed 'General case' 0 N--CA 1.514 2.766 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 177.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.0 p30 155.19 51.16 0.0 OUTLIER 'General case' 1 N--CA 1.555 4.782 0 C-N-CA 127.381 2.272 . . . . 0.0 108.222 177.19 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.2 mt -110.08 12.21 23.61 Favored 'General case' 0 N--CA 1.522 3.149 0 C-N-CA 124.209 1.003 . . . . 0.0 110.459 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.471 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 50.0 p-80 -84.47 5.82 25.92 Favored 'General case' 0 N--CA 1.515 2.781 0 C-N-CA 123.723 0.809 . . . . 0.0 108.854 174.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.633 ' HA ' HD22 ' A' ' 39' ' ' LEU . 31.7 mt -96.09 -52.39 0.23 Allowed Pre-proline 0 N--CA 1.502 2.151 0 CA-C-O 117.058 -1.448 . . . . 0.0 108.746 -176.199 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.425 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 6.1 Cg_exo -66.41 -32.04 41.36 Favored 'Trans proline' 0 C--N 1.391 2.799 0 N-CA-C 107.106 -1.921 . . . . 0.0 107.106 170.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.471 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 1.0 OUTLIER -65.58 -41.64 92.66 Favored 'General case' 0 N--CA 1.52 3.034 0 CA-C-O 118.212 -0.899 . . . . 0.0 108.739 176.79 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.633 HD22 ' HA ' ' A' ' 36' ' ' LEU 0.274 0.1 OUTLIER -78.28 -8.58 58.56 Favored 'General case' 1 N--CA 1.552 4.653 0 CA-C-N 119.612 1.096 . . . . 0.0 111.448 177.272 . . . . . . . . 5 4 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -90.22 8.57 32.43 Favored 'General case' 0 N--CA 1.524 3.245 0 CA-C-N 118.727 0.694 . . . . 0.0 109.618 174.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.47 -56.32 1.51 Allowed 'General case' 0 N--CA 1.513 2.723 0 C-N-CA 124.048 0.939 . . . . 0.0 109.629 -178.748 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 15.7 ptp -98.06 7.72 45.88 Favored 'General case' 0 N--CA 1.538 3.943 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -176.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.8 mp -120.63 -71.36 0.74 Allowed 'General case' 0 N--CA 1.514 2.726 0 CA-C-O 117.333 -1.318 . . . . 0.0 110.229 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.9 p 128.41 161.75 0.0 OUTLIER Pre-proline 1 N--CA 1.579 6.014 0 C-N-CA 127.533 2.333 . . . . 0.0 109.071 -179.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -68.16 -33.36 25.07 Favored 'Trans proline' 0 C--N 1.392 2.82 0 C-N-CA 121.934 1.756 . . . . 0.0 108.929 176.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -64.56 -22.78 67.06 Favored 'General case' 0 N--CA 1.532 3.644 0 CA-C-O 118.278 -0.867 . . . . 0.0 110.561 176.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -71.26 -37.11 71.93 Favored 'General case' 0 N--CA 1.524 3.245 0 CA-C-O 117.745 -1.121 . . . . 0.0 109.658 178.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.9 ptt180 -81.85 -20.31 39.21 Favored 'General case' 1 N--CA 1.541 4.113 0 CA-C-N 119.589 1.086 . . . . 0.0 108.896 174.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -71.99 -26.3 62.18 Favored 'General case' 0 N--CA 1.523 3.217 0 N-CA-C 107.559 -1.275 . . . . 0.0 107.559 174.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.02 -35.48 16.35 Favored 'General case' 0 N--CA 1.504 2.268 0 CA-C-O 117.365 -1.302 . . . . 0.0 110.114 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.464 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 29.5 tp -74.27 -19.98 60.31 Favored 'General case' 1 N--CA 1.541 4.1 0 CA-C-N 120.646 1.566 . . . . 0.0 106.94 173.689 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.01 -70.24 1.21 Allowed Glycine 0 N--CA 1.497 2.742 0 C-N-CA 125.346 1.45 . . . . 0.0 110.254 177.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.4 t -72.93 -22.14 60.77 Favored 'General case' 0 N--CA 1.526 3.368 0 CA-C-O 117.628 -1.177 . . . . 0.0 113.019 -179.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 12.2 mtt180 -70.57 -51.02 31.27 Favored 'General case' 0 N--CA 1.531 3.604 0 CA-C-N 120.073 1.306 . . . . 0.0 108.035 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 20.3 t -65.66 -18.75 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.978 0 CA-C-O 117.875 -1.059 . . . . 0.0 109.39 175.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.4 mmt180 -75.71 -45.19 38.13 Favored 'General case' 0 N--CA 1.525 3.325 0 CA-C-O 117.376 -1.297 . . . . 0.0 111.807 178.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.6 -25.62 21.05 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.261 0 CA-C-N 121.26 1.846 . . . . 0.0 111.137 -178.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -85.23 -47.16 17.08 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.108 0 CA-C-N 120.128 1.331 . . . . 0.0 107.536 -179.946 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -62.03 -24.28 66.97 Favored 'General case' 0 N--CA 1.534 3.741 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 177.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -92.73 -21.23 20.09 Favored 'General case' 0 N--CA 1.518 2.929 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.373 177.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 12.6 tp -74.75 -56.47 4.76 Favored 'General case' 0 N--CA 1.526 3.337 0 CA-C-N 120.091 1.314 . . . . 0.0 109.395 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 57.2 mt -51.15 -27.99 9.94 Favored 'General case' 1 N--CA 1.544 4.233 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -178.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.72 -57.45 2.98 Favored 'General case' 0 N--CA 1.524 3.261 0 N-CA-C 106.91 -1.515 . . . . 0.0 106.91 178.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 66.76 64.92 3.03 Favored Glycine 1 N--CA 1.517 4.094 0 C-N-CA 124.0 0.809 . . . . 0.0 112.698 178.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -115.17 -54.93 2.52 Favored 'General case' 0 N--CA 1.524 3.257 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 11.8 ptm -147.01 65.72 1.16 Allowed 'General case' 0 N--CA 1.528 3.463 0 N-CA-C 106.39 -1.707 . . . . 0.0 106.39 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 14.8 m -124.03 6.49 8.6 Favored 'General case' 0 N--CA 1.524 3.233 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -174.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -114.91 -70.09 0.82 Allowed 'General case' 0 N--CA 1.527 3.418 0 CA-C-N 119.61 1.096 . . . . 0.0 111.502 -179.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 8.6 mtt180 -91.44 -43.6 9.62 Favored 'General case' 0 N--CA 1.533 3.706 0 CA-C-N 118.591 0.632 . . . . 0.0 111.536 -177.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -77.07 -13.59 59.93 Favored 'General case' 0 N--CA 1.519 3.011 0 CA-C-O 118.321 -0.847 . . . . 0.0 112.925 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 24.4 tp -81.41 -50.46 9.43 Favored 'General case' 0 N--CA 1.523 3.198 0 CA-C-N 119.767 1.167 . . . . 0.0 111.522 -178.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.92 -31.79 1.39 Allowed 'General case' 1 N--CA 1.545 4.289 0 CA-C-N 119.57 1.077 . . . . 0.0 113.666 -179.171 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -77.86 -38.9 44.99 Favored 'General case' 0 N--CA 1.527 3.423 0 CA-C-O 119.232 -0.413 . . . . 0.0 111.217 -178.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -51.09 -59.19 4.44 Favored 'General case' 0 N--CA 1.529 3.521 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -177.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -119.08 -36.86 3.31 Favored 'General case' 0 N--CA 1.537 3.893 0 CA-C-O 118.455 -0.783 . . . . 0.0 112.075 -178.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 119.95 77.71 0.52 Allowed Glycine 1 N--CA 1.525 4.593 0 N-CA-C 110.76 -0.936 . . . . 0.0 110.76 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -146.0 100.83 3.45 Favored 'General case' 0 N--CA 1.524 3.242 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 178.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -40.18 170.48 0.01 OUTLIER Glycine 1 N--CA 1.54 5.624 0 C-N-CA 125.351 1.453 . . . . 0.0 116.094 -176.346 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.436 HG21 ' H41' ' F' ' 5' ' ' ' DC' . 0.4 OUTLIER -77.14 -20.81 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.04 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 178.513 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.94 -50.26 62.93 Favored 'General case' 0 N--CA 1.516 2.839 0 CA-C-O 117.944 -1.027 . . . . 0.0 109.302 177.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.09 -41.6 94.86 Favored 'General case' 1 N--CA 1.541 4.082 0 CA-C-O 117.875 -1.059 . . . . 0.0 113.459 -178.494 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -69.68 -32.16 51.34 Favored 'Isoleucine or valine' 1 N--CA 1.549 4.508 0 CA-C-N 120.392 1.451 . . . . 0.0 110.96 -179.616 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 71.3 p -98.9 -2.15 38.33 Favored 'General case' 0 N--CA 1.518 2.947 0 CA-C-N 119.101 0.864 . . . . 0.0 111.443 177.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -88.22 -32.87 18.34 Favored 'General case' 0 N--CA 1.529 3.478 0 N-CA-C 105.519 -2.03 . . . . 0.0 105.519 173.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.64 -29.64 72.54 Favored Glycine 1 N--CA 1.519 4.196 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 176.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 62.2 p -69.4 -35.89 76.19 Favored 'General case' 0 N--CA 1.538 3.942 0 CA-C-N 118.544 1.172 . . . . 0.0 110.259 177.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -63.16 -26.35 68.77 Favored 'General case' 0 N--CA 1.538 3.965 0 C-N-CA 123.146 0.578 . . . . 0.0 110.721 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.3 m -68.61 -38.68 80.8 Favored 'General case' 0 N--CA 1.534 3.757 0 C-N-CA 123.584 0.754 . . . . 0.0 110.375 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 13.5 mt -57.47 -37.96 73.73 Favored 'General case' 0 N--CA 1.533 3.682 0 C-N-CA 124.05 0.94 . . . . 0.0 111.468 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -68.43 -27.98 66.67 Favored 'General case' 0 N--CA 1.531 3.618 0 CA-C-O 118.563 -0.732 . . . . 0.0 111.757 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -76.42 -46.31 27.66 Favored 'General case' 0 N--CA 1.518 2.963 0 CA-C-N 118.782 0.719 . . . . 0.0 110.992 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.25 160.04 52.76 Favored Pre-proline 0 N--CA 1.538 3.955 0 CA-C-O 118.29 -0.862 . . . . 0.0 112.571 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -81.85 175.46 9.29 Favored 'Trans proline' 0 C--N 1.377 2.072 0 C-N-CA 121.737 1.625 . . . . 0.0 111.123 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 t -95.69 -25.19 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.192 0 CA-C-O 117.945 -1.026 . . . . 0.0 111.242 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -59.79 -44.94 93.69 Favored 'General case' 0 N--CA 1.516 2.85 0 CA-C-N 120.071 1.305 . . . . 0.0 109.966 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.9 mp -98.49 -9.98 24.24 Favored 'General case' 0 N--CA 1.505 2.282 0 CA-C-O 118.061 -0.971 . . . . 0.0 112.268 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.1 -33.93 76.9 Favored 'General case' 1 N--CA 1.549 4.52 0 N-CA-C 102.881 -3.007 . . . . 0.0 102.881 168.014 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -53.23 -41.26 65.22 Favored 'General case' 0 N--CA 1.519 3.007 0 C-N-CA 124.501 1.121 . . . . 0.0 110.159 174.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.422 ' HA ' ' HB2' ' A' ' 102' ' ' GLU . 51.1 t90 -64.46 -35.29 80.45 Favored 'General case' 0 N--CA 1.532 3.665 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 176.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.37 -38.56 59.14 Favored 'General case' 0 N--CA 1.537 3.901 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 176.212 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -69.97 -36.41 75.2 Favored 'General case' 0 N--CA 1.539 3.994 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 175.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.422 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 0.8 OUTLIER -59.12 -24.4 62.94 Favored 'General case' 1 N--CA 1.549 4.522 0 C-N-CA 123.419 0.688 . . . . 0.0 109.984 175.124 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -119.7 3.66 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.39 0 C-N-CA 123.615 0.766 . . . . 0.0 112.356 -177.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -98.68 -59.36 1.75 Allowed 'General case' 0 N--CA 1.517 2.909 0 N-CA-C 104.346 -2.464 . . . . 0.0 104.346 175.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 1.6 tp -64.15 -37.47 87.57 Favored 'General case' 0 N--CA 1.528 3.464 0 C-N-CA 124.687 1.195 . . . . 0.0 109.602 176.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 60.0 tttt 94.34 -38.59 0.01 OUTLIER 'General case' 0 N--CA 1.539 4.0 0 C-N-CA 126.917 2.087 . . . . 0.0 110.831 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 6.8 t . . . . . 0 N--CA 1.539 3.98 0 C-N-CA 124.477 1.111 . . . . 0.0 111.171 179.788 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 . . . . . 0 N--CA 1.504 2.274 0 CA-C-O 120.196 0.045 . . . . 0.0 110.906 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 70.1 m -121.82 124.37 27.09 Favored Pre-proline 0 N--CA 1.522 3.162 0 CA-C-O 117.392 -1.29 . . . . 0.0 109.437 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -72.55 159.55 48.7 Favored 'Trans proline' 0 C--N 1.391 2.806 0 C-N-CA 122.221 1.947 . . . . 0.0 111.613 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 85.44 -61.23 0.07 Allowed 'General case' 1 N--CA 1.544 4.251 0 C-N-CA 126.11 1.764 . . . . 0.0 110.234 -179.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 36.9 p -87.97 134.27 33.76 Favored 'General case' 0 N--CA 1.526 3.334 0 C-N-CA 123.257 0.623 . . . . 0.0 111.02 -178.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -123.53 116.71 23.63 Favored 'General case' 0 N--CA 1.513 2.702 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 178.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -97.66 127.97 44.01 Favored 'General case' 0 N--CA 1.521 3.085 0 C-N-CA 122.476 0.31 . . . . 0.0 111.041 -177.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 16.7 ttt -111.65 135.9 51.62 Favored 'General case' 0 N--CA 1.523 3.178 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 178.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . 68.57 132.39 0.03 OUTLIER 'General case' 1 N--CA 1.54 4.046 0 C-N-CA 123.89 0.876 . . . . 0.0 109.705 -179.061 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -69.59 -36.97 76.72 Favored 'General case' 0 N--CA 1.532 3.643 0 CA-C-O 118.876 -0.583 . . . . 0.0 110.956 -179.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 63.6 mm-40 -83.06 110.26 17.84 Favored 'General case' 0 N--CA 1.523 3.178 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 29.7 ptt180 -79.89 142.65 34.98 Favored 'General case' 0 N--CA 1.53 3.566 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -177.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 77.4 m-70 -138.89 122.78 17.74 Favored 'General case' 0 N--CA 1.524 3.269 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 177.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -108.13 140.89 40.67 Favored 'General case' 0 N--CA 1.529 3.505 0 C-N-CA 123.483 0.713 . . . . 0.0 110.901 -178.108 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -95.17 -83.15 0.36 Allowed 'General case' 0 N--CA 1.52 3.025 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 519' ' ' TRP . . . . . 0.44 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 67.9 t-105 -42.92 -28.15 0.24 Allowed 'General case' 1 N--CA 1.549 4.489 0 CA-C-N 119.641 1.11 . . . . 0.0 113.65 179.865 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 520' ' ' LEU . . . . . 0.41 ' CD2' ' N ' ' B' ' 520' ' ' LEU . 2.2 mm? -95.03 -29.1 14.78 Favored 'General case' 0 N--CA 1.53 3.532 0 CA-C-O 117.84 -1.076 . . . . 0.0 113.827 -172.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -27.23 68.26 Favored 'General case' 1 N--CA 1.545 4.297 0 N-CA-C 105.426 -2.064 . . . . 0.0 105.426 171.02 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . 0.464 ' CD2' ' HG ' ' A' ' 51' ' ' LEU . 0.9 OUTLIER -78.08 -40.37 38.67 Favored 'General case' 0 N--CA 1.507 2.402 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 174.77 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 37.0 t -63.02 -22.43 30.65 Favored 'Isoleucine or valine' 1 N--CA 1.569 5.48 0 CA-C-N 120.283 1.401 . . . . 0.0 111.965 178.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -76.89 -49.83 14.75 Favored 'General case' 0 N--CA 1.536 3.84 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 179.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 6.7 tt -63.45 -31.4 72.55 Favored 'General case' 0 N--CA 1.538 3.939 0 O-C-N 123.29 0.369 . . . . 0.0 110.115 176.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.65 -33.78 74.58 Favored 'General case' 0 N--CA 1.523 3.223 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 177.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 31.4 ttmt -67.66 -26.57 66.28 Favored 'General case' 0 N--CA 1.518 2.971 0 CA-C-O 118.161 -0.923 . . . . 0.0 110.853 177.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -69.58 -37.43 76.95 Favored 'General case' 0 N--CA 1.536 3.854 0 CA-C-N 119.462 1.028 . . . . 0.0 108.896 176.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 529' ' ' ALA . . . . . . . . . . . . . . . -90.98 -9.46 45.92 Favored 'General case' 0 CA--C 1.579 2.084 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.967 178.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -82.32 -32.11 29.59 Favored 'General case' 0 N--CA 1.531 3.6 0 CA-C-N 120.312 1.414 . . . . 0.0 109.328 -179.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -65.85 -43.0 89.76 Favored 'General case' 0 N--CA 1.534 3.766 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 177.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 65.6 m-80 -90.82 -90.15 0.16 Allowed 'General case' 0 N--CA 1.514 2.754 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 154.86 50.74 0.0 OUTLIER 'General case' 1 N--CA 1.559 4.977 0 C-N-CA 127.574 2.35 . . . . 0.0 107.984 177.384 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 6.9 mt -106.35 7.83 31.42 Favored 'General case' 0 N--CA 1.528 3.449 0 C-N-CA 124.297 1.039 . . . . 0.0 111.021 -178.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 535' ' ' HIS . . . . . . . . . . . . . 29.3 p-80 -80.57 0.01 35.77 Favored 'General case' 0 N--CA 1.514 2.732 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 175.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 536' ' ' LEU . . . . . . . . . . . . . 35.5 mt -94.23 -50.95 0.26 Allowed Pre-proline 0 N--CA 1.505 2.283 0 CA-C-O 116.486 -1.721 . . . . 0.0 109.263 -175.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 537' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -66.33 -35.37 31.8 Favored 'Trans proline' 0 C--N 1.394 2.966 0 N-CA-C 106.775 -2.048 . . . . 0.0 106.775 171.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.24 -41.7 98.66 Favored 'General case' 0 N--CA 1.524 3.251 0 C-N-CA 124.267 1.027 . . . . 0.0 108.334 175.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 11.5 mt -72.14 -21.76 61.42 Favored 'General case' 1 N--CA 1.54 4.057 0 CA-C-O 118.358 -0.83 . . . . 0.0 111.057 178.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -77.72 -6.18 53.11 Favored 'General case' 0 N--CA 1.524 3.234 0 CA-C-N 118.976 0.807 . . . . 0.0 110.44 177.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.88 -47.77 3.3 Favored 'General case' 0 N--CA 1.512 2.63 0 C-N-CA 124.053 0.941 . . . . 0.0 109.445 -179.092 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 12.7 ptp -89.76 -10.54 45.21 Favored 'General case' 0 N--CA 1.536 3.852 0 CA-C-O 117.407 -1.282 . . . . 0.0 113.542 -177.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 1.2 tt -128.2 -112.58 0.27 Allowed 'General case' 0 N--CA 1.53 3.563 0 CA-C-O 116.558 -1.687 . . . . 0.0 112.752 -178.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 2.2 p -174.56 161.66 2.64 Favored Pre-proline 1 N--CA 1.561 5.087 0 CA-C-N 121.505 1.957 . . . . 0.0 111.245 -178.483 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -74.81 -42.49 0.55 Allowed 'Trans proline' 0 C--N 1.388 2.621 0 C-N-CA 123.021 2.481 . . . . 0.0 109.733 176.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -58.28 -31.9 67.91 Favored 'General case' 1 N--CA 1.543 4.192 0 C-N-CA 123.707 0.803 . . . . 0.0 111.63 179.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -71.96 -34.09 68.7 Favored 'General case' 0 N--CA 1.526 3.35 0 CA-C-O 117.843 -1.075 . . . . 0.0 110.664 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 32.1 ptt180 -79.09 -23.51 44.08 Favored 'General case' 0 N--CA 1.533 3.692 0 CA-C-N 119.597 1.09 . . . . 0.0 110.133 177.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -65.16 -41.48 94.66 Favored 'General case' 0 N--CA 1.536 3.828 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 173.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -78.14 -19.95 53.01 Favored 'General case' 0 N--CA 1.508 2.448 0 CA-C-O 116.992 -1.48 . . . . 0.0 111.185 177.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 551' ' ' LEU . . . . . 0.42 HD22 ' CG ' ' A' ' 22' ' ' PHE . 18.0 tp -76.44 -28.19 56.5 Favored 'General case' 0 N--CA 1.529 3.497 0 CA-C-N 121.368 1.895 . . . . 0.0 108.52 175.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -72.23 -56.3 6.38 Favored Glycine 0 N--CA 1.501 2.993 0 N-CA-C 108.491 -1.844 . . . . 0.0 108.491 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.4 m -66.19 -28.18 68.56 Favored 'General case' 0 N--CA 1.537 3.913 0 CA-C-O 118.432 -0.794 . . . . 0.0 112.05 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 26.0 mtm-85 -69.22 -45.81 68.94 Favored 'General case' 1 N--CA 1.541 4.102 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 176.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 34.9 t -70.73 -15.47 18.93 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.66 0 CA-C-O 118.11 -0.947 . . . . 0.0 109.353 177.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -79.82 -44.35 20.72 Favored 'General case' 0 N--CA 1.523 3.222 0 CA-C-O 117.395 -1.288 . . . . 0.0 111.212 178.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 557' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.3 -25.07 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.213 0 CA-C-N 121.428 1.922 . . . . 0.0 110.107 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 558' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -84.32 -52.76 12.24 Favored 'Isoleucine or valine' 1 N--CA 1.547 4.397 0 CA-C-N 120.736 1.607 . . . . 0.0 107.541 -179.888 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -58.07 -25.69 61.59 Favored 'General case' 0 N--CA 1.529 3.507 0 CA-C-O 118.874 -0.584 . . . . 0.0 110.696 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -93.7 -24.58 17.8 Favored 'General case' 0 N--CA 1.523 3.225 0 CA-C-O 118.132 -0.937 . . . . 0.0 111.043 178.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.92 -38.71 66.76 Favored 'General case' 1 N--CA 1.541 4.092 0 CA-C-N 119.728 1.149 . . . . 0.0 108.561 177.776 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 34.7 mt -57.35 -22.32 41.63 Favored 'General case' 0 N--CA 1.536 3.857 0 C-N-CA 123.665 0.786 . . . . 0.0 111.545 177.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 24.5 mmm180 -77.77 -51.39 10.6 Favored 'General case' 0 N--CA 1.527 3.406 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 66.97 50.57 45.85 Favored Glycine 1 N--CA 1.522 4.386 0 CA-C-O 119.086 -0.841 . . . . 0.0 112.494 178.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -124.76 -54.21 1.65 Allowed 'General case' 0 N--CA 1.527 3.405 0 CA-C-N 118.362 1.081 . . . . 0.0 108.431 178.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 30.6 mtt -148.98 64.32 1.04 Allowed 'General case' 0 N--CA 1.522 3.168 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 80.0 p -130.87 -4.83 4.02 Favored 'General case' 0 N--CA 1.52 3.063 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -175.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -93.49 -78.43 0.43 Allowed 'General case' 0 N--CA 1.528 3.468 0 CA-C-N 120.164 1.347 . . . . 0.0 111.255 -179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.79 -34.86 13.02 Favored 'General case' 1 N--CA 1.541 4.086 0 CA-C-N 119.146 0.885 . . . . 0.0 112.043 -178.492 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -76.96 -11.08 59.76 Favored 'General case' 0 N--CA 1.52 3.028 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -178.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 16.8 tp -83.17 -43.65 15.93 Favored 'General case' 0 N--CA 1.532 3.639 0 CA-C-N 119.749 1.158 . . . . 0.0 112.649 -177.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -44.63 -29.21 0.7 Allowed 'General case' 1 N--CA 1.556 4.856 0 CA-C-N 120.249 1.386 . . . . 0.0 113.474 -178.591 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -66.4 -46.35 76.88 Favored 'General case' 0 N--CA 1.538 3.96 0 CA-C-N 118.698 0.681 . . . . 0.0 109.414 179.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -57.53 -51.13 70.71 Favored 'General case' 0 N--CA 1.525 3.293 0 C-N-CA 124.662 1.185 . . . . 0.0 112.413 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 61.0 mt -108.77 -61.83 1.55 Allowed 'General case' 0 N--CA 1.53 3.534 0 C-N-CA 122.988 0.515 . . . . 0.0 111.828 -177.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 122.81 20.82 2.76 Favored Glycine 1 N--CA 1.529 4.898 0 CA-C-O 118.199 -1.334 . . . . 0.0 112.619 -178.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -86.27 119.31 26.41 Favored 'General case' 0 N--CA 1.522 3.135 0 CA-C-N 119.577 1.689 . . . . 0.0 107.021 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -42.26 167.97 0.01 OUTLIER Glycine 1 N--CA 1.538 5.444 0 C-N-CA 124.616 1.103 . . . . 0.0 115.209 -177.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 579' ' ' ILE . . . . . 0.42 HG21 ' H41' ' E' ' 5' ' ' ' DC' . 0.7 OUTLIER -80.27 -19.05 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.743 0 CA-C-O 117.632 -1.175 . . . . 0.0 108.568 178.74 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -69.22 -37.21 77.91 Favored 'General case' 0 N--CA 1.527 3.424 0 CA-C-N 119.879 1.218 . . . . 0.0 109.501 176.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.4 -36.65 38.81 Favored 'General case' 0 N--CA 1.536 3.831 0 CA-C-N 118.978 0.808 . . . . 0.0 111.776 178.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 3.1 tt -67.07 -38.41 81.2 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.216 0 CA-C-O 118.975 -0.535 . . . . 0.0 112.223 -175.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 69.8 p -99.11 -27.34 13.87 Favored 'General case' 0 N--CA 1.508 2.443 0 CA-C-O 117.812 -1.089 . . . . 0.0 111.837 -178.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 13.3 ptt180 -73.66 -24.87 60.04 Favored 'General case' 0 N--CA 1.531 3.584 0 CA-C-N 120.061 1.301 . . . . 0.0 109.762 176.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -68.88 -36.11 81.08 Favored Glycine 1 N--CA 1.517 4.081 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 177.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 35.2 p -78.68 -29.49 45.62 Favored 'General case' 0 N--CA 1.531 3.607 0 CA-C-N 118.05 0.925 . . . . 0.0 111.278 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -64.01 -30.89 71.93 Favored 'General case' 1 N--CA 1.544 4.233 0 CA-C-N 119.346 0.976 . . . . 0.0 110.683 179.032 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 3.8 m -59.02 -35.98 74.2 Favored 'General case' 1 N--CA 1.541 4.108 0 C-N-CA 123.276 0.63 . . . . 0.0 110.411 178.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 43.7 mt -52.56 -45.84 66.57 Favored 'General case' 0 N--CA 1.532 3.641 0 C-N-CA 124.582 1.153 . . . . 0.0 111.398 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.52 -34.85 69.54 Favored 'General case' 1 N--CA 1.543 4.222 0 C-N-CA 123.268 0.627 . . . . 0.0 111.815 -179.744 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -81.2 -34.01 32.58 Favored 'General case' 0 N--CA 1.519 2.992 0 CA-C-O 118.878 -0.582 . . . . 0.0 111.859 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -61.94 171.99 1.3 Allowed Pre-proline 1 N--CA 1.54 4.061 0 CA-C-O 118.218 -0.896 . . . . 0.0 111.707 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -83.17 140.73 10.0 Favored 'Trans proline' 0 C--N 1.377 2.033 0 C-N-CA 121.775 1.65 . . . . 0.0 109.207 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.3 t -79.64 -20.82 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.019 0 CA-C-O 117.928 -1.034 . . . . 0.0 111.027 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -63.54 -41.91 98.44 Favored 'General case' 0 N--CA 1.516 2.856 0 CA-C-N 120.101 1.319 . . . . 0.0 109.786 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 7.4 mp -97.64 -13.79 21.33 Favored 'General case' 0 N--CA 1.511 2.592 0 C-N-CA 123.683 0.793 . . . . 0.0 111.349 177.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.16 -32.18 73.1 Favored 'General case' 1 N--CA 1.541 4.081 0 N-CA-C 103.595 -2.743 . . . . 0.0 103.595 168.496 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -54.16 -38.26 65.33 Favored 'General case' 0 N--CA 1.519 3.003 0 C-N-CA 124.532 1.133 . . . . 0.0 109.693 174.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 599' ' ' TRP . . . . . 0.421 ' HA ' ' HB2' ' B' ' 602' ' ' GLU . 49.7 t90 -63.25 -37.16 86.15 Favored 'General case' 0 N--CA 1.528 3.432 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 176.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -51.34 -39.03 56.16 Favored 'General case' 1 N--CA 1.543 4.204 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 175.869 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -69.64 -37.15 76.67 Favored 'General case' 1 N--CA 1.543 4.177 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 175.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 602' ' ' GLU . . . . . 0.421 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 2.9 mt-10 -59.35 -23.25 62.37 Favored 'General case' 1 N--CA 1.547 4.41 0 C-N-CA 123.424 0.69 . . . . 0.0 110.141 175.101 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -120.77 3.49 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.323 0 C-N-CA 123.566 0.747 . . . . 0.0 112.468 -177.399 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -111.68 -61.49 1.7 Allowed 'General case' 0 N--CA 1.509 2.508 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 176.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.74 -65.86 0.63 Allowed 'General case' 0 N--CA 1.535 3.792 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 177.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt 84.68 -44.48 0.08 Allowed 'General case' 0 N--CA 1.535 3.819 0 C-N-CA 126.452 1.901 . . . . 0.0 111.647 178.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 37.0 p . . . . . 0 N--CA 1.526 3.336 0 CA-C-O 118.129 -0.938 . . . . 0.0 109.582 179.836 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.209 0 CA-C-O 117.849 -1.072 . . . . 0.0 109.033 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.161 0 CA-C-O 118.315 -0.85 . . . . 0.0 109.537 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.054 3 O4'-C1'-N19 119.843 15.054 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.057 4 O4'-C1'-N19 120.187 15.484 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -9.982 3 O4'-C1'-N19 119.039 14.048 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . 0.441 ' N6 ' HG23 ' B' ' 579' ' ' ILE . . . . . . . . 6 C3'--C2' 1.416 -10.155 4 O4'-C1'-N19 120.195 15.493 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' E' E ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.566 10.392 3 C4'-C3'-C2' 116.98 13.78 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.41 -10.756 5 O4'-C1'-N19 119.731 14.913 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' E' E ' 7' ' ' ' DA' . . . . . 0.562 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 5 C3'--C2' 1.392 -12.567 4 C4'-C3'-C2' 113.058 9.858 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' E' E ' 8' ' ' ' DG' . . . . . 0.562 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.42 -9.816 4 O4'-C1'-N19 120.108 15.385 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.574 11.015 4 C4'-C3'-C2' 116.596 13.396 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.406 -11.171 5 O4'-C1'-N19 119.144 14.18 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.571 10.783 2 O4'-C1'-N19 120.004 15.255 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.406 -11.219 4 O4'-C1'-N19 119.654 14.818 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.415 -10.349 5 O4'-C1'-N19 119.876 15.094 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' E' E ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.077 2 O4'-C1'-N19 119.612 14.765 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' E' E ' 15' ' ' ' DA' . . . . . 0.417 ' H62' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.416 -10.234 6 O4'-C1'-N19 119.766 14.957 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.416 -10.227 6 O4'-C1'-N19 119.513 14.641 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.578 11.317 4 O4'-C1'-N19 119.786 14.983 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.42 -9.796 4 O4'-C1'-N19 120.356 15.695 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.094 5 O4'-C1'-N19 120.004 15.255 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.598 6.995 4 O4'-C1'-N19 120.24 15.551 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.197 4 O4'-C1'-N19 118.582 13.477 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.405 -11.32 3 O4'-C1'-N19 118.919 13.899 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.409 -10.862 3 O4'-C1'-N19 119.718 14.897 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' F' F ' 4' ' ' ' DA' . . . . . 0.441 ' N6 ' HG23 ' A' ' 79' ' ' ILE . . . . . . . . 6 O3'--C3' 1.563 10.158 4 O4'-C1'-N19 119.185 14.231 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' F' F ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.572 10.856 4 O4'-C1'-N19 118.773 13.716 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.408 -10.97 4 C4'-C3'-C2' 115.985 12.785 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.408 -12.013 4 N19-C1'-C2' 130.071 9.919 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.425 -9.341 3 O4'-C1'-N19 119.527 14.659 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.565 10.301 3 O4'-C1'-N19 119.665 14.831 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' F' F ' 10' ' ' ' DT' . . . . . 0.418 " H4'" ' OP1' ' F' ' 11' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.417 -10.076 5 O4'-C1'-N19 117.531 12.163 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . 0.418 ' OP1' " H4'" ' F' ' 10' ' ' ' DT' . . . . . . . . 5 C3'--C2' 1.413 -10.527 4 O4'-C1'-N19 121.533 17.166 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.618 5 O4'-C1'-N19 120.473 15.841 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.706 3 O4'-C1'-N19 120.914 16.392 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' F' F ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.567 10.459 3 O4'-C1'-N19 119.129 14.161 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' F' F ' 15' ' ' ' DA' . . . . . 0.402 ' H62' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.415 -10.254 6 O4'-C1'-N19 120.173 15.466 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.415 -10.328 5 O4'-C1'-N19 120.03 15.287 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.135 4 O4'-C1'-N19 119.239 14.299 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.47 5 O4'-C1'-N19 119.997 15.246 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.485 4 O4'-C1'-N19 120.397 15.746 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.511 6.966 4 O4'-C1'-N19 120.19 15.488 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 . . . . . 0 N--CA 1.498 1.947 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 36.2 p -102.77 152.5 38.46 Favored Pre-proline 0 N--CA 1.534 3.739 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.661 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -74.02 124.84 9.4 Favored 'Trans proline' 0 C--N 1.388 2.618 0 C-N-CA 122.468 2.112 . . . . 0.0 110.935 -179.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -145.49 -57.0 0.32 Allowed 'General case' 0 N--CA 1.525 3.313 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.0 p -105.61 149.86 25.93 Favored 'General case' 0 N--CA 1.528 3.426 0 C-N-CA 123.687 0.795 . . . . 0.0 108.87 177.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 71.19 127.71 0.03 OUTLIER 'General case' 1 N--CA 1.544 4.26 0 C-N-CA 123.884 0.874 . . . . 0.0 109.154 -178.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.66 -56.75 4.33 Favored 'General case' 0 N--CA 1.524 3.238 0 CA-C-O 119.107 -0.473 . . . . 0.0 111.162 -178.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 13.3 ttt -113.8 123.41 49.76 Favored 'General case' 0 N--CA 1.519 3.01 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -137.79 131.99 32.02 Favored 'General case' 0 N--CA 1.523 3.209 0 C-N-CA 123.637 0.775 . . . . 0.0 109.167 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -142.39 132.3 24.34 Favored 'General case' 0 N--CA 1.518 2.965 0 CA-C-N 117.905 0.32 . . . . 0.0 111.252 -178.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 65.4 mm-40 -102.78 -42.97 5.7 Favored 'General case' 0 N--CA 1.525 3.296 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 176.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 87.5 mtm180 68.49 139.92 0.03 OUTLIER 'General case' 0 N--CA 1.526 3.342 0 C-N-CA 125.014 1.326 . . . . 0.0 112.509 177.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 12.4 p-80 -146.99 -37.37 0.22 Allowed 'General case' 0 N--CA 1.524 3.254 0 C-N-CA 123.894 0.878 . . . . 0.0 110.554 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -68.33 132.94 47.95 Favored 'General case' 0 N--CA 1.527 3.424 0 C-N-CA 123.334 0.654 . . . . 0.0 111.533 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -148.91 -66.21 0.23 Allowed 'General case' 0 N--CA 1.528 3.445 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 177.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.41 ' CE3' ' CD2' ' B' ' 551' ' ' LEU . 61.6 t-105 -54.65 -38.26 66.67 Favored 'General case' 0 N--CA 1.531 3.598 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 173.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -80.03 -27.27 39.5 Favored 'General case' 0 N--CA 1.517 2.881 0 CA-C-O 117.263 -1.351 . . . . 0.0 112.279 -175.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 mmt180 -57.9 -31.54 66.86 Favored 'General case' 1 N--CA 1.549 4.508 0 N-CA-C 105.335 -2.098 . . . . 0.0 105.335 172.138 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.5 ' CG ' HD22 ' B' ' 551' ' ' LEU . 0.1 OUTLIER -76.59 -41.98 44.23 Favored 'General case' 0 N--CA 1.503 2.2 0 CA-C-O 116.718 -1.61 . . . . 0.0 109.382 173.628 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 26.8 t -69.91 -25.04 27.24 Favored 'Isoleucine or valine' 1 N--CA 1.566 5.349 0 CA-C-N 120.566 1.53 . . . . 0.0 113.981 -174.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -76.29 -51.56 11.74 Favored 'General case' 0 N--CA 1.535 3.815 0 CA-C-N 120.392 1.451 . . . . 0.0 108.276 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.5 mp -74.68 -12.33 60.4 Favored 'General case' 0 N--CA 1.52 3.059 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 175.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.468 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -70.76 -36.92 73.33 Favored 'General case' 0 N--CA 1.521 3.097 0 N-CA-C 106.495 -1.669 . . . . 0.0 106.495 173.22 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -62.79 -22.15 66.4 Favored 'General case' 0 N--CA 1.525 3.276 0 CA-C-O 118.495 -0.764 . . . . 0.0 111.006 176.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -70.36 -45.53 65.89 Favored 'General case' 0 N--CA 1.538 3.927 0 N-CA-C 108.307 -0.998 . . . . 0.0 108.307 176.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.494 ' HB2' ' N ' ' A' ' 35' ' ' HIS . . . -81.67 -9.37 59.67 Favored 'General case' 0 N--CA 1.508 2.455 0 CA-C-O 118.695 -0.669 . . . . 0.0 110.841 177.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.4 -36.15 29.88 Favored 'General case' 0 N--CA 1.533 3.707 0 CA-C-N 120.251 1.387 . . . . 0.0 109.066 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -59.99 -42.43 94.18 Favored 'General case' 0 N--CA 1.536 3.863 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 177.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 61.3 m-80 -90.15 -85.59 0.21 Allowed 'General case' 0 N--CA 1.513 2.717 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 176.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 147.94 50.96 0.0 OUTLIER 'General case' 1 N--CA 1.555 4.792 0 C-N-CA 128.042 2.537 . . . . 0.0 108.422 177.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.7 mt -111.63 12.38 21.2 Favored 'General case' 0 N--CA 1.526 3.339 0 C-N-CA 124.822 1.249 . . . . 0.0 110.021 -179.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.494 ' N ' ' HB2' ' A' ' 29' ' ' ALA . 51.6 p-80 -83.91 6.66 20.88 Favored 'General case' 0 N--CA 1.507 2.41 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 175.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.434 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 18.6 mt -96.37 -52.04 0.23 Allowed Pre-proline 0 N--CA 1.509 2.505 0 CA-C-O 116.794 -1.574 . . . . 0.0 108.828 -175.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.434 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 5.7 Cg_exo -66.02 -32.27 44.59 Favored 'Trans proline' 0 C--N 1.396 3.04 0 N-CA-C 106.489 -2.158 . . . . 0.0 106.489 170.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.48 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.9 OUTLIER -64.14 -39.22 93.57 Favored 'General case' 0 N--CA 1.517 2.9 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 175.679 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.35 -21.5 62.03 Favored 'General case' 1 N--CA 1.543 4.196 0 CA-C-N 119.324 0.966 . . . . 0.0 109.978 176.547 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -85.73 -3.19 58.83 Favored 'General case' 0 N--CA 1.527 3.42 0 CA-C-N 119.106 0.866 . . . . 0.0 111.131 177.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -112.96 -36.09 5.23 Favored 'General case' 0 N--CA 1.53 3.548 0 CA-C-N 119.698 1.135 . . . . 0.0 111.558 -178.26 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.9 ptt? -126.81 27.18 6.07 Favored 'General case' 1 N--CA 1.554 4.725 0 CA-C-N 120.249 1.386 . . . . 0.0 111.674 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.3 tp -134.1 -61.89 0.77 Allowed 'General case' 0 N--CA 1.516 2.867 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.9 p 118.5 158.8 0.0 OUTLIER Pre-proline 1 N--CA 1.566 5.345 0 C-N-CA 128.348 2.659 . . . . 0.0 109.495 -178.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -69.26 -31.26 23.1 Favored 'Trans proline' 0 C--N 1.392 2.864 0 C-N-CA 122.163 1.908 . . . . 0.0 109.058 175.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -67.17 -21.07 65.81 Favored 'General case' 0 N--CA 1.528 3.441 0 CA-C-O 118.131 -0.937 . . . . 0.0 110.243 176.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -75.46 -29.74 59.74 Favored 'General case' 0 N--CA 1.521 3.086 0 CA-C-O 117.599 -1.191 . . . . 0.0 109.853 178.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -87.18 -22.03 25.54 Favored 'General case' 0 N--CA 1.539 3.995 0 CA-C-N 119.933 1.242 . . . . 0.0 109.026 174.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -71.58 -27.94 63.49 Favored 'General case' 0 N--CA 1.527 3.423 0 N-CA-C 106.433 -1.692 . . . . 0.0 106.433 172.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.48 -27.24 20.48 Favored 'General case' 0 N--CA 1.503 2.177 0 CA-C-O 117.432 -1.27 . . . . 0.0 110.405 178.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 27.6 tp -75.55 -21.74 57.64 Favored 'General case' 0 N--CA 1.537 3.915 0 N-CA-C 106.249 -1.76 . . . . 0.0 106.249 173.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.421 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -67.85 -72.42 0.8 Allowed Glycine 0 C--N 1.376 2.802 0 N-CA-C 109.198 -1.561 . . . . 0.0 109.198 176.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.7 m -66.08 -22.38 66.41 Favored 'General case' 0 N--CA 1.535 3.82 0 CA-C-O 117.468 -1.253 . . . . 0.0 113.204 -179.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.3 mtm180 -71.27 -52.66 17.71 Favored 'General case' 0 N--CA 1.538 3.933 0 CA-C-N 120.498 1.499 . . . . 0.0 107.464 177.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.3 t -67.63 -16.2 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.903 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.84 176.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -76.09 -46.66 27.85 Favored 'General case' 0 N--CA 1.531 3.59 0 CA-C-N 120.052 1.296 . . . . 0.0 111.172 178.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.2 -23.04 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.376 0 CA-C-N 120.563 1.529 . . . . 0.0 111.573 -178.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -88.79 -53.31 9.75 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.765 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -57.39 -22.61 44.03 Favored 'General case' 0 N--CA 1.531 3.609 0 CA-C-O 118.454 -0.784 . . . . 0.0 110.755 178.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -95.33 -29.01 14.69 Favored 'General case' 0 N--CA 1.522 3.132 0 CA-C-O 118.148 -0.929 . . . . 0.0 110.365 177.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 45.6 tp -67.6 -56.33 9.83 Favored 'General case' 1 N--CA 1.539 4.007 0 CA-C-N 119.598 1.09 . . . . 0.0 110.073 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 54.9 mt -54.02 -24.64 17.68 Favored 'General case' 1 N--CA 1.541 4.09 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 -179.26 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -79.22 -48.83 13.51 Favored 'General case' 0 N--CA 1.53 3.531 0 CA-C-N 118.669 0.668 . . . . 0.0 110.045 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 74.61 81.14 0.48 Allowed Glycine 1 N--CA 1.521 4.344 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 179.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -158.57 -57.17 0.07 Allowed 'General case' 0 N--CA 1.53 3.528 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 44.1 mtt -138.61 76.56 1.58 Allowed 'General case' 0 N--CA 1.522 3.156 0 N-CA-C 104.344 -2.465 . . . . 0.0 104.344 177.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.5 m -128.5 -33.17 2.12 Favored 'General case' 0 N--CA 1.525 3.324 0 N-CA-C 114.104 1.15 . . . . 0.0 114.104 -172.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -105.91 -65.65 1.05 Allowed 'General case' 0 N--CA 1.526 3.343 0 CA-C-N 118.727 0.694 . . . . 0.0 111.933 -176.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 10.7 mtt180 -97.24 -45.59 6.45 Favored 'General case' 0 N--CA 1.526 3.361 0 CA-C-N 118.485 0.584 . . . . 0.0 111.419 -177.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -71.81 -14.87 62.1 Favored 'General case' 0 N--CA 1.521 3.083 0 CA-C-O 118.439 -0.791 . . . . 0.0 112.297 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 24.1 tp -79.14 -54.9 5.53 Favored 'General case' 0 N--CA 1.525 3.298 0 CA-C-N 119.484 1.038 . . . . 0.0 111.62 -178.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -41.77 -36.55 1.03 Allowed 'General case' 1 N--CA 1.549 4.511 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -178.174 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 14.1 t30 -74.12 -39.97 62.99 Favored 'General case' 0 N--CA 1.532 3.642 0 CA-C-N 118.112 0.415 . . . . 0.0 111.035 -178.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -46.3 -54.38 9.04 Favored 'General case' 0 N--CA 1.537 3.886 0 C-N-CA 124.824 1.25 . . . . 0.0 113.409 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -133.23 -39.88 0.92 Allowed 'General case' 0 N--CA 1.533 3.683 0 CA-C-O 118.63 -0.7 . . . . 0.0 111.835 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 117.77 86.79 1.17 Allowed Glycine 1 N--CA 1.523 4.486 0 N-CA-C 110.51 -1.036 . . . . 0.0 110.51 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -115.92 -47.1 2.8 Favored 'General case' 0 N--CA 1.522 3.152 0 C-N-CA 123.613 0.765 . . . . 0.0 109.397 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.99 161.67 22.84 Favored Glycine 1 N--CA 1.525 4.629 0 N-CA-C 109.771 -1.331 . . . . 0.0 109.771 -179.039 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.441 HG23 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.9 OUTLIER -83.11 -14.98 11.76 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.858 0 CA-C-N 119.439 1.619 . . . . 0.0 108.133 177.781 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.417 ' HB3' ' H62' ' E' ' 15' ' ' ' DA' . . . -70.94 -30.72 67.11 Favored 'General case' 0 N--CA 1.518 2.949 0 CA-C-O 117.463 -1.256 . . . . 0.0 111.239 177.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.9 p -93.4 -36.38 12.52 Favored 'General case' 1 N--CA 1.545 4.316 0 CA-C-N 120.45 1.477 . . . . 0.0 112.133 -179.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -73.93 -25.38 20.24 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.056 0 CA-C-O 118.101 -0.952 . . . . 0.0 111.898 -179.122 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.5 p -103.95 -29.67 10.79 Favored 'General case' 0 N--CA 1.513 2.697 0 CA-C-O 117.954 -1.022 . . . . 0.0 110.554 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.0 ptt180 -73.28 -25.59 60.74 Favored 'General case' 1 N--CA 1.545 4.287 0 CA-C-N 120.042 1.292 . . . . 0.0 108.154 173.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -64.71 -27.58 72.18 Favored Glycine 1 N--CA 1.524 4.543 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 174.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 20.1 m -70.33 -35.47 73.63 Favored 'General case' 0 N--CA 1.535 3.795 0 CA-C-N 117.973 0.886 . . . . 0.0 108.753 176.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -60.92 -30.69 70.35 Favored 'General case' 1 N--CA 1.542 4.143 0 C-N-CA 123.457 0.703 . . . . 0.0 110.096 177.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.6 m -64.76 -38.14 89.98 Favored 'General case' 0 N--CA 1.533 3.711 0 C-N-CA 123.509 0.723 . . . . 0.0 110.716 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.8 mt -53.39 -37.91 62.9 Favored 'General case' 0 N--CA 1.538 3.935 0 C-N-CA 123.734 0.813 . . . . 0.0 111.135 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -68.27 -36.3 79.19 Favored 'General case' 0 N--CA 1.534 3.755 0 C-N-CA 123.096 0.558 . . . . 0.0 111.174 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.67 -36.77 81.32 Favored 'General case' 0 N--CA 1.525 3.276 0 C-N-CA 123.216 0.607 . . . . 0.0 111.905 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.35 158.41 88.06 Favored Pre-proline 0 N--CA 1.526 3.363 0 CA-C-O 118.535 -0.745 . . . . 0.0 111.851 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -86.46 -178.54 2.75 Favored 'Trans proline' 0 CA--C 1.563 1.972 0 C-N-CA 122.331 2.021 . . . . 0.0 111.189 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.404 ' HA ' ' HB3' ' A' ' 97' ' ' ARG . 3.1 t -97.04 -28.76 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.101 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.773 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -59.78 -45.22 92.94 Favored 'General case' 0 N--CA 1.514 2.762 0 CA-C-N 119.666 1.121 . . . . 0.0 110.009 -178.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.6 mp -100.02 -11.63 20.42 Favored 'General case' 0 N--CA 1.511 2.591 0 CA-C-O 118.307 -0.854 . . . . 0.0 112.706 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.404 ' HB3' ' HA ' ' A' ' 94' ' ' VAL . 0.2 OUTLIER -67.56 -30.84 70.58 Favored 'General case' 1 N--CA 1.544 4.269 0 N-CA-C 102.368 -3.197 . . . . 0.0 102.368 167.849 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -56.67 -38.54 72.37 Favored 'General case' 0 N--CA 1.515 2.823 0 C-N-CA 124.134 0.973 . . . . 0.0 110.277 175.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 53.5 t90 -66.45 -34.22 77.45 Favored 'General case' 0 N--CA 1.538 3.963 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 176.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.52 -37.15 62.53 Favored 'General case' 0 N--CA 1.535 3.775 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 176.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -68.06 -38.94 83.0 Favored 'General case' 1 N--CA 1.541 4.089 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 175.341 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.51 -23.8 58.99 Favored 'General case' 1 N--CA 1.544 4.247 0 C-N-CA 123.459 0.704 . . . . 0.0 110.643 175.734 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -120.88 2.73 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.493 0 C-N-CA 123.375 0.67 . . . . 0.0 112.617 -177.143 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -109.57 -56.95 2.24 Favored 'General case' 0 N--CA 1.518 2.935 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 177.117 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.3 tp -50.2 -44.93 53.24 Favored 'General case' 0 N--CA 1.531 3.591 0 C-N-CA 125.149 1.38 . . . . 0.0 111.491 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -80.6 -55.59 4.75 Favored 'General case' 0 N--CA 1.524 3.267 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 N--CA 1.523 3.189 0 CA-C-O 118.761 -0.638 . . . . 0.0 109.992 -179.584 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.503 2.185 0 CA-C-O 119.209 -0.424 . . . . 0.0 109.914 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 58.5 m -110.01 109.57 59.04 Favored Pre-proline 0 N--CA 1.518 2.938 0 CA-C-O 118.031 -0.985 . . . . 0.0 108.666 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -70.09 130.8 19.55 Favored 'Trans proline' 0 C--N 1.394 2.943 0 C-N-CA 122.696 2.264 . . . . 0.0 110.443 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -99.72 140.57 33.73 Favored 'General case' 0 N--CA 1.524 3.272 0 C-N-CA 122.878 0.471 . . . . 0.0 110.579 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 60.8 m 67.35 -82.45 0.03 OUTLIER 'General case' 0 N--CA 1.528 3.432 0 C-N-CA 125.067 1.347 . . . . 0.0 112.627 178.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -114.92 167.09 11.09 Favored 'General case' 0 N--CA 1.53 3.57 0 CA-C-N 119.549 1.068 . . . . 0.0 112.993 -177.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -118.57 144.34 46.17 Favored 'General case' 0 N--CA 1.526 3.341 0 C-N-CA 123.675 0.79 . . . . 0.0 110.678 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 31.7 mtt -100.54 149.39 23.76 Favored 'General case' 0 N--CA 1.537 3.883 0 C-N-CA 123.155 0.582 . . . . 0.0 110.553 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -136.8 -53.64 0.71 Allowed 'General case' 0 N--CA 1.524 3.232 0 CA-C-O 118.965 -0.54 . . . . 0.0 111.208 -179.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -103.52 149.77 24.55 Favored 'General case' 0 N--CA 1.533 3.695 0 CA-C-N 118.439 0.563 . . . . 0.0 111.989 -178.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -148.32 132.03 16.93 Favored 'General case' 0 N--CA 1.526 3.352 0 C-N-CA 123.519 0.728 . . . . 0.0 109.449 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 86.8 mtt-85 65.79 134.49 0.02 OUTLIER 'General case' 1 N--CA 1.542 4.166 0 C-N-CA 124.601 1.16 . . . . 0.0 110.707 -179.112 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 -152.53 118.93 5.59 Favored 'General case' 0 N--CA 1.527 3.395 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 178.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -104.22 136.08 44.49 Favored 'General case' 0 N--CA 1.525 3.324 0 C-N-CA 122.744 0.417 . . . . 0.0 110.965 -178.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -128.55 -61.23 1.08 Allowed 'General case' 0 N--CA 1.52 3.047 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 178.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 519' ' ' TRP . . . . . . . . . . . . . 63.1 t-105 -42.54 -26.43 0.12 Allowed 'General case' 1 N--CA 1.552 4.64 0 C-N-CA 124.558 1.143 . . . . 0.0 113.753 178.523 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 520' ' ' LEU . . . . . 0.408 ' CD2' ' N ' ' B' ' 520' ' ' LEU . 2.4 mm? -93.88 -34.29 13.18 Favored 'General case' 0 N--CA 1.526 3.369 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -172.299 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.58 -25.02 68.04 Favored 'General case' 0 N--CA 1.534 3.755 0 N-CA-C 106.291 -1.744 . . . . 0.0 106.291 172.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . 0.421 ' CE2' ' HA2' ' A' ' 52' ' ' GLY . 2.2 m-85 -78.74 -37.33 41.56 Favored 'General case' 0 N--CA 1.513 2.716 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 173.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 25.4 t -66.4 -23.35 31.46 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.232 0 CA-C-N 120.169 1.349 . . . . 0.0 111.646 179.103 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -75.19 -49.38 19.61 Favored 'General case' 0 N--CA 1.536 3.849 0 CA-C-N 120.063 1.301 . . . . 0.0 108.345 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 1.8 tp -65.5 -29.31 69.94 Favored 'General case' 1 N--CA 1.54 4.05 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 176.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.41 -33.05 73.54 Favored 'General case' 0 N--CA 1.522 3.171 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 177.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 31.0 ttmt -65.89 -25.52 67.21 Favored 'General case' 0 N--CA 1.519 3.01 0 CA-C-O 118.387 -0.816 . . . . 0.0 111.144 177.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -69.22 -39.94 78.28 Favored 'General case' 0 N--CA 1.536 3.829 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 176.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 529' ' ' ALA . . . . . . . . . . . . . . . -88.63 -9.5 51.93 Favored 'General case' 0 N--CA 1.506 2.367 0 CA-C-O 118.417 -0.802 . . . . 0.0 111.295 178.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -81.61 -32.9 31.79 Favored 'General case' 0 N--CA 1.532 3.625 0 CA-C-N 120.439 1.472 . . . . 0.0 108.733 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -61.6 -44.43 97.02 Favored 'General case' 0 N--CA 1.538 3.944 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 176.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 61.4 m-80 -91.56 -86.45 0.22 Allowed 'General case' 0 N--CA 1.517 2.878 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 177.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 150.72 52.41 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.855 0 C-N-CA 128.027 2.531 . . . . 0.0 107.818 178.179 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 4.8 mt -111.08 10.65 22.02 Favored 'General case' 0 N--CA 1.528 3.429 0 C-N-CA 124.558 1.143 . . . . 0.0 110.831 -178.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 535' ' ' HIS . . . . . . . . . . . . . 39.9 p-80 -82.43 -0.32 45.67 Favored 'General case' 0 N--CA 1.517 2.888 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 174.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 536' ' ' LEU . . . . . 0.429 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 34.6 mt -93.96 -51.63 0.26 Allowed Pre-proline 0 N--CA 1.504 2.266 0 CA-C-O 116.728 -1.606 . . . . 0.0 108.952 -175.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 537' ' ' PRO . . . . . 0.429 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 6.3 Cg_exo -66.19 -33.86 38.43 Favored 'Trans proline' 0 C--N 1.394 2.941 0 C-N-CA 122.158 1.906 . . . . 0.0 107.235 171.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.07 -45.69 87.6 Favored 'General case' 0 N--CA 1.521 3.108 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 176.292 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . 0.262 2.2 pp -81.89 -2.86 52.67 Favored 'General case' 1 N--CA 1.542 4.161 0 CA-C-N 118.824 0.738 . . . . 0.0 111.9 178.392 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -81.51 -12.01 58.99 Favored 'General case' 0 N--CA 1.518 2.946 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 172.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -108.3 -45.05 3.99 Favored 'General case' 0 N--CA 1.512 2.635 0 C-N-CA 124.476 1.11 . . . . 0.0 109.639 -178.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 12.2 ptp -84.51 -28.28 26.81 Favored 'General case' 1 N--CA 1.546 4.326 0 CA-C-O 117.61 -1.186 . . . . 0.0 111.988 -178.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 5.7 mp -107.35 -99.14 0.36 Allowed 'General case' 0 N--CA 1.527 3.392 0 CA-C-O 117.111 -1.423 . . . . 0.0 112.759 -176.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 3.1 t 153.77 147.48 0.0 OUTLIER Pre-proline 1 N--CA 1.574 5.774 0 C-N-CA 126.224 1.809 . . . . 0.0 109.023 -177.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -58.67 -34.33 98.84 Favored 'Trans proline' 0 N--CA 1.524 3.301 0 C-N-CA 123.32 2.68 . . . . 0.0 113.502 -179.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -57.79 -30.02 65.35 Favored 'General case' 1 N--CA 1.542 4.135 0 CA-C-N 118.508 0.594 . . . . 0.0 111.479 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -67.86 -38.5 83.19 Favored 'General case' 0 N--CA 1.526 3.33 0 CA-C-O 118.307 -0.854 . . . . 0.0 110.6 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 4.2 ptt180 -76.44 -20.85 56.64 Favored 'General case' 0 N--CA 1.529 3.492 0 CA-C-O 118.135 -0.936 . . . . 0.0 111.289 178.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -65.57 -49.37 69.08 Favored 'General case' 0 N--CA 1.537 3.908 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 174.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -77.58 -13.88 59.8 Favored 'General case' 0 N--CA 1.511 2.598 0 CA-C-O 117.073 -1.441 . . . . 0.0 111.817 178.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 551' ' ' LEU . . . . . 0.5 HD22 ' CG ' ' A' ' 22' ' ' PHE . 11.7 tp -79.13 -30.39 43.66 Favored 'General case' 0 N--CA 1.53 3.529 0 CA-C-N 120.817 1.644 . . . . 0.0 107.73 175.028 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -71.15 -56.9 6.56 Favored Glycine 0 N--CA 1.498 2.783 0 N-CA-C 108.949 -1.661 . . . . 0.0 108.949 178.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 3.1 m -64.43 -31.29 72.44 Favored 'General case' 1 N--CA 1.541 4.092 0 CA-C-O 118.337 -0.839 . . . . 0.0 112.059 -179.169 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -65.5 -50.6 64.69 Favored 'General case' 1 N--CA 1.546 4.369 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 176.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 32.0 t -66.05 -15.98 19.87 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.849 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.03 177.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 18.6 mmt180 -79.82 -44.32 20.79 Favored 'General case' 0 N--CA 1.526 3.363 0 CA-C-O 117.327 -1.321 . . . . 0.0 111.319 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 557' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -24.58 21.41 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.186 0 CA-C-N 121.425 1.921 . . . . 0.0 110.406 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 558' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -86.22 -53.47 10.3 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.073 0 CA-C-N 119.997 1.271 . . . . 0.0 107.635 -179.739 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -61.36 -22.04 64.58 Favored 'General case' 0 N--CA 1.532 3.636 0 CA-C-O 118.497 -0.763 . . . . 0.0 110.971 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -93.81 -24.78 17.65 Favored 'General case' 0 N--CA 1.523 3.183 0 CA-C-O 118.081 -0.961 . . . . 0.0 110.07 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 14.3 tp -71.01 -53.77 13.6 Favored 'General case' 0 N--CA 1.535 3.813 0 CA-C-N 119.708 1.14 . . . . 0.0 108.255 178.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 36.5 mt -48.62 -30.1 5.04 Favored 'General case' 1 N--CA 1.543 4.218 0 C-N-CA 124.157 0.983 . . . . 0.0 112.583 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 20.5 mmm180 -79.68 -49.89 11.44 Favored 'General case' 0 N--CA 1.53 3.546 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 72.11 89.19 0.13 Allowed Glycine 1 N--CA 1.52 4.274 0 CA-C-O 119.346 -0.697 . . . . 0.0 111.822 178.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -155.87 -55.82 0.09 Allowed 'General case' 0 N--CA 1.528 3.428 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 2.1 ptt? -147.84 66.34 1.11 Allowed 'General case' 0 N--CA 1.527 3.388 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 178.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 7.6 t -125.55 -15.41 6.09 Favored 'General case' 0 N--CA 1.519 3.001 0 CA-C-O 117.484 -1.246 . . . . 0.0 114.05 -176.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -98.81 -55.43 2.72 Favored 'General case' 0 N--CA 1.533 3.703 0 CA-C-N 120.803 1.638 . . . . 0.0 111.582 -178.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -107.49 -38.48 5.91 Favored 'General case' 0 N--CA 1.532 3.641 0 C-N-CA 123.433 0.693 . . . . 0.0 111.728 -177.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -81.52 -8.71 59.76 Favored 'General case' 0 N--CA 1.518 2.966 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -176.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 26.1 tp -85.85 -48.6 8.61 Favored 'General case' 0 N--CA 1.535 3.783 0 CA-C-N 120.306 1.412 . . . . 0.0 112.973 -177.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -45.57 -29.54 1.22 Allowed 'General case' 1 N--CA 1.555 4.784 0 CA-C-N 120.23 1.377 . . . . 0.0 113.866 -177.517 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -67.09 -41.53 86.15 Favored 'General case' 1 N--CA 1.54 4.034 0 CA-C-N 118.819 0.736 . . . . 0.0 110.26 -179.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -48.41 -62.22 1.61 Allowed 'General case' 0 N--CA 1.529 3.5 0 C-N-CA 125.167 1.387 . . . . 0.0 113.157 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 3.4 pp -119.09 -39.76 2.89 Favored 'General case' 0 N--CA 1.532 3.666 0 CA-C-N 118.736 0.698 . . . . 0.0 111.705 -179.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 120.62 37.24 0.74 Allowed Glycine 1 N--CA 1.527 4.729 0 CA-C-O 118.572 -1.127 . . . . 0.0 111.953 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -89.23 108.52 19.66 Favored 'General case' 0 N--CA 1.521 3.109 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 177.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -43.13 170.33 0.01 OUTLIER Glycine 1 N--CA 1.53 4.903 0 C-N-CA 125.095 1.331 . . . . 0.0 115.685 -177.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 579' ' ' ILE . . . . . 0.441 HG23 ' N6 ' ' E' ' 4' ' ' ' DA' . 0.5 OUTLIER -84.14 -15.57 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.642 0 CA-C-O 117.549 -1.215 . . . . 0.0 108.724 177.464 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 580' ' ' ALA . . . . . 0.402 ' HB3' ' H62' ' F' ' 15' ' ' ' DA' . . . -70.09 -38.65 75.72 Favored 'General case' 0 N--CA 1.523 3.217 0 CA-C-N 120.213 1.37 . . . . 0.0 108.951 176.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -79.66 -36.3 37.93 Favored 'General case' 0 N--CA 1.539 3.996 0 CA-C-N 118.609 0.641 . . . . 0.0 112.247 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 1.6 tt -71.01 -37.67 68.69 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.212 0 C-N-CA 122.9 0.48 . . . . 0.0 111.601 -175.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 65.0 p -98.25 -23.56 15.61 Favored 'General case' 0 N--CA 1.512 2.633 0 CA-C-O 117.968 -1.015 . . . . 0.0 111.746 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 13.8 ptt180 -79.7 -22.06 43.85 Favored 'General case' 0 N--CA 1.531 3.622 0 CA-C-N 120.164 1.347 . . . . 0.0 108.355 173.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -65.36 -33.63 87.14 Favored Glycine 1 N--CA 1.519 4.214 0 N-CA-C 108.975 -1.65 . . . . 0.0 108.975 175.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 83.0 p -64.1 -32.79 74.48 Favored 'General case' 0 N--CA 1.537 3.9 0 CA-C-N 118.224 1.012 . . . . 0.0 109.97 176.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -62.1 -31.53 71.99 Favored 'General case' 0 N--CA 1.538 3.962 0 C-N-CA 123.501 0.72 . . . . 0.0 110.826 178.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 50.3 m -63.17 -43.19 98.95 Favored 'General case' 1 N--CA 1.541 4.096 0 C-N-CA 123.379 0.672 . . . . 0.0 110.318 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 36.1 mt -54.86 -44.74 74.27 Favored 'General case' 0 N--CA 1.527 3.38 0 C-N-CA 124.015 0.926 . . . . 0.0 110.96 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -29.08 66.67 Favored 'General case' 0 N--CA 1.537 3.876 0 CA-C-O 118.76 -0.638 . . . . 0.0 111.135 178.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -64.84 -42.9 94.54 Favored 'General case' 0 N--CA 1.528 3.47 0 CA-C-N 118.737 0.699 . . . . 0.0 110.957 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -65.44 162.7 39.41 Favored Pre-proline 0 N--CA 1.534 3.767 0 CA-C-O 118.426 -0.797 . . . . 0.0 112.165 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -79.23 179.77 6.13 Favored 'Trans proline' 0 C--N 1.38 2.185 0 C-N-CA 122.02 1.813 . . . . 0.0 111.081 178.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -94.27 -26.36 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.306 0 CA-C-O 118.01 -0.995 . . . . 0.0 111.495 -178.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -61.39 -45.1 95.77 Favored 'General case' 0 N--CA 1.517 2.898 0 CA-C-N 119.837 1.198 . . . . 0.0 109.47 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 6.9 mp -97.06 -9.09 28.78 Favored 'General case' 0 N--CA 1.508 2.466 0 C-N-CA 123.233 0.613 . . . . 0.0 111.843 179.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.68 -39.18 93.22 Favored 'General case' 1 N--CA 1.548 4.464 0 N-CA-C 102.516 -3.142 . . . . 0.0 102.516 167.456 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -49.84 -36.77 27.96 Favored 'General case' 0 N--CA 1.519 2.985 0 C-N-CA 124.311 1.044 . . . . 0.0 111.676 174.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 599' ' ' TRP . . . . . 0.458 ' HA ' ' HB2' ' B' ' 602' ' ' GLU . 39.0 t90 -64.5 -40.67 96.09 Favored 'General case' 0 N--CA 1.528 3.468 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 178.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 10.6 mp -54.17 -32.83 56.55 Favored 'General case' 1 N--CA 1.544 4.228 0 CA-C-N 118.92 0.782 . . . . 0.0 109.226 176.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -74.96 -34.56 62.05 Favored 'General case' 0 N--CA 1.528 3.468 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 176.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 602' ' ' GLU . . . . . 0.458 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.5 OUTLIER -63.99 -22.77 67.07 Favored 'General case' 1 N--CA 1.549 4.501 0 C-N-CA 124.903 1.281 . . . . 0.0 111.405 175.969 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -108.8 -20.77 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.611 0 CA-C-O 118.01 -0.995 . . . . 0.0 112.231 -175.067 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 7.2 mp -88.78 -58.68 2.46 Favored 'General case' 0 N--CA 1.523 3.193 0 N-CA-C 105.499 -2.038 . . . . 0.0 105.499 175.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -76.3 -66.06 0.85 Allowed 'General case' 0 N--CA 1.528 3.457 0 C-N-CA 123.636 0.774 . . . . 0.0 110.658 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 82.5 mttt 89.48 -52.66 0.02 OUTLIER 'General case' 1 N--CA 1.544 4.248 0 C-N-CA 127.265 2.226 . . . . 0.0 109.061 -177.373 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 7.6 t . . . . . 0 N--CA 1.523 3.2 0 CA-C-O 118.013 -0.994 . . . . 0.0 109.795 179.852 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.166 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.17 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.423 -9.543 3 O4'-C1'-N19 119.44 14.55 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.591 5 O4'-C1'-N19 119.902 15.128 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.42 -9.798 3 O4'-C1'-N19 119.732 14.914 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . 0.406 ' H61' HG23 ' B' ' 579' ' ' ILE . . . . . . . . 6 C3'--C2' 1.416 -10.242 3 O4'-C1'-N19 120.369 15.711 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' E' E ' 5' ' ' ' DC' . . . . . 0.491 ' H41' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 5 O3'--C3' 1.564 10.193 3 C4'-C3'-C2' 117.188 13.988 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.406 -11.229 5 O4'-C1'-N19 119.787 14.984 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' E' E ' 7' ' ' ' DA' . . . . . 0.668 H2'' " H5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.4 -11.812 4 C4'-C3'-C2' 114.279 11.079 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' E' E ' 8' ' ' ' DG' . . . . . 0.668 " H5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 O3'--C3' 1.559 9.835 4 O4'-C1'-N19 117.886 12.607 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 O3'--C3' 1.579 11.356 5 O4'-C1'-N19 119.469 14.586 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.404 -11.394 6 O4'-C1'-N19 119.526 14.657 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.402 -11.566 4 O4'-C1'-N19 120.382 15.727 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.505 3 O4'-C1'-N19 120.383 15.728 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.594 4 O4'-C1'-N19 118.886 13.858 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' E' E ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.567 10.489 4 C4'-C3'-C2' 117.012 13.812 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' E' E ' 15' ' ' ' DA' . . . . . 0.404 ' H62' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.425 -9.347 5 O4'-C1'-N19 119.35 14.438 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.418 -10.002 3 O4'-C1'-N19 120.196 15.495 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.563 10.18 2 O4'-C1'-N19 119.424 14.53 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.604 4 O4'-C1'-N19 120.013 15.266 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.42 -9.784 4 O4'-C1'-N19 119.629 14.786 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.505 6.538 3 O4'-C1'-N19 119.577 14.721 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.179 2 O4'-C1'-N19 119.494 14.618 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.571 10.804 5 C4'-C3'-C2' 116.172 12.972 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -10.047 4 O4'-C1'-N19 120.195 15.493 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' F' F ' 4' ' ' ' DA' . . . . . 0.409 ' H61' HG23 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.415 -10.314 2 O4'-C1'-N19 119.168 14.21 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' F' F ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.574 11.032 5 O4'-C1'-N19 119.309 14.386 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.399 -11.851 5 O4'-C1'-N19 118.825 13.782 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' F' F ' 7' ' ' ' DA' . . . . . 0.734 H2'' H5'' ' F' ' 8' ' ' ' DG' . . . . . . . . 4 O3'--C3' 1.572 10.861 3 N19-C1'-C2' 136.11 13.694 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' F' F ' 8' ' ' ' DG' . . . . . 0.734 H5'' H2'' ' F' ' 7' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.41 -10.752 5 O4'-C1'-N19 120.358 15.698 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.416 -10.203 5 O4'-C1'-N19 119.987 15.233 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.405 -11.285 4 O4'-C1'-N19 119.29 14.363 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.415 -10.321 4 O4'-C1'-N19 121.153 16.692 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.146 2 O4'-C1'-N19 120.315 15.644 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.417 -10.096 5 O4'-C1'-N19 119.054 14.068 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' F' F ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.818 5 O4'-C1'-N19 119.289 14.361 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' F' F ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.428 -9.026 3 O4'-C1'-N19 120.194 15.493 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.419 -9.888 4 O4'-C1'-N19 119.026 14.033 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.249 5 O4'-C1'-N19 119.497 14.622 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.174 5 O4'-C1'-N19 120.264 15.579 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.574 5 O4'-C1'-N19 120.747 16.184 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.513 7.192 4 O4'-C1'-N19 120.125 15.407 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 . . . . . 0 N--CA 1.501 2.097 0 N-CA-C 110.693 -0.114 . . . . 0.0 110.693 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 88.9 p 52.7 103.8 0.03 OUTLIER Pre-proline 0 N--CA 1.532 3.633 0 C-N-CA 125.078 1.351 . . . . 0.0 112.888 178.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -82.29 141.6 11.55 Favored 'Trans proline' 0 C--N 1.389 2.691 0 C-N-CA 122.918 2.412 . . . . 0.0 110.668 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -106.12 -63.47 1.26 Allowed 'General case' 0 N--CA 1.521 3.092 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 178.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 7.2 t -136.94 119.61 16.11 Favored 'General case' 0 N--CA 1.522 3.148 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -145.5 -50.94 0.25 Allowed 'General case' 0 N--CA 1.52 3.062 0 CA-C-O 119.169 -0.443 . . . . 0.0 111.332 -178.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -100.45 -54.29 2.89 Favored 'General case' 0 N--CA 1.524 3.262 0 CA-C-O 119.262 -0.399 . . . . 0.0 111.348 -178.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 14.1 ttt 67.39 126.45 0.02 OUTLIER 'General case' 1 N--CA 1.54 4.064 0 C-N-CA 124.207 1.003 . . . . 0.0 109.858 -179.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -108.06 154.57 21.48 Favored 'General case' 0 N--CA 1.528 3.429 0 C-N-CA 123.162 0.585 . . . . 0.0 111.669 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -83.73 -51.19 7.45 Favored 'General case' 0 N--CA 1.523 3.213 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -108.67 144.26 36.67 Favored 'General case' 0 N--CA 1.53 3.556 0 C-N-CA 123.171 0.588 . . . . 0.0 110.578 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -116.59 126.78 53.77 Favored 'General case' 0 N--CA 1.521 3.087 0 C-N-CA 123.605 0.762 . . . . 0.0 109.314 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.2 t60 60.46 155.64 0.03 OUTLIER 'General case' 1 N--CA 1.54 4.046 0 C-N-CA 124.746 1.218 . . . . 0.0 112.311 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -92.02 149.86 21.29 Favored 'General case' 0 N--CA 1.537 3.908 0 C-N-CA 122.89 0.476 . . . . 0.0 110.762 -179.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -115.13 -90.39 0.54 Allowed 'General case' 0 N--CA 1.521 3.092 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.476 ' HA ' HD21 ' B' ' 551' ' ' LEU . 74.4 t-105 -50.62 -39.5 50.37 Favored 'General case' 0 N--CA 1.538 3.945 0 CA-C-N 119.572 1.078 . . . . 0.0 110.969 178.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -81.18 -27.7 35.28 Favored 'General case' 0 N--CA 1.524 3.271 0 CA-C-O 117.792 -1.099 . . . . 0.0 112.387 -174.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.31 -28.12 66.51 Favored 'General case' 1 N--CA 1.54 4.072 0 N-CA-C 106.306 -1.738 . . . . 0.0 106.306 172.338 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.457 ' CG ' HD22 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -82.52 -37.46 25.21 Favored 'General case' 0 N--CA 1.503 2.215 0 CA-C-O 116.755 -1.593 . . . . 0.0 108.822 173.778 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.9 t -67.06 -25.37 34.01 Favored 'Isoleucine or valine' 1 N--CA 1.563 5.215 0 CA-C-N 121.283 1.856 . . . . 0.0 112.444 -176.255 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -78.03 -51.46 10.29 Favored 'General case' 0 N--CA 1.534 3.736 0 CA-C-N 119.901 1.228 . . . . 0.0 107.916 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.94 -19.83 65.79 Favored 'General case' 0 N--CA 1.537 3.889 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 176.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.36 -40.4 67.35 Favored 'General case' 0 N--CA 1.515 2.797 0 CA-C-O 117.873 -1.06 . . . . 0.0 108.153 177.465 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -59.77 -20.96 59.9 Favored 'General case' 0 N--CA 1.531 3.603 0 CA-C-O 118.3 -0.857 . . . . 0.0 111.42 176.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -73.6 -43.63 59.2 Favored 'General case' 0 N--CA 1.531 3.603 0 CA-C-N 119.273 0.942 . . . . 0.0 108.684 176.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.404 ' HB2' ' N ' ' A' ' 35' ' ' HIS . . . -89.5 -1.53 58.07 Favored 'General case' 0 N--CA 1.511 2.6 0 CA-C-O 118.818 -0.61 . . . . 0.0 110.843 177.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -89.03 -34.64 16.73 Favored 'General case' 0 N--CA 1.533 3.683 0 CA-C-N 120.003 1.274 . . . . 0.0 108.594 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -65.04 -40.58 94.98 Favored 'General case' 0 N--CA 1.532 3.635 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 176.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 -89.99 -89.46 0.16 Allowed 'General case' 0 N--CA 1.513 2.709 0 N-CA-C 106.766 -1.568 . . . . 0.0 106.766 176.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 p30 153.11 44.64 0.0 OUTLIER 'General case' 1 N--CA 1.561 5.103 0 C-N-CA 127.504 2.322 . . . . 0.0 109.034 177.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.1 mt -103.08 15.14 30.16 Favored 'General case' 0 N--CA 1.524 3.268 0 C-N-CA 123.966 0.907 . . . . 0.0 110.901 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.511 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 54.5 p-80 -84.91 5.5 28.71 Favored 'General case' 0 CA--C 1.594 2.648 0 C-N-CA 123.38 0.672 . . . . 0.0 109.22 174.844 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.417 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 18.9 mt -95.53 -49.58 0.25 Allowed Pre-proline 0 N--CA 1.508 2.466 0 C-N-CA 125.792 1.637 . . . . 0.0 109.031 -175.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.417 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 4.4 Cg_exo -67.21 -37.32 18.64 Favored 'Trans proline' 0 C--N 1.388 2.64 0 N-CA-C 106.053 -2.326 . . . . 0.0 106.053 169.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.511 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 1.9 tm? -60.64 -36.75 79.42 Favored 'General case' 0 N--CA 1.53 3.565 0 C-N-CA 124.058 0.943 . . . . 0.0 108.839 175.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.18 -49.43 77.9 Favored 'General case' 1 N--CA 1.553 4.71 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 176.134 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.5 t30 -59.28 -15.59 16.63 Favored 'General case' 0 N--CA 1.536 3.832 0 CA-C-O 118.113 -0.946 . . . . 0.0 113.52 -178.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -103.72 -46.77 4.42 Favored 'General case' 0 N--CA 1.522 3.133 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 -177.178 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.3 ptt? -122.04 14.87 10.71 Favored 'General case' 1 N--CA 1.554 4.748 0 CA-C-N 120.014 1.279 . . . . 0.0 113.016 -174.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.7 mp -123.06 -48.97 1.97 Allowed 'General case' 0 N--CA 1.494 1.725 0 CA-C-O 117.702 -1.142 . . . . 0.0 110.432 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 77.5 p 107.27 158.94 0.0 OUTLIER Pre-proline 1 N--CA 1.566 5.333 0 C-N-CA 127.642 2.377 . . . . 0.0 110.919 -179.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo -71.86 -32.14 11.8 Favored 'Trans proline' 0 C--N 1.391 2.789 0 C-N-CA 122.145 1.897 . . . . 0.0 107.371 172.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -69.03 -14.79 63.24 Favored 'General case' 0 N--CA 1.521 3.114 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.695 176.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -77.94 -40.74 38.54 Favored 'General case' 0 N--CA 1.514 2.744 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 177.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.9 ptt-85 -83.36 -11.5 57.56 Favored 'General case' 0 N--CA 1.532 3.662 0 CA-C-N 119.253 0.933 . . . . 0.0 109.933 175.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -74.12 -39.44 63.34 Favored 'General case' 0 N--CA 1.525 3.302 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 174.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -84.24 -31.4 25.02 Favored 'General case' 0 N--CA 1.501 2.102 0 CA-C-O 117.432 -1.271 . . . . 0.0 110.357 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 17.9 tp -70.35 -25.53 63.32 Favored 'General case' 1 N--CA 1.545 4.28 0 CA-C-N 120.961 1.71 . . . . 0.0 106.82 173.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.402 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -65.28 -73.45 0.59 Allowed Glycine 0 N--CA 1.507 3.382 0 C-N-CA 125.56 1.552 . . . . 0.0 111.295 176.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 m -69.66 -25.56 63.96 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-O 117.736 -1.126 . . . . 0.0 113.159 -177.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 36.7 mtm180 -71.54 -48.34 49.29 Favored 'General case' 0 N--CA 1.53 3.529 0 CA-C-N 120.101 1.319 . . . . 0.0 107.849 178.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.6 t -67.06 -18.07 23.64 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.042 0 CA-C-N 119.543 1.065 . . . . 0.0 109.684 175.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.82 -48.46 31.16 Favored 'General case' 0 N--CA 1.529 3.52 0 CA-C-N 119.828 1.195 . . . . 0.0 111.559 178.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.93 -24.84 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.555 0 CA-C-N 120.619 1.554 . . . . 0.0 111.378 -178.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -85.01 -49.33 15.79 Favored 'Isoleucine or valine' 1 N--CA 1.546 4.354 0 CA-C-N 120.419 1.463 . . . . 0.0 107.666 -179.228 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -62.04 -27.33 68.81 Favored 'General case' 0 N--CA 1.528 3.441 0 CA-C-O 118.917 -0.563 . . . . 0.0 109.961 178.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -91.21 -19.62 22.84 Favored 'General case' 0 N--CA 1.521 3.106 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.683 177.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.2 mt -76.68 -47.09 23.16 Favored 'General case' 0 N--CA 1.537 3.91 0 CA-C-N 119.71 1.141 . . . . 0.0 108.55 178.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 47.4 mt -52.6 -27.6 17.59 Favored 'General case' 0 N--CA 1.539 3.986 0 C-N-CA 124.366 1.066 . . . . 0.0 112.319 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 27.9 mmm180 -92.31 -48.61 6.58 Favored 'General case' 0 N--CA 1.526 3.333 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.4 79.3 0.46 Allowed Glycine 1 N--CA 1.52 4.241 0 CA-C-O 119.433 -0.648 . . . . 0.0 111.933 178.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -143.74 -59.44 0.4 Allowed 'General case' 0 N--CA 1.524 3.265 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 38.5 mtt -137.0 70.62 1.4 Allowed 'General case' 0 N--CA 1.522 3.149 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 178.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 9.7 t -128.77 -25.39 2.84 Favored 'General case' 0 N--CA 1.524 3.237 0 CA-C-O 117.573 -1.203 . . . . 0.0 113.634 -176.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -104.48 -59.89 1.67 Allowed 'General case' 0 N--CA 1.531 3.589 0 CA-C-N 120.166 1.348 . . . . 0.0 112.352 -176.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.79 -62.83 1.37 Allowed 'General case' 0 N--CA 1.527 3.421 0 C-N-CA 122.916 0.486 . . . . 0.0 111.741 -176.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -73.7 -3.54 28.91 Favored 'General case' 0 N--CA 1.52 3.033 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -176.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 46.2 tp -78.51 -51.38 10.06 Favored 'General case' 0 N--CA 1.525 3.308 0 CA-C-N 120.35 1.432 . . . . 0.0 112.683 -178.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -44.65 -31.29 1.11 Allowed 'General case' 1 N--CA 1.547 4.418 0 CA-C-N 119.612 1.096 . . . . 0.0 113.787 -176.538 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 25.2 t30 -71.67 -41.09 69.14 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-N 118.389 0.54 . . . . 0.0 110.459 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -62.97 -56.43 17.21 Favored 'General case' 0 N--CA 1.524 3.235 0 C-N-CA 124.076 0.95 . . . . 0.0 112.667 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 42.7 mt -99.54 -53.44 3.2 Favored 'General case' 0 N--CA 1.531 3.599 0 C-N-CA 123.013 0.525 . . . . 0.0 111.6 -177.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 117.23 25.49 3.22 Favored Glycine 1 N--CA 1.525 4.619 0 CA-C-O 118.392 -1.226 . . . . 0.0 111.186 -177.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -93.51 119.93 33.17 Favored 'General case' 0 N--CA 1.515 2.804 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 178.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -45.24 171.3 0.01 OUTLIER Glycine 1 N--CA 1.533 5.103 0 C-N-CA 124.253 0.93 . . . . 0.0 115.07 -178.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.409 HG23 ' H61' ' F' ' 4' ' ' ' DA' . 0.6 OUTLIER -80.21 -17.1 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.907 0 CA-C-O 117.9 -1.047 . . . . 0.0 108.594 178.126 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.404 ' HB3' ' H62' ' E' ' 15' ' ' ' DA' . . . -69.33 -36.12 76.61 Favored 'General case' 0 N--CA 1.524 3.234 0 CA-C-N 119.584 1.083 . . . . 0.0 110.747 178.058 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.7 p -80.21 -42.16 23.82 Favored 'General case' 0 N--CA 1.536 3.864 0 CA-C-N 119.315 0.961 . . . . 0.0 111.526 -179.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.8 pt -71.68 -17.32 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.903 0 CA-C-O 117.597 -1.192 . . . . 0.0 113.632 -177.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 63.3 p -111.85 -28.89 7.88 Favored 'General case' 0 N--CA 1.515 2.821 0 CA-C-N 120.039 1.29 . . . . 0.0 110.833 178.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.6 ptt180 -76.4 -22.01 55.27 Favored 'General case' 0 N--CA 1.524 3.274 0 CA-C-N 119.605 1.093 . . . . 0.0 108.175 174.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -62.13 -36.07 92.42 Favored Glycine 1 N--CA 1.516 4.023 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 177.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 74.5 p -66.5 -33.09 74.92 Favored 'General case' 0 N--CA 1.535 3.783 0 CA-C-N 118.27 1.035 . . . . 0.0 109.971 176.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -61.21 -32.74 72.51 Favored 'General case' 1 N--CA 1.543 4.179 0 C-N-CA 123.474 0.71 . . . . 0.0 111.307 178.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.1 m -58.79 -38.51 78.72 Favored 'General case' 1 N--CA 1.545 4.321 0 C-N-CA 123.5 0.72 . . . . 0.0 111.179 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 12.8 mt -58.86 -41.49 87.12 Favored 'General case' 0 N--CA 1.532 3.647 0 C-N-CA 124.303 1.041 . . . . 0.0 111.084 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.7 -20.54 65.8 Favored 'General case' 1 N--CA 1.539 4.013 0 CA-C-O 118.439 -0.791 . . . . 0.0 112.416 -179.669 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -86.54 -43.7 12.51 Favored 'General case' 0 N--CA 1.514 2.735 0 CA-C-N 118.876 0.762 . . . . 0.0 110.196 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.11 163.9 9.37 Favored Pre-proline 1 N--CA 1.543 4.192 0 CA-C-O 118.09 -0.957 . . . . 0.0 112.508 179.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -84.41 166.74 12.18 Favored 'Trans proline' 0 C--N 1.381 2.268 0 C-N-CA 121.886 1.724 . . . . 0.0 111.131 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 t -91.59 -23.08 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.075 0 CA-C-O 117.663 -1.161 . . . . 0.0 111.374 -179.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -61.15 -42.82 99.24 Favored 'General case' 0 N--CA 1.518 2.955 0 CA-C-N 120.316 1.416 . . . . 0.0 109.894 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.2 mp -98.08 -13.17 21.15 Favored 'General case' 0 N--CA 1.512 2.647 0 C-N-CA 123.527 0.731 . . . . 0.0 111.851 178.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -32.35 73.68 Favored 'General case' 1 N--CA 1.541 4.081 0 N-CA-C 103.397 -2.816 . . . . 0.0 103.397 167.732 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -53.93 -38.53 65.0 Favored 'General case' 0 N--CA 1.515 2.818 0 C-N-CA 124.735 1.214 . . . . 0.0 110.384 174.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.426 ' HA ' ' HB2' ' A' ' 102' ' ' GLU . 48.6 t90 -65.32 -37.94 88.63 Favored 'General case' 0 N--CA 1.53 3.542 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 176.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.35 -36.2 52.95 Favored 'General case' 1 N--CA 1.541 4.125 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 176.402 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -70.69 -38.42 73.71 Favored 'General case' 0 N--CA 1.539 3.989 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 175.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.426 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 2.6 mt-10 -58.62 -22.77 57.4 Favored 'General case' 1 N--CA 1.544 4.226 0 C-N-CA 123.938 0.895 . . . . 0.0 110.926 175.473 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -110.16 -2.68 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.332 0 CA-C-O 117.968 -1.015 . . . . 0.0 113.482 -175.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 7.0 mp -114.04 -61.37 1.75 Allowed 'General case' 0 N--CA 1.523 3.188 0 N-CA-C 106.419 -1.697 . . . . 0.0 106.419 174.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.5 tt -47.52 -55.33 9.38 Favored 'General case' 1 N--CA 1.546 4.37 0 C-N-CA 125.056 1.343 . . . . 0.0 112.875 -178.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.72 -58.63 3.16 Favored 'General case' 0 N--CA 1.53 3.531 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 -179.516 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 5.6 t . . . . . 0 N--CA 1.525 3.305 0 CA-C-O 118.119 -0.944 . . . . 0.0 110.314 -179.961 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 19.4 mm100 . . . . . 0 N--CA 1.504 2.232 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 75.6 m -101.9 122.09 48.51 Favored Pre-proline 0 N--CA 1.522 3.161 0 CA-C-O 117.415 -1.278 . . . . 0.0 109.206 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -76.88 -53.42 0.07 OUTLIER 'Trans proline' 0 C--N 1.391 2.816 0 C-N-CA 122.587 2.191 . . . . 0.0 109.528 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -107.05 128.13 54.09 Favored 'General case' 0 N--CA 1.521 3.112 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 37.9 p -147.35 -49.74 0.18 Allowed 'General case' 0 N--CA 1.523 3.203 0 C-N-CA 122.695 0.398 . . . . 0.0 110.134 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . 66.02 136.64 0.02 OUTLIER 'General case' 0 N--CA 1.537 3.876 0 C-N-CA 124.369 1.068 . . . . 0.0 111.148 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -134.37 144.85 48.47 Favored 'General case' 0 N--CA 1.525 3.313 0 C-N-CA 123.231 0.612 . . . . 0.0 111.017 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 35.1 mtt 65.41 135.55 0.02 OUTLIER 'General case' 0 N--CA 1.539 3.997 0 C-N-CA 124.757 1.223 . . . . 0.0 111.255 179.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -140.94 -49.6 0.43 Allowed 'General case' 0 N--CA 1.522 3.166 0 C-N-CA 122.953 0.501 . . . . 0.0 110.564 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -128.9 131.52 47.6 Favored 'General case' 0 N--CA 1.525 3.317 0 C-N-CA 123.014 0.525 . . . . 0.0 110.051 -179.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 -86.11 125.7 33.66 Favored 'General case' 0 N--CA 1.523 3.211 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 178.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 4.9 ttp180 -148.83 143.85 26.57 Favored 'General case' 0 N--CA 1.529 3.501 0 CA-C-N 117.855 0.298 . . . . 0.0 111.223 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 62.1 102.85 0.03 OUTLIER 'General case' 0 N--CA 1.535 3.79 0 C-N-CA 124.538 1.135 . . . . 0.0 110.626 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 23.4 tt0 -115.47 -102.34 0.42 Allowed 'General case' 0 N--CA 1.517 2.91 0 CA-C-O 117.674 -1.155 . . . . 0.0 108.114 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -149.13 -62.88 0.23 Allowed 'General case' 0 N--CA 1.525 3.324 0 CA-C-N 120.481 1.492 . . . . 0.0 108.324 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 519' ' ' TRP . . . . . 0.466 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 63.4 t-105 -42.8 -27.58 0.19 Allowed 'General case' 1 N--CA 1.543 4.198 0 C-N-CA 124.213 1.005 . . . . 0.0 113.667 178.828 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 520' ' ' LEU . . . . . 0.416 ' CD2' ' N ' ' B' ' 520' ' ' LEU . 2.3 mm? -91.83 -33.38 14.98 Favored 'General case' 0 N--CA 1.523 3.221 0 CA-C-O 117.613 -1.184 . . . . 0.0 113.738 -171.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 16.0 ttp180 -64.79 -23.08 67.13 Favored 'General case' 0 N--CA 1.531 3.594 0 N-CA-C 106.125 -1.806 . . . . 0.0 106.125 171.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . 0.466 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.1 m-85 -78.04 -37.88 45.84 Favored 'General case' 0 N--CA 1.512 2.665 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 173.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 44.9 t -67.2 -20.09 26.34 Favored 'Isoleucine or valine' 1 N--CA 1.559 4.992 0 CA-C-O 117.799 -1.096 . . . . 0.0 111.352 177.366 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -76.52 -53.2 8.42 Favored 'General case' 0 N--CA 1.531 3.621 0 CA-C-N 120.337 1.426 . . . . 0.0 108.058 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 6.2 mp -67.57 -21.5 65.44 Favored 'General case' 0 N--CA 1.533 3.685 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 175.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -69.78 -36.06 75.41 Favored 'General case' 0 N--CA 1.519 3.02 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 176.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 9.6 tttt -67.31 -23.29 65.63 Favored 'General case' 0 N--CA 1.521 3.08 0 CA-C-O 118.409 -0.805 . . . . 0.0 110.905 176.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -72.21 -40.87 67.5 Favored 'General case' 0 N--CA 1.533 3.7 0 CA-C-N 119.151 0.887 . . . . 0.0 109.59 178.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 529' ' ' ALA . . . . . . . . . . . . . . . -86.79 -13.75 44.24 Favored 'General case' 0 N--CA 1.509 2.49 0 CA-C-O 118.719 -0.658 . . . . 0.0 110.517 178.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -74.99 -29.69 60.95 Favored 'General case' 0 N--CA 1.536 3.838 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 177.696 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -61.94 -49.62 75.39 Favored 'General case' 0 N--CA 1.532 3.659 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 177.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -91.95 -87.93 0.21 Allowed 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 177.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.6 p30 155.8 51.77 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.84 0 C-N-CA 127.325 2.25 . . . . 0.0 107.54 177.479 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 7.1 mt -109.95 11.33 24.12 Favored 'General case' 0 N--CA 1.529 3.523 0 C-N-CA 124.54 1.136 . . . . 0.0 110.988 -178.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 535' ' ' HIS . . . . . 0.404 ' HA ' ' HB3' ' B' ' 538' ' ' LEU . 40.7 p-80 -82.9 2.53 34.0 Favored 'General case' 0 N--CA 1.515 2.792 0 C-N-CA 123.419 0.688 . . . . 0.0 109.235 175.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 536' ' ' LEU . . . . . 0.409 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 36.4 mt -97.15 -50.69 0.23 Allowed Pre-proline 0 N--CA 1.509 2.507 0 CA-C-O 116.854 -1.546 . . . . 0.0 109.22 -175.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 537' ' ' PRO . . . . . 0.409 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 3.9 Cg_exo -68.68 -29.93 28.78 Favored 'Trans proline' 0 C--N 1.391 2.795 0 N-CA-C 106.79 -2.042 . . . . 0.0 106.79 171.086 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 538' ' ' LEU . . . . . 0.404 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 0.6 OUTLIER -65.28 -45.32 84.94 Favored 'General case' 0 N--CA 1.512 2.658 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 175.36 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 1.1 pp -76.52 -7.97 56.24 Favored 'General case' 0 N--CA 1.536 3.861 0 CA-C-N 118.992 0.814 . . . . 0.0 111.828 177.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -84.78 -0.69 54.66 Favored 'General case' 0 N--CA 1.525 3.303 0 CA-C-N 119.195 0.907 . . . . 0.0 109.635 175.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -118.72 -48.37 2.48 Favored 'General case' 0 N--CA 1.512 2.671 0 C-N-CA 125.039 1.336 . . . . 0.0 108.724 -178.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 4.0 ptm -101.3 11.86 38.51 Favored 'General case' 0 N--CA 1.538 3.932 0 CA-C-O 118.584 -0.722 . . . . 0.0 112.83 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -129.58 -86.24 0.54 Allowed 'General case' 0 N--CA 1.526 3.348 0 CA-C-O 117.322 -1.323 . . . . 0.0 112.182 -179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 7.8 p 137.08 137.39 0.0 OUTLIER Pre-proline 1 N--CA 1.569 5.515 0 C-N-CA 127.8 2.44 . . . . 0.0 107.289 -178.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -62.55 -29.65 78.57 Favored 'Trans proline' 0 N--CA 1.516 2.835 0 C-N-CA 122.839 2.359 . . . . 0.0 112.964 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -62.8 -28.5 70.04 Favored 'General case' 1 N--CA 1.54 4.069 0 CA-C-N 118.744 0.702 . . . . 0.0 111.282 179.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -70.72 -41.87 71.32 Favored 'General case' 0 N--CA 1.525 3.322 0 CA-C-O 118.712 -0.661 . . . . 0.0 109.918 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -72.9 -21.97 60.82 Favored 'General case' 0 N--CA 1.529 3.494 0 CA-C-O 118.273 -0.87 . . . . 0.0 111.276 177.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -66.36 -50.88 62.03 Favored 'General case' 1 N--CA 1.54 4.062 0 N-CA-C 106.614 -1.625 . . . . 0.0 106.614 175.634 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -76.55 -9.86 58.97 Favored 'General case' 0 N--CA 1.508 2.465 0 CA-C-O 117.363 -1.303 . . . . 0.0 111.026 177.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 551' ' ' LEU . . . . . 0.476 HD21 ' HA ' ' A' ' 19' ' ' TRP . 5.8 tp -79.88 -31.5 40.35 Favored 'General case' 0 N--CA 1.516 2.827 0 CA-C-N 120.158 1.344 . . . . 0.0 107.68 174.224 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -70.49 -56.17 7.88 Favored Glycine 0 N--CA 1.51 3.577 0 N-CA-C 108.68 -1.768 . . . . 0.0 108.68 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.5 m -64.88 -27.98 69.23 Favored 'General case' 0 N--CA 1.537 3.882 0 CA-C-O 118.043 -0.979 . . . . 0.0 112.042 -179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 6.5 mtm180 -69.26 -49.84 52.48 Favored 'General case' 1 N--CA 1.543 4.188 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 176.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 23.6 t -65.71 -16.89 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.679 0 CA-C-O 118.067 -0.968 . . . . 0.0 109.532 176.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 11.7 mtt180 -78.16 -47.29 18.45 Favored 'General case' 0 N--CA 1.521 3.113 0 CA-C-O 117.43 -1.271 . . . . 0.0 111.257 178.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 557' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.75 -22.66 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.527 0 CA-C-N 121.456 1.934 . . . . 0.0 110.918 -179.297 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 558' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -85.8 -51.05 13.84 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.002 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 179.979 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -57.26 -26.17 60.37 Favored 'General case' 0 N--CA 1.536 3.835 0 CA-C-O 118.543 -0.742 . . . . 0.0 110.178 177.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -90.39 -28.35 18.73 Favored 'General case' 0 N--CA 1.529 3.512 0 CA-C-O 118.586 -0.721 . . . . 0.0 109.749 177.412 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 6.8 mt -66.37 -44.01 84.34 Favored 'General case' 1 N--CA 1.546 4.342 0 CA-C-N 118.96 0.8 . . . . 0.0 109.552 178.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 14.7 mt -60.7 -22.91 64.44 Favored 'General case' 0 N--CA 1.534 3.761 0 C-N-CA 124.159 0.984 . . . . 0.0 111.795 179.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -82.62 -48.36 11.03 Favored 'General case' 0 N--CA 1.525 3.307 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 66.4 79.56 0.2 Allowed Glycine 1 N--CA 1.526 4.641 0 CA-C-O 119.318 -0.712 . . . . 0.0 111.663 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -155.8 -51.57 0.08 Allowed 'General case' 0 N--CA 1.527 3.388 0 CA-C-N 117.463 0.632 . . . . 0.0 109.56 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 10.5 ptt? -152.99 63.33 0.78 Allowed 'General case' 0 N--CA 1.527 3.419 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 78.6 p -130.63 3.19 4.54 Favored 'General case' 0 N--CA 1.522 3.131 0 CA-C-N 115.166 -0.924 . . . . 0.0 113.257 -176.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 42.4 mm-40 -110.02 -55.16 2.48 Favored 'General case' 0 N--CA 1.522 3.157 0 CA-C-N 119.579 1.081 . . . . 0.0 111.873 -178.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.94 -58.87 1.8 Allowed 'General case' 0 N--CA 1.529 3.52 0 CA-C-N 118.125 0.42 . . . . 0.0 111.875 -177.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -73.64 0.44 12.76 Favored 'General case' 0 N--CA 1.517 2.904 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -176.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 15.7 tp -77.67 -45.59 24.48 Favored 'General case' 0 N--CA 1.524 3.227 0 CA-C-N 120.299 1.409 . . . . 0.0 110.515 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.65 -37.01 65.17 Favored 'General case' 1 N--CA 1.544 4.233 0 CA-C-N 120.002 1.274 . . . . 0.0 110.889 178.303 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 31.0 t30 -61.71 -38.54 88.24 Favored 'General case' 0 N--CA 1.535 3.788 0 C-N-CA 123.154 0.581 . . . . 0.0 110.109 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -65.01 -64.01 0.97 Allowed 'General case' 0 N--CA 1.518 2.93 0 C-N-CA 124.078 0.951 . . . . 0.0 110.663 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 5.5 mp -97.81 -68.2 0.81 Allowed 'General case' 0 N--CA 1.522 3.13 0 C-N-CA 123.374 0.67 . . . . 0.0 111.044 -179.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 133.05 50.16 0.09 OUTLIER Glycine 1 N--CA 1.517 4.083 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 -178.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -111.18 114.72 28.16 Favored 'General case' 0 N--CA 1.52 3.067 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 178.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -41.88 167.34 0.01 OUTLIER Glycine 1 N--CA 1.535 5.267 0 C-N-CA 124.819 1.2 . . . . 0.0 115.914 -176.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 579' ' ' ILE . . . . . 0.491 HG21 ' H41' ' E' ' 5' ' ' ' DC' . 1.1 mp -81.86 -16.94 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.094 0 CA-C-O 117.643 -1.17 . . . . 0.0 108.438 176.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -68.74 -37.92 79.78 Favored 'General case' 0 N--CA 1.526 3.371 0 CA-C-N 120.047 1.294 . . . . 0.0 108.87 176.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.1 p -79.7 -37.24 36.14 Favored 'General case' 0 N--CA 1.534 3.733 0 C-N-CA 123.191 0.597 . . . . 0.0 112.544 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -70.86 -37.73 69.62 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.35 0 C-N-CA 123.336 0.654 . . . . 0.0 111.343 -175.096 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 82.3 p -95.22 -28.78 14.85 Favored 'General case' 0 N--CA 1.513 2.699 0 CA-C-O 117.987 -1.006 . . . . 0.0 111.003 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 14.2 ptt180 -74.65 -21.58 59.35 Favored 'General case' 0 N--CA 1.528 3.469 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 173.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -69.11 -26.49 74.62 Favored Glycine 1 N--CA 1.517 4.071 0 N-CA-C 108.464 -1.854 . . . . 0.0 108.464 173.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 16.4 m -68.41 -36.78 79.58 Favored 'General case' 1 N--CA 1.539 4.01 0 CA-C-N 118.293 1.046 . . . . 0.0 108.862 176.365 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -62.19 -22.35 65.84 Favored 'General case' 0 N--CA 1.539 3.977 0 C-N-CA 123.182 0.593 . . . . 0.0 110.478 176.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 62.4 m -47.63 -47.54 29.05 Favored 'General case' 1 N--CA 1.544 4.226 0 C-N-CA 124.97 1.308 . . . . 0.0 111.091 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 28.0 mt -69.58 -41.14 76.19 Favored 'General case' 0 N--CA 1.519 2.986 0 C-N-CA 123.655 0.782 . . . . 0.0 109.974 178.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 12.1 mmpt? -55.3 -29.11 57.57 Favored 'General case' 1 N--CA 1.545 4.297 0 C-N-CA 123.684 0.794 . . . . 0.0 112.361 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -82.81 -44.8 15.1 Favored 'General case' 0 N--CA 1.515 2.792 0 C-N-CA 123.104 0.562 . . . . 0.0 110.586 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -70.08 158.9 86.26 Favored Pre-proline 0 N--CA 1.53 3.544 0 CA-C-O 118.518 -0.753 . . . . 0.0 112.496 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -81.2 176.29 8.94 Favored 'Trans proline' 0 C--N 1.379 2.142 0 C-N-CA 122.273 1.982 . . . . 0.0 111.064 178.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.1 t -89.81 -26.71 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.522 3.149 0 CA-C-O 117.708 -1.139 . . . . 0.0 111.609 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -62.75 -39.17 93.29 Favored 'General case' 0 N--CA 1.516 2.852 0 CA-C-N 120.159 1.345 . . . . 0.0 109.872 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 6.7 mp -100.26 -11.04 20.7 Favored 'General case' 0 N--CA 1.514 2.74 0 C-N-CA 123.564 0.746 . . . . 0.0 112.103 177.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -33.3 75.36 Favored 'General case' 1 N--CA 1.543 4.207 0 N-CA-C 102.344 -3.206 . . . . 0.0 102.344 165.996 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -56.63 -36.57 69.64 Favored 'General case' 0 N--CA 1.52 3.043 0 C-N-CA 124.712 1.205 . . . . 0.0 110.465 174.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 599' ' ' TRP . . . . . 0.404 ' HA ' ' HB2' ' B' ' 602' ' ' GLU . 35.4 t90 -63.25 -37.06 85.75 Favored 'General case' 1 N--CA 1.54 4.053 0 N-CA-C 107.092 -1.447 . . . . 0.0 107.092 176.439 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.79 -35.89 57.35 Favored 'General case' 0 N--CA 1.538 3.957 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 176.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -71.28 -37.0 71.89 Favored 'General case' 1 N--CA 1.541 4.111 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 175.366 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 602' ' ' GLU . . . . . 0.404 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 2.7 mt-10 -60.34 -22.87 63.74 Favored 'General case' 1 N--CA 1.544 4.247 0 C-N-CA 123.5 0.72 . . . . 0.0 109.861 174.656 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -115.48 1.65 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.407 0 CA-C-O 118.423 -0.798 . . . . 0.0 112.471 -177.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 42.8 mt -108.28 -64.85 1.18 Allowed 'General case' 0 N--CA 1.523 3.212 0 N-CA-C 104.666 -2.346 . . . . 0.0 104.666 174.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 6.4 tp -48.57 -34.9 12.34 Favored 'General case' 0 N--CA 1.537 3.875 0 C-N-CA 125.442 1.497 . . . . 0.0 111.912 178.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt 86.87 -36.84 0.03 OUTLIER 'General case' 1 N--CA 1.541 4.103 0 C-N-CA 125.999 1.72 . . . . 0.0 111.608 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 60.1 m . . . . . 1 N--CA 1.542 4.126 0 C-N-CA 124.573 1.149 . . . . 0.0 111.257 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.135 0 CA-C-O 118.27 -0.871 . . . . 0.0 109.581 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.188 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.559 9.869 2 O4'-C1'-N19 119.777 14.971 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.448 6 O4'-C1'-N19 119.285 14.356 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.79 2 C4'-C3'-C2' 117.359 14.159 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . 0.421 ' N6 ' HG22 ' B' ' 579' ' ' ILE . . . . . . . . 4 C3'--C2' 1.422 -9.616 5 O4'-C1'-N19 120.564 15.955 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' E' E ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.577 11.238 5 C4'-C3'-C2' 116.291 13.091 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.405 -11.292 4 O4'-C1'-N19 118.42 13.276 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' E' E ' 7' ' ' ' DA' . . . . . 0.566 H2'' " H5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.396 -12.219 5 C4'-C3'-C2' 111.87 8.67 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' E' E ' 8' ' ' ' DG' . . . . . 0.566 " H5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 O3'--C3' 1.578 11.289 4 O4'-C1'-N19 118.154 12.942 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.408 -10.95 5 O4'-C1'-N19 119.416 14.52 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.412 -10.563 4 O4'-C1'-N19 119.929 15.161 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.396 3 O4'-C1'-N19 119.764 14.954 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.283 4 O4'-C1'-N19 118.701 13.627 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.414 -10.4 5 O4'-C1'-N19 118.989 13.986 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' E' E ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.258 3 O4'-C1'-N19 119.109 14.136 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' E' E ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.426 -9.155 5 O4'-C1'-N19 119.818 15.023 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.419 -9.886 5 O4'-C1'-N19 119.24 14.3 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.569 10.6 4 O4'-C1'-N19 120.038 15.297 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.616 5 O4'-C1'-N19 120.14 15.425 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.409 -10.91 4 O4'-C1'-N19 120.729 16.161 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.512 7.077 4 O4'-C1'-N19 118.908 13.885 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.568 10.516 3 C4'-C3'-C2' 116.521 13.321 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.412 -10.591 5 O4'-C1'-N19 119.282 14.353 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.554 4 O4'-C1'-N19 120.178 15.472 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' F' F ' 4' ' ' ' DA' . . . . . 0.488 ' N6 ' HG22 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.419 -9.868 5 O4'-C1'-N19 119.438 14.547 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' F' F ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.148 4 O4'-C1'-N19 119.639 14.799 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -10.979 5 O4'-C1'-N19 119.309 14.386 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.425 -10.328 3 C4'-C3'-C2' 113.65 10.45 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.422 -9.589 4 O4'-C1'-N19 119.476 14.595 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.594 5 O4'-C1'-N19 119.621 14.777 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.406 -11.17 4 O4'-C1'-N19 118.391 13.239 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.421 -9.746 4 O4'-C1'-N19 120.803 16.254 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.564 10.225 2 O4'-C1'-N19 120.384 15.73 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.403 -11.525 5 O4'-C1'-N19 118.092 12.865 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' F' F ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.413 -10.525 3 O4'-C1'-N19 118.676 13.595 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' F' F ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.34 6 O4'-C1'-N19 119.99 15.237 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.419 -9.938 5 O4'-C1'-N19 120.089 15.362 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.421 -9.73 3 O4'-C1'-N19 119.422 14.527 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.568 4 O4'-C1'-N19 119.347 14.434 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.778 5 O4'-C1'-N19 119.916 15.145 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.514 7.244 3 O4'-C1'-N19 119.669 14.836 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 . . . . . 0 N--CA 1.502 2.15 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.5 t -116.3 145.71 35.69 Favored Pre-proline 0 N--CA 1.527 3.422 0 CA-C-O 118.061 -0.971 . . . . 0.0 111.33 -179.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -68.29 136.35 36.9 Favored 'Trans proline' 0 C--N 1.394 2.955 0 C-N-CA 122.759 2.306 . . . . 0.0 112.306 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -122.87 -55.67 1.79 Allowed 'General case' 0 N--CA 1.517 2.887 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 72.5 m -131.56 121.8 25.02 Favored 'General case' 0 N--CA 1.518 2.938 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 178.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -106.06 125.14 50.64 Favored 'General case' 0 N--CA 1.518 2.97 0 C-N-CA 122.831 0.453 . . . . 0.0 109.868 -178.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -162.69 129.73 3.63 Favored 'General case' 0 N--CA 1.527 3.391 0 C-N-CA 122.808 0.443 . . . . 0.0 110.442 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 72.3 mtp -107.94 -68.56 0.9 Allowed 'General case' 0 N--CA 1.523 3.198 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -164.51 144.58 7.66 Favored 'General case' 0 N--CA 1.53 3.529 0 CA-C-N 118.444 0.565 . . . . 0.0 111.832 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -127.15 -60.55 1.2 Allowed 'General case' 0 N--CA 1.519 3.011 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 178.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -140.9 114.45 8.82 Favored 'General case' 0 N--CA 1.523 3.197 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 178.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.7 mmt180 -134.92 -53.4 0.8 Allowed 'General case' 0 N--CA 1.523 3.215 0 CA-C-O 119.178 -0.439 . . . . 0.0 110.045 -178.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -110.8 130.05 55.68 Favored 'General case' 0 N--CA 1.528 3.427 0 C-N-CA 123.054 0.541 . . . . 0.0 109.58 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -106.34 119.29 38.87 Favored 'General case' 0 N--CA 1.519 3.005 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -126.81 -82.06 0.61 Allowed 'General case' 0 N--CA 1.52 3.064 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.425 ' CZ3' HD23 ' B' ' 551' ' ' LEU . 76.4 t-105 -51.03 -42.35 60.41 Favored 'General case' 0 N--CA 1.532 3.625 0 C-N-CA 123.359 0.664 . . . . 0.0 110.085 176.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -77.77 -28.18 50.49 Favored 'General case' 0 N--CA 1.516 2.833 0 O-C-N 124.925 1.391 . . . . 0.0 112.112 -176.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 27.7 tpt180 -57.9 -27.76 63.6 Favored 'General case' 1 N--CA 1.539 4.005 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 173.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.499 ' CG ' HD22 ' B' ' 551' ' ' LEU . 0.1 OUTLIER -81.6 -39.56 24.33 Favored 'General case' 0 N--CA 1.509 2.495 0 CA-C-O 117.092 -1.432 . . . . 0.0 108.829 172.876 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 26.3 t -66.97 -38.67 81.83 Favored 'Isoleucine or valine' 1 N--CA 1.561 5.085 0 CA-C-N 120.207 1.367 . . . . 0.0 113.478 -174.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -67.79 -50.87 54.61 Favored 'General case' 1 N--CA 1.542 4.135 0 CA-C-N 120.027 1.285 . . . . 0.0 109.349 -178.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.1 mp -69.86 -17.47 63.37 Favored 'General case' 0 N--CA 1.533 3.709 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 175.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.08 -37.82 84.64 Favored 'General case' 0 N--CA 1.519 3.004 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 175.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.9 ttmt -63.44 -23.48 67.42 Favored 'General case' 0 N--CA 1.526 3.348 0 CA-C-O 118.303 -0.856 . . . . 0.0 111.385 177.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -70.88 -41.89 70.74 Favored 'General case' 0 N--CA 1.534 3.751 0 CA-C-N 119.221 0.919 . . . . 0.0 108.525 176.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.459 ' HB2' ' N ' ' A' ' 35' ' ' HIS . . . -89.24 -3.28 58.61 Favored 'General case' 0 CA--C 1.581 2.153 0 CA-C-O 118.446 -0.788 . . . . 0.0 110.672 177.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -86.5 -36.72 18.84 Favored 'General case' 0 N--CA 1.534 3.739 0 CA-C-N 120.513 1.506 . . . . 0.0 108.832 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -59.78 -44.33 93.97 Favored 'General case' 0 N--CA 1.536 3.853 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 177.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -87.44 -86.47 0.16 Allowed 'General case' 0 N--CA 1.514 2.741 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 176.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 p30 149.31 45.15 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.912 0 C-N-CA 127.656 2.382 . . . . 0.0 109.109 177.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.7 mt -104.79 15.33 28.07 Favored 'General case' 0 N--CA 1.528 3.436 0 C-N-CA 124.177 0.991 . . . . 0.0 110.25 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.497 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 48.9 p-80 -84.7 6.64 23.42 Favored 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 175.115 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.488 ' HA ' HD22 ' A' ' 39' ' ' LEU . 26.7 mt -95.58 -52.29 0.23 Allowed Pre-proline 0 N--CA 1.501 2.097 0 CA-C-O 116.942 -1.504 . . . . 0.0 108.633 -175.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.452 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 4.3 Cg_exo -67.16 -33.5 31.06 Favored 'Trans proline' 0 C--N 1.39 2.726 0 N-CA-C 106.64 -2.1 . . . . 0.0 106.64 170.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.497 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.6 OUTLIER -63.45 -40.64 97.68 Favored 'General case' 0 N--CA 1.517 2.884 0 CA-C-O 118.01 -0.995 . . . . 0.0 109.203 176.887 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.488 HD22 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -75.91 -18.45 59.37 Favored 'General case' 1 N--CA 1.544 4.231 0 CA-C-N 119.921 1.237 . . . . 0.0 110.46 177.333 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -80.09 -7.39 58.86 Favored 'General case' 0 N--CA 1.525 3.325 0 CA-C-N 119.45 1.023 . . . . 0.0 110.062 175.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -106.46 -60.26 1.68 Allowed 'General case' 0 N--CA 1.521 3.112 0 C-N-CA 124.019 0.927 . . . . 0.0 111.58 -178.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 13.5 ptt? -93.47 3.76 55.05 Favored 'General case' 1 N--CA 1.546 4.353 0 CA-C-N 119.442 1.019 . . . . 0.0 113.504 -177.056 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.1 mp -120.73 -94.63 0.5 Allowed 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 178.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 156.55 169.82 0.01 OUTLIER Pre-proline 1 N--CA 1.575 5.801 0 C-N-CA 125.747 1.619 . . . . 0.0 109.685 179.706 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -68.29 -37.37 14.02 Favored 'Trans proline' 0 C--N 1.392 2.841 0 C-N-CA 121.918 1.745 . . . . 0.0 108.099 174.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -64.25 -22.33 66.91 Favored 'General case' 0 N--CA 1.527 3.404 0 C-N-CA 123.518 0.727 . . . . 0.0 110.418 176.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -70.22 -38.45 75.25 Favored 'General case' 0 N--CA 1.524 3.257 0 CA-C-O 117.438 -1.267 . . . . 0.0 109.867 178.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 26.1 ptt180 -80.91 -17.34 50.92 Favored 'General case' 0 N--CA 1.539 3.986 0 CA-C-N 119.992 1.269 . . . . 0.0 108.32 173.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -74.47 -18.63 60.6 Favored 'General case' 0 N--CA 1.52 3.045 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 172.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.14 -46.81 8.21 Favored 'General case' 0 N--CA 1.504 2.264 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 178.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.475 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 23.6 tp -66.81 -21.12 66.04 Favored 'General case' 1 N--CA 1.546 4.357 0 CA-C-N 120.613 1.551 . . . . 0.0 108.005 173.966 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.406 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -71.04 -72.21 0.93 Allowed Glycine 0 N--CA 1.502 3.089 0 C-N-CA 125.707 1.623 . . . . 0.0 111.421 177.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.9 m -70.18 -25.21 63.32 Favored 'General case' 0 N--CA 1.532 3.659 0 CA-C-O 117.639 -1.172 . . . . 0.0 112.526 -177.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -73.61 -51.8 15.59 Favored 'General case' 0 N--CA 1.53 3.539 0 CA-C-N 120.213 1.37 . . . . 0.0 107.545 177.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.2 t -62.23 -18.41 19.97 Favored 'Isoleucine or valine' 1 N--CA 1.545 4.309 0 CA-C-N 119.472 1.033 . . . . 0.0 109.853 175.067 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.6 mmm180 -75.86 -48.48 21.3 Favored 'General case' 0 N--CA 1.517 2.897 0 CA-C-O 117.343 -1.313 . . . . 0.0 111.903 178.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -71.32 -21.63 21.89 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.439 0 CA-C-N 121.171 1.805 . . . . 0.0 111.303 -178.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -87.69 -52.01 11.97 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.011 0 CA-C-N 119.96 1.255 . . . . 0.0 107.869 -178.91 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -62.73 -21.6 65.92 Favored 'General case' 0 N--CA 1.528 3.474 0 CA-C-O 118.58 -0.724 . . . . 0.0 110.202 177.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -91.86 -23.96 19.49 Favored 'General case' 0 N--CA 1.526 3.338 0 CA-C-O 118.082 -0.961 . . . . 0.0 110.273 177.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.6 mt -77.62 -61.86 1.85 Allowed 'General case' 0 N--CA 1.535 3.801 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 178.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.3 tt -43.4 -37.85 2.51 Favored 'General case' 1 N--CA 1.545 4.321 0 C-N-CA 125.98 1.712 . . . . 0.0 112.798 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -87.99 -62.64 1.45 Allowed 'General case' 0 N--CA 1.524 3.269 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.17 83.29 1.43 Allowed Glycine 0 N--CA 1.513 3.821 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 179.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -131.21 -58.3 1.0 Allowed 'General case' 0 N--CA 1.521 3.12 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 15.1 ptt? -154.4 82.32 1.12 Allowed 'General case' 0 N--CA 1.522 3.159 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 178.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 3.8 t -130.0 -9.52 4.35 Favored 'General case' 0 N--CA 1.523 3.214 0 CA-C-O 117.993 -1.003 . . . . 0.0 113.464 -176.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -106.75 -65.27 1.1 Allowed 'General case' 0 N--CA 1.533 3.71 0 CA-C-N 120.437 1.472 . . . . 0.0 111.54 -177.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.4 mtt180 -104.71 -45.88 4.48 Favored 'General case' 0 N--CA 1.53 3.533 0 C-N-CA 123.148 0.579 . . . . 0.0 109.843 -178.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -66.82 -10.35 46.96 Favored 'General case' 0 N--CA 1.52 3.062 0 CA-C-O 118.376 -0.821 . . . . 0.0 112.962 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 28.6 tp -88.73 -55.44 3.71 Favored 'General case' 0 N--CA 1.524 3.234 0 CA-C-N 119.748 1.158 . . . . 0.0 113.186 -177.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -37.99 -37.47 0.26 Allowed 'General case' 1 N--CA 1.552 4.664 0 N-CA-C 114.217 1.192 . . . . 0.0 114.217 -177.118 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -73.72 -44.11 57.3 Favored 'General case' 0 N--CA 1.533 3.687 0 CA-C-N 118.158 0.435 . . . . 0.0 110.411 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -46.57 -49.51 18.69 Favored 'General case' 0 N--CA 1.533 3.692 0 C-N-CA 124.888 1.275 . . . . 0.0 113.49 -179.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.4 pp -132.34 -43.0 0.95 Allowed 'General case' 0 N--CA 1.532 3.656 0 CA-C-O 118.803 -0.618 . . . . 0.0 111.974 -178.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 111.62 74.88 0.74 Allowed Glycine 1 N--CA 1.525 4.61 0 N-CA-C 110.588 -1.005 . . . . 0.0 110.588 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.68 -37.48 5.9 Favored 'General case' 0 N--CA 1.526 3.334 0 C-N-CA 123.409 0.684 . . . . 0.0 110.528 179.047 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 100.16 163.8 28.66 Favored Glycine 1 N--CA 1.523 4.459 0 N-CA-C 109.429 -1.468 . . . . 0.0 109.429 -177.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.488 HG22 ' N6 ' ' F' ' 4' ' ' ' DA' . 3.0 mt -86.57 -11.49 11.1 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.664 0 CA-C-N 119.403 1.602 . . . . 0.0 109.296 178.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.34 -36.93 68.95 Favored 'General case' 0 N--CA 1.526 3.326 0 CA-C-N 119.93 1.241 . . . . 0.0 110.49 176.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.2 p -83.93 -39.18 20.1 Favored 'General case' 1 N--CA 1.541 4.081 0 CA-C-N 119.517 1.053 . . . . 0.0 112.227 -179.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.8 pt -73.28 -14.79 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.718 0 CA-C-O 117.85 -1.071 . . . . 0.0 112.938 -177.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 50.3 p -112.6 -33.18 6.22 Favored 'General case' 0 N--CA 1.514 2.755 0 CA-C-N 119.951 1.251 . . . . 0.0 110.184 178.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 13.8 ptt180 -72.81 -21.46 60.97 Favored 'General case' 0 N--CA 1.532 3.659 0 CA-C-N 119.464 1.029 . . . . 0.0 108.426 174.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -64.73 -33.49 87.37 Favored Glycine 1 N--CA 1.52 4.249 0 N-CA-C 109.313 -1.515 . . . . 0.0 109.313 175.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.6 t -63.96 -33.18 75.15 Favored 'General case' 1 N--CA 1.539 4.021 0 CA-C-N 118.282 1.041 . . . . 0.0 109.748 176.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -55.65 -33.8 64.39 Favored 'General case' 1 N--CA 1.547 4.376 0 C-N-CA 123.335 0.654 . . . . 0.0 111.285 177.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.7 m -62.15 -34.71 76.91 Favored 'General case' 1 N--CA 1.54 4.043 0 C-N-CA 123.728 0.811 . . . . 0.0 112.114 -179.56 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.3 mt -56.13 -42.32 76.73 Favored 'General case' 0 N--CA 1.536 3.831 0 C-N-CA 123.892 0.877 . . . . 0.0 111.166 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -21.53 61.49 Favored 'General case' 0 N--CA 1.534 3.739 0 CA-C-O 118.244 -0.884 . . . . 0.0 112.116 -179.401 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.76 -41.65 26.17 Favored 'General case' 0 N--CA 1.517 2.892 0 CA-C-N 119.157 0.889 . . . . 0.0 111.669 -179.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.17 159.9 13.56 Favored Pre-proline 1 N--CA 1.543 4.203 0 CA-C-O 118.471 -0.776 . . . . 0.0 113.079 -178.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -85.1 157.22 11.32 Favored 'Trans proline' 0 C--N 1.379 2.183 0 C-N-CA 122.285 1.99 . . . . 0.0 110.261 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 t -78.54 -27.71 14.22 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.114 0 CA-C-O 117.873 -1.061 . . . . 0.0 111.102 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -58.82 -44.21 90.79 Favored 'General case' 0 N--CA 1.518 2.932 0 CA-C-N 120.173 1.351 . . . . 0.0 109.949 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.7 mp -100.18 -7.46 24.73 Favored 'General case' 0 N--CA 1.512 2.667 0 CA-C-O 118.362 -0.827 . . . . 0.0 112.71 177.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -35.86 81.9 Favored 'General case' 0 N--CA 1.539 3.979 0 N-CA-C 102.361 -3.2 . . . . 0.0 102.361 168.048 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.59 -40.39 65.64 Favored 'General case' 0 N--CA 1.515 2.794 0 C-N-CA 124.492 1.117 . . . . 0.0 111.332 174.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 51.5 t90 -64.47 -35.59 81.44 Favored 'General case' 1 N--CA 1.541 4.09 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 177.601 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.57 -37.69 63.17 Favored 'General case' 0 N--CA 1.533 3.681 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 176.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -69.0 -37.24 78.6 Favored 'General case' 1 N--CA 1.539 4.016 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 175.5 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.15 -25.31 61.32 Favored 'General case' 1 N--CA 1.542 4.156 0 C-N-CA 123.089 0.556 . . . . 0.0 110.067 175.575 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -120.37 5.51 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.482 0 C-N-CA 123.592 0.757 . . . . 0.0 112.792 -176.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -125.45 -56.85 1.5 Allowed 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 178.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 4.1 tt -46.99 -66.99 0.32 Allowed 'General case' 1 N--CA 1.544 4.273 0 C-N-CA 124.914 1.286 . . . . 0.0 113.524 -179.136 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 72.0 tttt -106.61 -66.99 0.97 Allowed 'General case' 0 N--CA 1.526 3.375 0 CA-C-N 118.649 0.659 . . . . 0.0 111.525 -177.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 49.1 p . . . . . 0 N--CA 1.532 3.643 0 CA-C-O 118.104 -0.95 . . . . 0.0 111.41 -178.078 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 . . . . . 0 N--CA 1.501 2.102 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 5.3 t -114.24 127.95 26.31 Favored Pre-proline 0 N--CA 1.523 3.211 0 CA-C-O 117.411 -1.281 . . . . 0.0 108.97 179.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -63.73 117.97 4.93 Favored 'Trans proline' 0 C--N 1.395 3.022 0 C-N-CA 122.748 2.299 . . . . 0.0 111.922 -179.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -153.65 119.8 5.43 Favored 'General case' 0 N--CA 1.521 3.087 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 73.4 m -124.47 130.52 52.62 Favored 'General case' 0 N--CA 1.52 3.067 0 C-N-CA 122.933 0.493 . . . . 0.0 110.007 -178.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -106.12 -44.69 4.51 Favored 'General case' 0 N--CA 1.519 2.994 0 C-N-CA 123.093 0.557 . . . . 0.0 109.886 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -113.88 128.61 56.48 Favored 'General case' 0 N--CA 1.518 2.931 0 C-N-CA 123.217 0.607 . . . . 0.0 110.338 -179.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 46.9 ttm -147.31 -55.96 0.24 Allowed 'General case' 0 N--CA 1.522 3.172 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -113.82 -45.44 3.09 Favored 'General case' 0 N--CA 1.518 2.956 0 C-N-CA 123.728 0.811 . . . . 0.0 109.076 178.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -106.82 128.37 54.2 Favored 'General case' 0 N--CA 1.523 3.178 0 C-N-CA 123.257 0.623 . . . . 0.0 109.772 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -110.3 -56.62 2.31 Favored 'General case' 0 N--CA 1.518 2.957 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -145.85 124.53 12.56 Favored 'General case' 0 N--CA 1.532 3.638 0 C-N-CA 123.262 0.625 . . . . 0.0 109.835 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 33.8 p-80 -78.01 131.03 37.18 Favored 'General case' 0 N--CA 1.533 3.709 0 C-N-CA 122.654 0.382 . . . . 0.0 110.59 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 -102.45 127.68 49.38 Favored 'General case' 0 N--CA 1.523 3.207 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -149.66 -78.4 0.14 Allowed 'General case' 0 N--CA 1.523 3.212 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 519' ' ' TRP . . . . . 0.431 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 71.7 t-105 -43.07 -28.66 0.29 Allowed 'General case' 1 N--CA 1.55 4.555 0 C-N-CA 124.279 1.032 . . . . 0.0 113.424 179.855 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 520' ' ' LEU . . . . . 0.404 ' CD2' ' N ' ' B' ' 520' ' ' LEU . 2.3 mm? -95.76 -31.43 13.2 Favored 'General case' 0 N--CA 1.526 3.373 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.693 -173.262 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.11 -22.92 65.1 Favored 'General case' 0 N--CA 1.539 3.994 0 N-CA-C 106.904 -1.517 . . . . 0.0 106.904 171.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . 0.475 ' CD2' ' HG ' ' A' ' 51' ' ' LEU . 1.6 m-85 -81.82 -40.16 22.94 Favored 'General case' 0 N--CA 1.509 2.494 0 N-CA-C 107.208 -1.404 . . . . 0.0 107.208 174.167 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 20.4 t -58.88 -44.81 91.56 Favored 'Isoleucine or valine' 1 N--CA 1.565 5.313 0 CA-C-O 117.603 -1.189 . . . . 0.0 113.292 -179.059 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -61.05 -46.11 92.01 Favored 'General case' 1 N--CA 1.548 4.462 0 CA-C-N 120.641 1.564 . . . . 0.0 110.038 -178.484 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 1.7 tp -67.38 -26.52 66.5 Favored 'General case' 0 N--CA 1.536 3.829 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 176.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -68.06 -31.78 71.67 Favored 'General case' 0 N--CA 1.522 3.141 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 176.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 527' ' ' LYS . . . . . 0.433 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 15.2 tttt -67.79 -23.3 65.19 Favored 'General case' 0 N--CA 1.521 3.118 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.833 177.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -71.99 -41.27 67.83 Favored 'General case' 0 N--CA 1.534 3.744 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 176.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 529' ' ' ALA . . . . . . . . . . . . . . . -88.6 -7.34 56.59 Favored 'General case' 0 N--CA 1.503 2.219 0 CA-C-O 118.427 -0.797 . . . . 0.0 110.569 177.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 530' ' ' TYR . . . . . 0.433 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.5 OUTLIER -82.07 -35.68 28.44 Favored 'General case' 0 N--CA 1.532 3.671 0 CA-C-N 120.309 1.413 . . . . 0.0 108.737 179.798 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -60.7 -45.07 95.6 Favored 'General case' 0 N--CA 1.538 3.932 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -90.67 -84.0 0.25 Allowed 'General case' 0 N--CA 1.515 2.805 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 177.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.0 p30 149.31 47.34 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.88 0 C-N-CA 128.105 2.562 . . . . 0.0 108.104 178.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 7.3 mt -102.89 9.13 39.0 Favored 'General case' 0 N--CA 1.529 3.523 0 C-N-CA 124.095 0.958 . . . . 0.0 111.606 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 535' ' ' HIS . . . . . . . . . . . . . 49.2 p-80 -80.76 0.38 34.95 Favored 'General case' 0 N--CA 1.512 2.657 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 175.006 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 536' ' ' LEU . . . . . 0.4 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 33.8 mt -94.01 -51.43 0.26 Allowed Pre-proline 0 N--CA 1.505 2.303 0 CA-C-O 116.343 -1.789 . . . . 0.0 109.067 -175.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 537' ' ' PRO . . . . . 0.4 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 3.7 Cg_exo -64.57 -37.42 37.71 Favored 'Trans proline' 0 C--N 1.396 3.048 0 N-CA-C 107.071 -1.934 . . . . 0.0 107.071 170.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -60.28 -41.53 93.51 Favored 'General case' 0 N--CA 1.527 3.387 0 C-N-CA 124.332 1.053 . . . . 0.0 108.736 175.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 11.0 mt -71.78 -25.04 61.86 Favored 'General case' 0 N--CA 1.536 3.836 0 CA-C-O 118.247 -0.883 . . . . 0.0 111.452 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -77.88 -8.05 57.54 Favored 'General case' 0 N--CA 1.53 3.526 0 CA-C-N 119.31 0.959 . . . . 0.0 110.187 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.6 -42.17 5.74 Favored 'General case' 0 N--CA 1.512 2.656 0 C-N-CA 124.033 0.933 . . . . 0.0 109.779 -179.388 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 15.1 ptp -85.2 -28.08 25.69 Favored 'General case' 0 N--CA 1.534 3.764 0 CA-C-O 117.439 -1.267 . . . . 0.0 113.252 -177.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 1.8 tt -131.54 -110.27 0.25 Allowed 'General case' 0 N--CA 1.533 3.691 0 CA-C-O 116.967 -1.492 . . . . 0.0 112.886 -177.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 24.3 p -163.75 162.81 16.57 Favored Pre-proline 1 N--CA 1.542 4.168 0 CA-C-N 120.754 1.615 . . . . 0.0 111.823 -177.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -76.43 -32.09 4.06 Favored 'Trans proline' 0 CA--C 1.578 2.677 0 C-N-CA 122.792 2.328 . . . . 0.0 109.551 174.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -55.63 -36.41 66.97 Favored 'General case' 1 N--CA 1.546 4.338 0 C-N-CA 123.876 0.87 . . . . 0.0 111.523 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -71.66 -32.57 68.03 Favored 'General case' 0 N--CA 1.523 3.191 0 CA-C-O 117.637 -1.173 . . . . 0.0 110.778 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 20.5 ptt180 -74.16 -21.21 59.94 Favored 'General case' 0 N--CA 1.534 3.731 0 CA-C-N 120.027 1.285 . . . . 0.0 109.618 175.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -65.19 -44.43 88.41 Favored 'General case' 0 N--CA 1.536 3.832 0 N-CA-C 106.184 -1.784 . . . . 0.0 106.184 173.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -72.22 -20.29 61.59 Favored 'General case' 0 N--CA 1.517 2.915 0 CA-C-O 117.198 -1.382 . . . . 0.0 110.764 176.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 551' ' ' LEU . . . . . 0.499 HD22 ' CG ' ' A' ' 22' ' ' PHE . 12.3 tp -80.42 -20.26 44.32 Favored 'General case' 0 N--CA 1.524 3.238 0 CA-C-N 120.582 1.537 . . . . 0.0 109.168 175.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -77.35 -52.18 5.73 Favored Glycine 0 N--CA 1.507 3.401 0 N-CA-C 108.333 -1.907 . . . . 0.0 108.333 177.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.5 m -70.32 -32.54 70.33 Favored 'General case' 0 N--CA 1.535 3.825 0 CA-C-O 118.703 -0.665 . . . . 0.0 110.842 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -63.9 -54.64 31.56 Favored 'General case' 1 N--CA 1.539 4.007 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 176.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 38.9 t -66.28 -14.9 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.531 0 CA-C-O 117.759 -1.115 . . . . 0.0 110.995 177.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.77 -44.39 20.77 Favored 'General case' 0 N--CA 1.526 3.374 0 CA-C-N 120.168 1.349 . . . . 0.0 111.539 178.359 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 557' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -71.94 -22.49 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.278 0 CA-C-N 120.724 1.602 . . . . 0.0 110.213 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 558' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -88.44 -52.49 11.09 Favored 'Isoleucine or valine' 1 N--CA 1.543 4.181 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 -179.789 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -57.72 -24.28 56.12 Favored 'General case' 0 N--CA 1.536 3.826 0 CA-C-O 118.895 -0.574 . . . . 0.0 110.487 177.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -98.07 -22.81 16.04 Favored 'General case' 0 N--CA 1.527 3.377 0 CA-C-O 118.059 -0.972 . . . . 0.0 111.363 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 16.6 tp -78.72 -63.17 1.47 Allowed 'General case' 0 N--CA 1.537 3.878 0 CA-C-N 119.637 1.108 . . . . 0.0 108.473 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 25.9 mt -41.82 -31.38 0.31 Allowed 'General case' 1 N--CA 1.547 4.422 0 C-N-CA 125.303 1.441 . . . . 0.0 113.513 -178.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 11.4 mmm180 -75.75 -51.01 13.61 Favored 'General case' 0 N--CA 1.527 3.398 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 80.67 93.47 0.44 Allowed Glycine 1 N--CA 1.516 4.02 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 177.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -161.54 -53.34 0.05 OUTLIER 'General case' 0 N--CA 1.529 3.508 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 48.1 mtt -153.31 77.8 1.14 Allowed 'General case' 0 N--CA 1.522 3.151 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 95.1 p -136.34 4.59 2.92 Favored 'General case' 0 N--CA 1.519 2.979 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -175.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -110.99 -69.69 0.85 Allowed 'General case' 0 N--CA 1.529 3.491 0 CA-C-N 120.153 1.342 . . . . 0.0 111.592 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.98 -45.4 6.94 Favored 'General case' 0 N--CA 1.53 3.559 0 CA-C-N 118.538 0.608 . . . . 0.0 111.806 -176.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -80.05 -5.13 55.28 Favored 'General case' 0 N--CA 1.522 3.172 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 -177.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 27.9 tp -83.42 -48.49 10.3 Favored 'General case' 0 N--CA 1.531 3.594 0 CA-C-N 120.165 1.348 . . . . 0.0 112.555 -177.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -47.06 -30.61 2.81 Favored 'General case' 1 N--CA 1.552 4.628 0 CA-C-N 119.855 1.207 . . . . 0.0 113.82 -178.682 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -68.84 -38.08 79.56 Favored 'General case' 0 N--CA 1.537 3.92 0 CA-C-N 118.724 0.693 . . . . 0.0 110.881 -178.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -49.96 -61.25 2.25 Favored 'General case' 0 N--CA 1.53 3.549 0 C-N-CA 124.769 1.228 . . . . 0.0 113.0 -179.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.0 -36.56 3.25 Favored 'General case' 0 N--CA 1.534 3.747 0 CA-C-O 118.511 -0.756 . . . . 0.0 111.905 -178.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 115.25 57.71 0.35 Allowed Glycine 1 N--CA 1.525 4.57 0 CA-C-N 119.144 0.883 . . . . 0.0 111.039 179.577 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -114.54 103.16 10.75 Favored 'General case' 0 N--CA 1.52 3.069 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 177.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -39.0 164.28 0.01 OUTLIER Glycine 1 N--CA 1.544 5.834 0 C-N-CA 125.441 1.496 . . . . 0.0 115.311 -176.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 579' ' ' ILE . . . . . 0.421 HG22 ' N6 ' ' E' ' 4' ' ' ' DA' 0.262 10.9 mt -81.89 -12.24 12.4 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.333 0 CA-C-N 118.888 1.344 . . . . 0.0 109.341 178.383 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -70.05 -41.64 73.94 Favored 'General case' 0 N--CA 1.531 3.577 0 CA-C-N 120.363 1.438 . . . . 0.0 109.285 175.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -77.4 -37.71 51.37 Favored 'General case' 1 N--CA 1.54 4.03 0 CA-C-N 118.909 0.777 . . . . 0.0 111.877 179.144 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -66.57 -40.04 85.35 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.375 0 C-N-CA 123.421 0.688 . . . . 0.0 111.722 -176.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 44.2 p -99.89 -18.36 17.15 Favored 'General case' 0 N--CA 1.506 2.368 0 CA-C-O 117.744 -1.122 . . . . 0.0 112.057 -178.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -81.64 -20.95 38.58 Favored 'General case' 0 N--CA 1.528 3.475 0 CA-C-N 120.265 1.393 . . . . 0.0 107.909 173.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -66.33 -35.49 90.32 Favored Glycine 1 N--CA 1.518 4.116 0 N-CA-C 108.785 -1.726 . . . . 0.0 108.785 176.084 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 88.8 p -66.55 -32.6 74.04 Favored 'General case' 0 N--CA 1.534 3.769 0 CA-C-N 117.803 0.802 . . . . 0.0 111.188 177.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -64.14 -31.32 72.47 Favored 'General case' 0 N--CA 1.53 3.544 0 C-N-CA 123.566 0.747 . . . . 0.0 110.778 178.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 52.9 m -62.95 -41.07 99.39 Favored 'General case' 1 N--CA 1.54 4.047 0 C-N-CA 123.5 0.72 . . . . 0.0 110.77 178.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 57.2 mt -52.78 -48.49 66.79 Favored 'General case' 0 N--CA 1.531 3.578 0 C-N-CA 124.46 1.104 . . . . 0.0 111.956 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -61.03 -29.81 69.94 Favored 'General case' 1 N--CA 1.54 4.049 0 CA-C-O 118.691 -0.671 . . . . 0.0 112.349 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -71.39 -41.61 69.43 Favored 'General case' 0 N--CA 1.52 3.03 0 CA-C-N 118.391 0.541 . . . . 0.0 110.806 179.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -57.72 162.52 4.91 Favored Pre-proline 1 N--CA 1.542 4.15 0 CA-C-O 118.194 -0.908 . . . . 0.0 112.132 179.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -78.97 -177.98 4.31 Favored 'Trans proline' 0 C--N 1.379 2.134 0 C-N-CA 121.439 1.426 . . . . 0.0 110.514 178.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.1 t -99.36 -29.2 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.098 0 CA-C-O 117.757 -1.116 . . . . 0.0 111.286 -179.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -63.4 -41.32 98.75 Favored 'General case' 0 N--CA 1.517 2.882 0 CA-C-N 119.761 1.164 . . . . 0.0 110.535 -178.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 6.7 mp -99.52 -15.88 18.5 Favored 'General case' 0 N--CA 1.511 2.582 0 C-N-CA 123.331 0.653 . . . . 0.0 111.762 179.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.48 -29.68 69.19 Favored 'General case' 0 N--CA 1.531 3.617 0 N-CA-C 103.119 -2.919 . . . . 0.0 103.119 167.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -56.36 -36.91 69.33 Favored 'General case' 0 N--CA 1.521 3.094 0 C-N-CA 124.302 1.041 . . . . 0.0 110.388 173.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 599' ' ' TRP . . . . . 0.414 ' HA ' ' HB2' ' B' ' 602' ' ' GLU . 50.4 t90 -63.59 -35.61 81.07 Favored 'General case' 0 N--CA 1.53 3.558 0 CA-C-O 117.657 -1.164 . . . . 0.0 108.112 178.288 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 6.2 mp -54.93 -37.03 65.9 Favored 'General case' 1 N--CA 1.544 4.245 0 CA-C-N 119.37 0.986 . . . . 0.0 108.429 176.501 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -70.81 -34.18 71.47 Favored 'General case' 0 N--CA 1.532 3.634 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 176.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 602' ' ' GLU . . . . . 0.414 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.5 OUTLIER -62.2 -24.4 67.2 Favored 'General case' 1 N--CA 1.546 4.363 0 C-N-CA 123.491 0.716 . . . . 0.0 109.88 174.868 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -121.46 13.73 6.06 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.448 0 C-N-CA 123.851 0.861 . . . . 0.0 111.888 -177.565 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 45.0 mt -126.6 -61.95 1.16 Allowed 'General case' 0 N--CA 1.528 3.426 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 176.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.29 -48.67 68.15 Favored 'General case' 0 N--CA 1.539 3.989 0 C-N-CA 124.573 1.149 . . . . 0.0 111.295 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 42.4 mtpt 70.85 96.45 0.07 Allowed 'General case' 0 N--CA 1.531 3.6 0 C-N-CA 124.768 1.227 . . . . 0.0 109.479 -179.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 75.6 m . . . . . 0 N--CA 1.522 3.129 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.961 -179.46 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.128 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.193 0 CA-C-O 118.523 -0.751 . . . . 0.0 109.283 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.413 -10.547 4 O4'-C1'-N19 120.014 15.267 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.275 4 O4'-C1'-N19 119.178 14.223 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.943 4 O4'-C1'-N19 119.397 14.496 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . 0.426 ' N6 ' HG23 ' B' ' 579' ' ' ILE . . . . . . . . 6 C3'--C2' 1.416 -10.225 3 O4'-C1'-N19 120.242 15.553 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' E' E ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.576 11.172 3 C4'-C3'-C2' 116.52 13.32 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.405 -11.335 4 O4'-C1'-N19 118.556 13.445 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' E' E ' 7' ' ' ' DA' . . . . . 0.584 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.389 -12.904 4 C4'-C3'-C2' 111.952 8.752 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' E' E ' 8' ' ' ' DG' . . . . . 0.584 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 O3'--C3' 1.563 10.176 4 O4'-C1'-N19 119.827 15.033 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.574 11.029 4 O4'-C1'-N19 118.632 13.541 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.414 -10.403 3 O4'-C1'-N19 119.483 14.604 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.409 -10.938 5 O4'-C1'-N19 119.599 14.749 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.407 -11.081 2 O4'-C1'-N19 120.06 15.325 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.411 -10.696 4 O4'-C1'-N19 119.276 14.345 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' E' E ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.413 -10.497 3 C4'-C3'-C2' 117.125 13.925 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' E' E ' 15' ' ' ' DA' . . . . . 0.402 ' H62' ' CB ' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.418 -10.002 6 O4'-C1'-N19 119.523 14.653 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.418 -10.008 6 O4'-C1'-N19 119.683 14.854 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.573 10.946 4 O4'-C1'-N19 119.53 14.663 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.407 -11.105 5 O4'-C1'-N19 120.257 15.572 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.107 2 O4'-C1'-N19 120.019 15.274 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.507 6.686 5 O4'-C1'-N19 118.922 13.902 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.564 10.223 3 C4'-C3'-C2' 116.992 13.792 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.411 -10.747 3 O4'-C1'-N19 119.76 14.95 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.407 -11.082 5 O4'-C1'-N19 120.312 15.64 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' F' F ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.164 2 O4'-C1'-N19 119.184 14.23 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' F' F ' 5' ' ' ' DC' . . . . . 0.473 ' H42' ' HA ' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.417 -10.134 5 C4'-C3'-C2' 116.028 12.828 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -11.001 4 O4'-C1'-N19 118.357 13.196 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.402 -12.608 4 N19-C1'-C2' 129.924 9.827 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.416 -10.232 5 O4'-C1'-N19 119.348 14.435 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.566 10.358 3 O4'-C1'-N19 118.846 13.807 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.616 4 O4'-C1'-N19 118.575 13.469 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.414 -10.401 4 O4'-C1'-N19 121.153 16.691 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -11.013 5 O4'-C1'-N19 120.102 15.378 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.409 -10.891 3 O4'-C1'-N19 119.806 15.008 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' F' F ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.138 5 O4'-C1'-N19 118.62 13.524 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' F' F ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.43 -8.788 4 O4'-C1'-N19 119.401 14.501 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.416 -10.16 4 O4'-C1'-N19 119.772 14.965 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.362 5 O4'-C1'-N19 119.098 14.122 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -10.027 3 O4'-C1'-N19 120.096 15.37 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.423 -9.505 3 O4'-C1'-N19 120.407 15.759 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 O4'--C1' 1.51 6.947 4 O4'-C1'-N19 118.791 13.739 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 . . . . . 0 N--CA 1.499 2.002 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 55.6 m -135.13 138.2 28.67 Favored Pre-proline 0 N--CA 1.521 3.124 0 CA-C-O 117.785 -1.102 . . . . 0.0 110.34 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -69.1 -52.53 0.37 Allowed 'Trans proline' 0 C--N 1.387 2.575 0 C-N-CA 122.809 2.339 . . . . 0.0 112.907 -178.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -92.18 -33.43 14.71 Favored 'General case' 0 N--CA 1.532 3.643 0 CA-C-O 118.281 -0.866 . . . . 0.0 112.369 -177.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 21.3 m -66.23 -34.73 78.67 Favored 'General case' 1 N--CA 1.539 4.024 0 CA-C-N 119.172 0.897 . . . . 0.0 112.242 -177.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -143.56 128.77 18.76 Favored 'General case' 0 N--CA 1.52 3.056 0 CA-C-N 118.609 0.641 . . . . 0.0 110.782 -179.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -130.67 -53.5 1.07 Allowed 'General case' 0 N--CA 1.52 3.06 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 179.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 19.3 ptm -155.28 125.22 6.58 Favored 'General case' 0 N--CA 1.526 3.347 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 178.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.98 144.1 48.98 Favored 'General case' 0 N--CA 1.534 3.74 0 C-N-CA 122.705 0.402 . . . . 0.0 111.892 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -121.0 117.58 27.65 Favored 'General case' 0 N--CA 1.52 3.067 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -161.98 124.87 2.99 Favored 'General case' 0 N--CA 1.533 3.713 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -179.807 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.0 ttt180 -153.82 144.84 22.78 Favored 'General case' 0 N--CA 1.524 3.243 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -177.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 38.8 m-70 -119.26 129.4 54.9 Favored 'General case' 0 N--CA 1.521 3.12 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 178.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -83.07 100.74 10.69 Favored 'General case' 0 N--CA 1.526 3.334 0 CA-C-O 121.295 0.569 . . . . 0.0 111.683 -177.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -148.54 -67.36 0.23 Allowed 'General case' 0 N--CA 1.534 3.737 0 N-CA-C 105.777 -1.935 . . . . 0.0 105.777 177.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 59.1 t-105 -51.03 -37.18 43.7 Favored 'General case' 1 N--CA 1.543 4.192 0 C-N-CA 124.253 1.021 . . . . 0.0 109.182 174.125 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -90.34 -25.95 20.2 Favored 'General case' 0 N--CA 1.526 3.345 0 CA-C-O 117.852 -1.07 . . . . 0.0 111.089 -178.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.2 mtt-85 -53.69 -28.34 33.16 Favored 'General case' 1 N--CA 1.539 4.002 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 173.223 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.475 ' O ' ' HB2' ' A' ' 26' ' ' LEU . 47.7 t80 -87.11 -39.04 15.92 Favored 'General case' 0 N--CA 1.501 2.125 0 CA-C-O 115.907 -1.997 . . . . 0.0 109.276 172.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 91.1 t -66.15 -58.26 7.36 Favored 'Isoleucine or valine' 1 N--CA 1.577 5.905 0 CA-C-N 122.462 2.392 . . . . 0.0 112.704 -177.182 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -55.7 -45.84 77.79 Favored 'General case' 1 N--CA 1.548 4.451 0 CA-C-N 119.957 1.253 . . . . 0.0 110.914 -177.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.7 mp -71.71 -24.34 61.79 Favored 'General case' 0 N--CA 1.531 3.603 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.23 177.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.475 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -66.85 -33.5 75.75 Favored 'General case' 0 N--CA 1.519 3.016 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 176.172 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -65.33 -26.91 68.25 Favored 'General case' 0 N--CA 1.518 2.956 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.679 177.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -69.7 -39.71 76.74 Favored 'General case' 0 N--CA 1.53 3.54 0 CA-C-N 119.167 0.894 . . . . 0.0 109.031 177.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.41 -8.9 58.83 Favored 'General case' 0 N--CA 1.504 2.232 0 CA-C-O 118.489 -0.767 . . . . 0.0 110.633 177.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -80.63 -32.79 36.17 Favored 'General case' 0 N--CA 1.529 3.522 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 176.293 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -56.02 -46.49 78.78 Favored 'General case' 0 N--CA 1.533 3.679 0 C-N-CA 124.2 1.0 . . . . 0.0 108.591 176.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -96.26 -83.48 0.37 Allowed 'General case' 0 N--CA 1.517 2.922 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 178.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p30 150.32 49.7 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.888 0 C-N-CA 127.875 2.47 . . . . 0.0 108.045 177.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.5 mt -103.16 9.49 38.28 Favored 'General case' 0 N--CA 1.526 3.326 0 C-N-CA 124.099 0.96 . . . . 0.0 111.156 -178.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.4 ' HA ' ' HB2' ' A' ' 38' ' ' LEU . 48.5 p-80 -81.17 3.86 22.18 Favored 'General case' 0 N--CA 1.513 2.711 0 C-N-CA 123.224 0.61 . . . . 0.0 109.558 174.547 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.7 mt -95.84 -49.94 0.24 Allowed Pre-proline 0 N--CA 1.512 2.649 0 C-N-CA 125.374 1.47 . . . . 0.0 109.373 -175.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_exo -62.87 -37.97 51.14 Favored 'Trans proline' 0 N--CA 1.513 2.638 0 N-CA-C 105.703 -2.46 . . . . 0.0 105.703 169.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.4 ' HB2' ' HA ' ' A' ' 35' ' ' HIS . 0.9 OUTLIER -54.44 -44.36 72.41 Favored 'General case' 0 N--CA 1.536 3.874 0 C-N-CA 124.442 1.097 . . . . 0.0 109.38 174.151 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.79 -52.77 61.61 Favored 'General case' 1 N--CA 1.561 5.087 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.626 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -58.48 -17.1 18.38 Favored 'General case' 1 N--CA 1.543 4.194 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -179.233 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -107.27 -35.23 6.87 Favored 'General case' 0 N--CA 1.529 3.496 0 CA-C-O 117.738 -1.125 . . . . 0.0 112.971 -176.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 18.0 ptp -125.48 21.87 7.77 Favored 'General case' 1 N--CA 1.549 4.485 0 CA-C-N 120.505 1.502 . . . . 0.0 112.641 -177.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -137.76 -68.75 0.46 Allowed 'General case' 0 N--CA 1.515 2.804 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.295 177.174 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.4 p 122.82 157.25 0.0 OUTLIER Pre-proline 1 N--CA 1.568 5.439 0 C-N-CA 128.528 2.731 . . . . 0.0 109.534 -179.526 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -67.28 -30.49 37.14 Favored 'Trans proline' 0 C--N 1.393 2.875 0 C-N-CA 122.316 2.011 . . . . 0.0 109.429 175.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -68.35 -27.07 65.93 Favored 'General case' 0 N--CA 1.531 3.575 0 CA-C-O 118.208 -0.901 . . . . 0.0 109.55 176.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -70.65 -30.47 67.1 Favored 'General case' 0 N--CA 1.52 3.069 0 CA-C-O 117.588 -1.196 . . . . 0.0 109.935 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 -85.76 -18.0 34.25 Favored 'General case' 0 N--CA 1.537 3.88 0 CA-C-N 119.617 1.098 . . . . 0.0 108.394 174.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -75.86 -22.91 55.72 Favored 'General case' 0 N--CA 1.523 3.179 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 172.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.79 -35.24 15.81 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 117.729 -1.129 . . . . 0.0 109.252 179.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.411 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 31.2 tp -74.16 -20.0 60.37 Favored 'General case' 0 N--CA 1.534 3.741 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 172.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.95 -70.51 1.12 Allowed Glycine 0 N--CA 1.496 2.687 0 C-N-CA 125.161 1.363 . . . . 0.0 110.627 177.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.6 m -73.54 -25.43 60.39 Favored 'General case' 0 N--CA 1.531 3.607 0 CA-C-O 117.759 -1.115 . . . . 0.0 112.46 -178.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -69.62 -51.4 35.37 Favored 'General case' 0 N--CA 1.536 3.866 0 CA-C-N 120.269 1.395 . . . . 0.0 107.914 177.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.5 t -61.82 -20.22 23.08 Favored 'Isoleucine or valine' 1 N--CA 1.543 4.199 0 O-C-N 120.977 -1.077 . . . . 0.0 109.402 175.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.5 mmm180 -74.55 -44.08 52.76 Favored 'General case' 0 N--CA 1.522 3.147 0 CA-C-O 117.098 -1.429 . . . . 0.0 112.082 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.15 -23.87 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.507 0 CA-C-N 121.942 2.155 . . . . 0.0 111.161 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -88.36 -50.56 13.4 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.107 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 -178.153 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -62.26 -25.46 67.85 Favored 'General case' 0 N--CA 1.532 3.653 0 CA-C-O 118.818 -0.611 . . . . 0.0 109.976 178.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -95.05 -21.39 18.6 Favored 'General case' 0 N--CA 1.524 3.258 0 CA-C-O 117.828 -1.082 . . . . 0.0 111.113 178.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -78.08 -46.14 21.61 Favored 'General case' 0 N--CA 1.533 3.678 0 CA-C-N 120.011 1.278 . . . . 0.0 108.026 178.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 30.9 mt -51.84 -26.32 9.7 Favored 'General case' 0 N--CA 1.539 3.987 0 C-N-CA 124.546 1.139 . . . . 0.0 112.203 178.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -90.23 -52.08 5.12 Favored 'General case' 0 N--CA 1.521 3.075 0 N-CA-C 107.397 -1.335 . . . . 0.0 107.397 178.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.1 94.41 0.26 Allowed Glycine 0 N--CA 1.514 3.854 0 CA-C-O 119.442 -0.643 . . . . 0.0 112.424 177.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -160.23 -59.05 0.06 Allowed 'General case' 0 N--CA 1.529 3.504 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 177.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 59.0 mtt -140.19 74.1 1.45 Allowed 'General case' 0 N--CA 1.526 3.351 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 178.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 8.4 t -136.08 -14.59 1.79 Allowed 'General case' 0 N--CA 1.525 3.296 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -176.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -106.7 -56.49 2.18 Favored 'General case' 0 N--CA 1.529 3.492 0 CA-C-N 120.284 1.402 . . . . 0.0 112.122 -176.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 1.9 ttm180 -102.57 -54.03 2.75 Favored 'General case' 0 N--CA 1.53 3.535 0 C-N-CA 123.294 0.638 . . . . 0.0 111.469 -176.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.39 -8.54 56.29 Favored 'General case' 0 N--CA 1.518 2.947 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -176.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 37.0 tp -80.91 -51.33 8.68 Favored 'General case' 0 N--CA 1.528 3.45 0 CA-C-O 117.6 -1.19 . . . . 0.0 113.061 -178.017 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.06 -31.85 0.14 Allowed 'General case' 1 N--CA 1.552 4.669 0 N-CA-C 115.038 1.496 . . . . 0.0 115.038 -176.937 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -72.78 -44.24 61.81 Favored 'General case' 0 N--CA 1.536 3.847 0 CA-C-N 119.18 0.9 . . . . 0.0 110.048 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -53.26 -50.14 65.44 Favored 'General case' 0 N--CA 1.529 3.504 0 C-N-CA 124.631 1.172 . . . . 0.0 112.903 -179.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 56.7 mt -110.54 -51.33 2.88 Favored 'General case' 0 N--CA 1.526 3.365 0 C-N-CA 122.973 0.509 . . . . 0.0 111.646 -177.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 117.59 17.94 5.44 Favored Glycine 1 N--CA 1.527 4.724 0 CA-C-O 118.095 -1.392 . . . . 0.0 111.867 -178.089 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -89.21 112.74 23.84 Favored 'General case' 0 N--CA 1.512 2.643 0 CA-C-N 119.594 1.697 . . . . 0.0 106.508 178.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -42.67 173.95 0.01 OUTLIER Glycine 1 N--CA 1.535 5.299 0 C-N-CA 125.25 1.405 . . . . 0.0 115.253 -177.759 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.8 mt -80.06 -17.29 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.707 0 CA-C-N 118.5 1.15 . . . . 0.0 107.984 177.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.473 ' HA ' ' H42' ' F' ' 5' ' ' ' DC' . . . -71.86 -6.63 43.12 Favored 'General case' 0 N--CA 1.521 3.121 0 CA-C-O 117.403 -1.284 . . . . 0.0 111.223 174.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -104.17 -44.28 5.02 Favored 'General case' 0 N--CA 1.53 3.539 0 CA-C-N 120.77 1.623 . . . . 0.0 110.26 177.292 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -72.23 -38.71 62.92 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.652 0 CA-C-N 119.307 0.958 . . . . 0.0 111.202 -177.771 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 44.3 p -82.15 -25.65 34.17 Favored 'General case' 0 N--CA 1.521 3.104 0 CA-C-O 118.865 -0.588 . . . . 0.0 109.917 178.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.9 ttp180 -67.71 -35.54 78.97 Favored 'General case' 1 N--CA 1.54 4.044 0 N-CA-C 107.319 -1.363 . . . . 0.0 107.319 173.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -69.94 -26.24 74.59 Favored Glycine 1 N--CA 1.516 4.025 0 CA-C-O 118.094 -1.392 . . . . 0.0 111.916 178.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 89.7 p -66.14 -25.5 67.0 Favored 'General case' 1 N--CA 1.543 4.222 0 CA-C-N 119.537 1.669 . . . . 0.0 110.754 178.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -54.81 -25.28 27.3 Favored 'General case' 1 N--CA 1.545 4.287 0 C-N-CA 123.281 0.632 . . . . 0.0 110.752 176.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.9 m -49.88 -42.85 48.74 Favored 'General case' 1 N--CA 1.547 4.382 0 C-N-CA 124.837 1.255 . . . . 0.0 111.467 178.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 37.8 mt -65.02 -41.98 94.8 Favored 'General case' 0 N--CA 1.519 2.99 0 C-N-CA 123.324 0.65 . . . . 0.0 110.259 178.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.11 0.06 55.88 Favored 'General case' 0 N--CA 1.532 3.643 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -179.45 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -113.18 -64.0 1.37 Allowed 'General case' 0 N--CA 1.518 2.958 0 CA-C-N 120.047 1.294 . . . . 0.0 111.741 -179.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -49.73 159.31 0.74 Allowed Pre-proline 1 N--CA 1.548 4.461 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -178.528 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -78.01 -179.31 5.33 Favored 'Trans proline' 0 C--N 1.384 2.427 0 C-N-CA 121.735 1.623 . . . . 0.0 110.248 177.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.1 t -98.75 -27.15 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.117 0 CA-C-O 117.545 -1.217 . . . . 0.0 111.69 -178.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -61.9 -43.51 98.69 Favored 'General case' 0 N--CA 1.518 2.936 0 CA-C-N 120.189 1.359 . . . . 0.0 110.459 -178.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.9 mp -98.57 -16.07 19.26 Favored 'General case' 0 N--CA 1.509 2.52 0 CA-C-O 118.676 -0.678 . . . . 0.0 112.149 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.76 -29.65 68.91 Favored 'General case' 0 N--CA 1.538 3.948 0 N-CA-C 103.591 -2.744 . . . . 0.0 103.591 168.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -55.24 -39.1 69.34 Favored 'General case' 0 N--CA 1.518 2.971 0 C-N-CA 123.892 0.877 . . . . 0.0 110.259 174.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.43 ' HA ' ' HB2' ' A' ' 102' ' ' GLU . 54.9 t90 -66.22 -34.67 78.53 Favored 'General case' 0 N--CA 1.528 3.462 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 177.246 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.1 -35.29 59.46 Favored 'General case' 0 N--CA 1.537 3.916 0 CA-C-N 118.923 0.783 . . . . 0.0 108.905 175.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -71.76 -37.12 70.56 Favored 'General case' 1 N--CA 1.539 4.002 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 175.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 3.0 mt-10 -60.51 -22.27 63.38 Favored 'General case' 1 N--CA 1.544 4.251 0 C-N-CA 123.607 0.763 . . . . 0.0 110.636 175.047 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -118.05 6.46 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.514 0 CA-C-O 118.744 -0.646 . . . . 0.0 112.215 -177.017 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.2 mt -111.67 -62.05 1.61 Allowed 'General case' 0 N--CA 1.525 3.281 0 N-CA-C 105.793 -1.929 . . . . 0.0 105.793 175.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.0 tt -46.42 -48.69 18.72 Favored 'General case' 1 N--CA 1.54 4.049 0 C-N-CA 125.572 1.549 . . . . 0.0 112.287 -179.113 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -94.37 -58.45 2.21 Favored 'General case' 0 N--CA 1.524 3.241 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 89.7 p . . . . . 0 N--CA 1.534 3.764 0 C-N-CA 125.35 1.46 . . . . 0.0 112.724 179.956 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 . . . . . 0 N--CA 1.499 2.01 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 8.4 t -140.63 125.93 11.2 Favored Pre-proline 0 N--CA 1.521 3.095 0 CA-C-O 117.389 -1.291 . . . . 0.0 109.489 179.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -75.18 -47.3 0.2 Allowed 'Trans proline' 0 C--N 1.388 2.635 0 C-N-CA 122.58 2.187 . . . . 0.0 110.411 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -89.78 155.63 19.05 Favored 'General case' 0 N--CA 1.533 3.709 0 C-N-CA 122.969 0.507 . . . . 0.0 111.149 -178.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 62.5 m -80.5 133.82 35.88 Favored 'General case' 0 N--CA 1.525 3.306 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.984 -179.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -100.41 -41.08 7.16 Favored 'General case' 0 N--CA 1.523 3.225 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . 64.22 142.66 0.02 OUTLIER 'General case' 0 N--CA 1.534 3.763 0 C-N-CA 124.722 1.209 . . . . 0.0 112.487 178.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 5.4 tpt -82.9 -44.4 15.42 Favored 'General case' 0 N--CA 1.521 3.084 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -113.4 137.62 51.27 Favored 'General case' 0 N--CA 1.525 3.284 0 C-N-CA 123.582 0.753 . . . . 0.0 110.544 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -117.08 -42.27 2.94 Favored 'General case' 0 N--CA 1.527 3.378 0 C-N-CA 123.305 0.642 . . . . 0.0 110.589 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 76.87 -98.82 0.02 OUTLIER 'General case' 0 N--CA 1.533 3.715 0 CA-C-O 117.612 -1.185 . . . . 0.0 108.597 -178.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -144.55 -66.03 0.34 Allowed 'General case' 0 N--CA 1.531 3.579 0 CA-C-N 120.921 1.691 . . . . 0.0 109.518 179.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 9.3 m170 -157.17 160.45 38.77 Favored 'General case' 0 N--CA 1.53 3.54 0 CA-C-N 118.422 0.556 . . . . 0.0 111.953 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -108.71 126.17 52.71 Favored 'General case' 0 N--CA 1.52 3.07 0 C-N-CA 123.404 0.682 . . . . 0.0 109.607 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -104.02 -67.55 0.89 Allowed 'General case' 0 N--CA 1.521 3.091 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 519' ' ' TRP . . . . . 0.439 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 64.2 t-105 -42.43 -29.54 0.28 Allowed 'General case' 1 N--CA 1.549 4.482 0 C-N-CA 123.954 0.901 . . . . 0.0 113.335 179.166 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 520' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -93.98 -31.64 14.18 Favored 'General case' 0 N--CA 1.524 3.274 0 CA-C-O 117.696 -1.145 . . . . 0.0 113.879 -172.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 54.3 mtt-85 -61.7 -25.76 67.62 Favored 'General case' 1 N--CA 1.546 4.361 0 N-CA-C 105.729 -1.952 . . . . 0.0 105.729 171.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . 0.439 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 2.0 m-85 -76.24 -43.24 42.97 Favored 'General case' 0 N--CA 1.511 2.602 0 CA-C-O 117.287 -1.34 . . . . 0.0 107.401 173.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 54.1 t -65.82 -17.29 21.95 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.24 0 CA-C-O 117.717 -1.135 . . . . 0.0 112.246 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -77.62 -52.59 8.77 Favored 'General case' 0 N--CA 1.527 3.419 0 CA-C-N 120.396 1.453 . . . . 0.0 107.885 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 5.1 mp -75.35 -14.6 60.49 Favored 'General case' 0 N--CA 1.53 3.547 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 175.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.23 -35.92 68.97 Favored 'General case' 0 N--CA 1.521 3.102 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 174.153 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 30.7 ttmt -68.73 -21.96 64.36 Favored 'General case' 0 N--CA 1.512 2.644 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.633 176.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -67.55 -40.17 84.96 Favored 'General case' 0 N--CA 1.535 3.82 0 CA-C-N 119.365 0.984 . . . . 0.0 108.465 176.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 529' ' ' ALA . . . . . 0.443 ' HB2' ' N ' ' B' ' 535' ' ' HIS . . . -90.22 -13.46 35.41 Favored 'General case' 0 N--CA 1.504 2.24 0 CA-C-O 117.968 -1.015 . . . . 0.0 111.637 178.71 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.29 -28.64 42.25 Favored 'General case' 0 N--CA 1.537 3.908 0 CA-C-N 120.787 1.63 . . . . 0.0 107.461 177.478 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -61.7 -47.77 83.81 Favored 'General case' 0 N--CA 1.527 3.415 0 C-N-CA 124.421 1.089 . . . . 0.0 108.425 176.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -91.4 -85.33 0.24 Allowed 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 177.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.8 p30 152.58 51.76 0.0 OUTLIER 'General case' 1 N--CA 1.555 4.825 0 C-N-CA 127.339 2.256 . . . . 0.0 108.263 176.456 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 7.0 mt -109.89 12.16 23.95 Favored 'General case' 0 N--CA 1.519 2.997 0 C-N-CA 125.249 1.42 . . . . 0.0 109.924 -179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 535' ' ' HIS . . . . . 0.443 ' N ' ' HB2' ' B' ' 529' ' ' ALA . 24.6 p-80 -86.38 9.09 19.08 Favored 'General case' 0 N--CA 1.516 2.871 0 C-N-CA 124.146 0.979 . . . . 0.0 108.873 175.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 536' ' ' LEU . . . . . 0.482 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 20.3 mt -97.05 -52.04 0.22 Allowed Pre-proline 0 N--CA 1.502 2.173 0 CA-C-O 116.589 -1.672 . . . . 0.0 107.794 -176.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 537' ' ' PRO . . . . . 0.482 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 2.7 Cg_exo -65.8 -34.1 41.22 Favored 'Trans proline' 0 C--N 1.401 3.308 0 N-CA-C 106.693 -2.08 . . . . 0.0 106.693 170.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.47 -51.68 68.83 Favored 'General case' 0 N--CA 1.523 3.211 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 174.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 40.1 mt -77.45 -6.81 54.79 Favored 'General case' 0 N--CA 1.535 3.811 0 CA-C-O 118.441 -0.79 . . . . 0.0 112.599 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -75.36 -22.67 57.36 Favored 'General case' 0 N--CA 1.518 2.963 0 CA-C-O 117.601 -1.19 . . . . 0.0 111.576 179.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.58 -27.47 2.86 Favored 'General case' 0 N--CA 1.524 3.256 0 CA-C-O 117.214 -1.374 . . . . 0.0 113.648 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 2.2 ptp -79.77 9.68 4.92 Favored 'General case' 1 N--CA 1.543 4.221 0 CA-C-N 121.663 2.028 . . . . 0.0 110.583 177.42 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 1.6 tp -132.78 -89.36 0.42 Allowed 'General case' 0 N--CA 1.519 2.985 0 CA-C-N 120.183 1.356 . . . . 0.0 111.823 178.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 162.56 175.45 0.04 OUTLIER Pre-proline 1 N--CA 1.578 5.967 0 C-N-CA 125.12 1.368 . . . . 0.0 109.971 -177.682 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -64.73 -21.45 64.93 Favored 'Trans proline' 0 N--CA 1.527 3.475 0 C-N-CA 122.25 1.967 . . . . 0.0 109.834 173.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -72.29 8.87 1.17 Allowed 'General case' 0 N--CA 1.517 2.908 0 C-N-CA 123.38 0.672 . . . . 0.0 110.728 175.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.6 -57.91 3.96 Favored 'General case' 0 N--CA 1.51 2.568 0 CA-C-O 117.493 -1.241 . . . . 0.0 108.326 178.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 -93.65 -5.98 47.42 Favored 'General case' 0 N--CA 1.527 3.422 0 CA-C-N 120.303 1.41 . . . . 0.0 111.507 175.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -74.35 -45.89 44.2 Favored 'General case' 0 N--CA 1.535 3.777 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 173.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -90.34 -23.33 21.16 Favored 'General case' 0 N--CA 1.521 3.108 0 CA-C-O 117.652 -1.166 . . . . 0.0 112.363 179.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 551' ' ' LEU . . . . . . . . . . . . . 17.4 tp -80.86 -33.28 34.6 Favored 'General case' 1 N--CA 1.54 4.071 0 CA-C-N 120.657 1.571 . . . . 0.0 107.707 176.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -73.49 -52.76 8.11 Favored Glycine 0 N--CA 1.496 2.676 0 N-CA-C 109.905 -1.278 . . . . 0.0 109.905 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 1.8 m -71.97 -33.8 68.45 Favored 'General case' 0 N--CA 1.536 3.873 0 CA-C-N 118.415 1.108 . . . . 0.0 112.574 -177.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -67.23 -52.64 38.54 Favored 'General case' 1 N--CA 1.54 4.052 0 N-CA-C 106.916 -1.512 . . . . 0.0 106.916 176.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 42.8 t -61.25 -18.43 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.66 0 CA-C-O 117.938 -1.03 . . . . 0.0 110.485 177.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 -79.25 -42.21 26.41 Favored 'General case' 0 N--CA 1.525 3.291 0 CA-C-O 116.869 -1.539 . . . . 0.0 111.152 177.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 557' ' ' ILE . . . . . 0.433 ' HB ' HG23 ' B' ' 582' ' ' ILE . 0.0 OUTLIER -71.83 -22.04 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.946 0 CA-C-N 122.178 2.263 . . . . 0.0 110.742 179.911 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 558' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -87.14 -52.1 12.06 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.746 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 -178.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -67.1 -17.0 64.68 Favored 'General case' 0 N--CA 1.523 3.188 0 CA-C-O 118.599 -0.715 . . . . 0.0 110.975 178.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -96.97 -23.9 16.07 Favored 'General case' 0 N--CA 1.528 3.445 0 CA-C-O 118.277 -0.868 . . . . 0.0 109.946 176.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 21.2 tp -78.47 -56.66 4.27 Favored 'General case' 0 N--CA 1.534 3.742 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 178.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 6.7 tp -45.18 -30.11 1.1 Allowed 'General case' 0 N--CA 1.537 3.914 0 C-N-CA 125.196 1.398 . . . . 0.0 112.82 -179.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.14 -50.22 7.59 Favored 'General case' 0 N--CA 1.527 3.392 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 177.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 77.7 94.55 0.24 Allowed Glycine 0 N--CA 1.514 3.862 0 CA-C-O 119.616 -0.547 . . . . 0.0 113.51 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -165.86 -57.95 0.03 OUTLIER 'General case' 0 N--CA 1.531 3.608 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 177.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 47.4 mtt -131.18 69.9 1.47 Allowed 'General case' 0 N--CA 1.519 3.0 0 N-CA-C 106.564 -1.643 . . . . 0.0 106.564 178.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 6.1 t -126.25 -8.52 6.44 Favored 'General case' 0 N--CA 1.523 3.209 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -177.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -113.47 -70.67 0.79 Allowed 'General case' 0 N--CA 1.526 3.366 0 CA-C-N 120.042 1.292 . . . . 0.0 111.843 -178.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 24.0 mtt180 -91.43 -52.37 4.82 Favored 'General case' 0 N--CA 1.53 3.532 0 CA-C-N 118.853 0.751 . . . . 0.0 110.38 -178.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -68.68 -12.16 61.05 Favored 'General case' 0 N--CA 1.519 3.0 0 CA-C-O 118.183 -0.913 . . . . 0.0 112.613 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 24.2 tp -80.72 -54.72 5.38 Favored 'General case' 0 N--CA 1.517 2.912 0 CA-C-N 119.554 1.07 . . . . 0.0 109.798 179.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -45.88 -32.35 2.6 Favored 'General case' 1 N--CA 1.545 4.281 0 CA-C-N 119.229 0.922 . . . . 0.0 112.507 -179.716 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -72.65 -42.12 64.72 Favored 'General case' 0 N--CA 1.534 3.757 0 C-N-CA 122.988 0.515 . . . . 0.0 110.61 -179.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -43.97 -56.57 3.86 Favored 'General case' 1 N--CA 1.539 4.002 0 C-N-CA 125.137 1.375 . . . . 0.0 113.568 -179.165 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -137.43 -41.74 0.56 Allowed 'General case' 0 N--CA 1.528 3.447 0 CA-C-O 118.814 -0.612 . . . . 0.0 111.579 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 125.66 98.78 1.15 Allowed Glycine 1 N--CA 1.517 4.047 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -126.72 -47.34 1.54 Allowed 'General case' 0 N--CA 1.525 3.311 0 C-N-CA 123.529 0.732 . . . . 0.0 109.44 178.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 108.14 161.05 20.65 Favored Glycine 1 N--CA 1.519 4.22 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -178.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 579' ' ' ILE . . . . . 0.426 HG23 ' N6 ' ' E' ' 4' ' ' ' DA' . 0.9 OUTLIER -84.01 -18.0 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.861 0 CA-C-N 119.219 1.51 . . . . 0.0 108.062 177.93 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -71.01 -38.33 72.63 Favored 'General case' 0 N--CA 1.522 3.149 0 CA-C-N 119.843 1.201 . . . . 0.0 110.301 177.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 4.2 p -78.07 -46.86 19.7 Favored 'General case' 0 N--CA 1.536 3.855 0 CA-C-N 119.689 1.131 . . . . 0.0 111.659 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 582' ' ' ILE . . . . . 0.433 HG23 ' HB ' ' B' ' 557' ' ' ILE . 1.4 pt -68.49 -22.36 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.932 0 CA-C-O 117.854 -1.07 . . . . 0.0 113.289 -177.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 31.0 p -108.74 -21.55 12.63 Favored 'General case' 0 N--CA 1.521 3.095 0 CA-C-N 119.728 1.149 . . . . 0.0 111.95 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 11.3 ptt180 -82.75 -21.55 34.65 Favored 'General case' 0 N--CA 1.531 3.592 0 CA-C-N 119.98 1.264 . . . . 0.0 107.875 173.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -67.66 -31.87 77.09 Favored Glycine 0 N--CA 1.514 3.853 0 N-CA-C 109.703 -1.359 . . . . 0.0 109.703 176.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 88.2 p -65.92 -34.83 79.01 Favored 'General case' 1 N--CA 1.54 4.044 0 CA-C-N 118.537 1.168 . . . . 0.0 110.053 177.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -58.06 -29.04 65.08 Favored 'General case' 1 N--CA 1.539 4.01 0 C-N-CA 123.888 0.875 . . . . 0.0 111.306 178.773 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.31 -35.43 80.99 Favored 'General case' 0 N--CA 1.537 3.917 0 C-N-CA 123.26 0.624 . . . . 0.0 110.507 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 23.6 mt -73.14 -45.76 54.86 Favored 'General case' 0 N--CA 1.518 2.954 0 C-N-CA 123.651 0.78 . . . . 0.0 110.699 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.46 -30.71 31.19 Favored 'General case' 1 N--CA 1.552 4.631 0 C-N-CA 123.672 0.789 . . . . 0.0 112.351 -179.608 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -96.61 -35.22 11.13 Favored 'General case' 0 N--CA 1.519 3.013 0 C-N-CA 123.301 0.64 . . . . 0.0 111.259 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -51.72 164.32 0.55 Allowed Pre-proline 1 N--CA 1.543 4.191 0 CA-C-O 118.197 -0.906 . . . . 0.0 112.941 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -76.09 147.64 30.27 Favored 'Trans proline' 0 C--N 1.38 2.212 0 C-N-CA 121.873 1.715 . . . . 0.0 110.028 178.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.7 t -84.6 -26.24 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.745 0 CA-C-O 117.442 -1.266 . . . . 0.0 112.016 -178.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -65.17 -35.6 81.6 Favored 'General case' 0 N--CA 1.518 2.925 0 CA-C-N 120.282 1.401 . . . . 0.0 110.596 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 6.8 mp -97.75 -21.23 17.09 Favored 'General case' 0 N--CA 1.517 2.879 0 C-N-CA 123.929 0.892 . . . . 0.0 110.423 178.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.51 -35.36 77.49 Favored 'General case' 1 N--CA 1.55 4.527 0 N-CA-C 103.764 -2.68 . . . . 0.0 103.764 168.503 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -57.36 -40.46 78.13 Favored 'General case' 0 N--CA 1.52 3.046 0 C-N-CA 125.358 1.463 . . . . 0.0 111.278 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 599' ' ' TRP . . . . . 0.416 ' HA ' ' HB2' ' B' ' 602' ' ' GLU . 57.5 t90 -57.97 -34.44 69.94 Favored 'General case' 1 N--CA 1.54 4.064 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 179.387 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 54.1 mt -53.68 -42.38 67.88 Favored 'General case' 0 N--CA 1.538 3.962 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 176.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -68.07 -33.76 75.16 Favored 'General case' 0 N--CA 1.53 3.545 0 O-C-N 123.802 0.689 . . . . 0.0 109.42 176.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 602' ' ' GLU . . . . . 0.416 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.6 OUTLIER -61.29 -25.02 66.83 Favored 'General case' 1 N--CA 1.542 4.149 0 C-N-CA 123.362 0.665 . . . . 0.0 110.148 175.27 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -120.59 7.61 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.463 0 C-N-CA 123.747 0.819 . . . . 0.0 112.772 -177.003 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.73 -57.06 1.92 Allowed 'General case' 0 N--CA 1.512 2.643 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 178.075 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.7 -65.33 0.65 Allowed 'General case' 0 N--CA 1.533 3.677 0 C-N-CA 124.869 1.268 . . . . 0.0 113.51 -177.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -96.16 -32.14 12.63 Favored 'General case' 0 N--CA 1.534 3.753 0 CA-C-O 118.678 -0.677 . . . . 0.0 112.11 -177.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 14.7 m . . . . . 1 N--CA 1.542 4.165 0 CA-C-N 119.106 0.866 . . . . 0.0 110.617 -179.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.133 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.102 0 CA-C-O 117.841 -1.076 . . . . 0.0 109.604 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.419 -9.949 3 O4'-C1'-N19 118.788 13.735 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.594 4 O4'-C1'-N19 119.81 15.012 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.423 -9.505 3 O4'-C1'-N19 119.632 14.791 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . 0.443 ' N6 ' HG23 ' B' ' 579' ' ' ILE . . . . . . . . 6 C3'--C2' 1.412 -10.587 5 O4'-C1'-N19 119.375 14.468 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' E' E ' 5' ' ' ' DC' . . . . . 0.401 ' H42' ' HA ' ' B' ' 580' ' ' ALA . . . . . . . . 6 O3'--C3' 1.578 11.272 4 O4'-C1'-N19 118.648 13.56 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.408 -11.024 4 C4'-C3'-C2' 116.282 13.082 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' E' E ' 7' ' ' ' DA' . . . . . 0.599 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.391 -12.723 4 C4'-C3'-C2' 112.204 9.004 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' E' E ' 8' ' ' ' DG' . . . . . 0.599 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.413 -10.505 3 O4'-C1'-N19 120.458 15.823 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.573 10.925 5 O4'-C1'-N19 118.927 13.909 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.403 -11.464 5 O4'-C1'-N19 119.383 14.478 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.569 10.585 3 O4'-C1'-N19 121.876 17.595 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.678 6 O4'-C1'-N19 118.961 13.951 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 4 O3'--C3' 1.551 9.257 4 O4'-C1'-N19 119.604 14.755 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' E' E ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.517 6 O4'-C1'-N19 118.897 13.871 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' E' E ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.429 -8.938 4 O4'-C1'-N19 119.354 14.442 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.415 -10.276 4 O4'-C1'-N19 120.445 15.806 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.572 10.838 4 O4'-C1'-N19 119.269 14.336 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.565 4 O4'-C1'-N19 119.949 15.186 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.427 -9.081 3 O4'-C1'-N19 119.261 14.326 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.51 6.939 4 O4'-C1'-N19 119.904 15.13 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.564 10.215 2 O4'-C1'-N19 118.641 13.551 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.412 -10.576 3 O4'-C1'-N19 119.025 14.031 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.408 -11.033 5 O4'-C1'-N19 120.531 15.913 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' F' F ' 4' ' ' ' DA' . . . . . 0.457 ' N6 ' HG23 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.418 -9.964 3 O4'-C1'-N19 120.488 15.86 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' F' F ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.407 -11.052 5 O4'-C1'-N19 119.642 14.802 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.708 3 O4'-C1'-N19 119.731 14.914 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' F' F ' 7' ' ' ' DA' . . . . . 0.679 H2'' H5'' ' F' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.398 -12.019 5 N19-C1'-C2' 131.947 11.092 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' F' F ' 8' ' ' ' DG' . . . . . 0.679 H5'' H2'' ' F' ' 7' ' ' ' DA' . . . . . . . . 5 C3'--C2' 1.41 -10.784 4 O4'-C1'-N19 119.244 14.305 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.572 10.823 4 O4'-C1'-N19 119.284 14.355 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.568 10.56 3 O4'-C1'-N19 118.981 13.977 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.411 -10.658 5 O4'-C1'-N19 120.374 15.717 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.175 5 O4'-C1'-N19 118.879 13.849 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' F' F ' 13' ' ' ' DC' . . . . . 0.487 " H4'" ' OP1' ' F' ' 14' ' ' ' DT' . . . . . . . . 6 O3'--C3' 1.565 10.346 3 O4'-C1'-N19 120.251 15.564 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' F' F ' 14' ' ' ' DT' . . . . . 0.487 ' OP1' " H4'" ' F' ' 13' ' ' ' DC' . . . . . . . . 6 C3'--C2' 1.408 -11.045 3 O4'-C1'-N19 118.773 13.717 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' F' F ' 15' ' ' ' DA' . . . . . 0.41 ' H62' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.417 -10.079 5 O4'-C1'-N19 119.565 14.706 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.413 -10.493 5 O4'-C1'-N19 119.831 15.039 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.492 5 O4'-C1'-N19 119.44 14.551 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.288 5 O4'-C1'-N19 120.306 15.632 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.418 5 O4'-C1'-N19 120.033 15.291 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.512 7.041 4 O4'-C1'-N19 120.37 15.712 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 . . . . . 0 N--CA 1.514 2.772 0 N-CA-C 110.83 -0.063 . . . . 0.0 110.83 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 57.8 m -109.99 119.28 47.8 Favored Pre-proline 0 N--CA 1.518 2.96 0 CA-C-O 117.683 -1.151 . . . . 0.0 109.025 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -66.15 137.9 49.75 Favored 'Trans proline' 0 C--N 1.396 3.074 0 C-N-CA 122.717 2.278 . . . . 0.0 111.417 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -127.85 126.45 41.64 Favored 'General case' 0 N--CA 1.527 3.382 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 75.5 m -139.9 -51.02 0.5 Allowed 'General case' 0 N--CA 1.521 3.124 0 C-N-CA 122.692 0.397 . . . . 0.0 109.974 -179.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 70.88 115.38 0.05 OUTLIER 'General case' 0 N--CA 1.531 3.584 0 C-N-CA 124.208 1.003 . . . . 0.0 110.32 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -148.79 125.98 11.44 Favored 'General case' 0 N--CA 1.523 3.218 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 43.3 mtp 66.86 130.24 0.02 OUTLIER 'General case' 1 N--CA 1.541 4.124 0 C-N-CA 124.51 1.124 . . . . 0.0 110.033 -178.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.73 155.09 28.12 Favored 'General case' 0 N--CA 1.53 3.543 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -86.16 140.32 30.28 Favored 'General case' 0 N--CA 1.53 3.569 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 59.5 mm-40 -94.6 139.15 31.58 Favored 'General case' 0 N--CA 1.533 3.695 0 C-N-CA 122.881 0.473 . . . . 0.0 111.469 -178.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.7 mmt180 -110.15 -54.1 2.61 Favored 'General case' 0 N--CA 1.525 3.309 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 74.5 m80 -140.74 122.76 15.58 Favored 'General case' 0 N--CA 1.526 3.327 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -111.44 -94.0 0.44 Allowed 'General case' 0 N--CA 1.524 3.229 0 CA-C-O 117.971 -1.014 . . . . 0.0 111.066 -177.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -136.41 -72.89 0.44 Allowed 'General case' 0 N--CA 1.526 3.375 0 CA-C-N 120.271 1.396 . . . . 0.0 108.098 -179.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -51.35 -39.96 58.14 Favored 'General case' 1 N--CA 1.541 4.085 0 C-N-CA 123.034 0.534 . . . . 0.0 109.664 176.376 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -81.5 -26.91 34.77 Favored 'General case' 0 N--CA 1.519 2.987 0 O-C-N 124.699 1.249 . . . . 0.0 111.633 -176.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.0 ttm180 -56.27 -29.17 60.75 Favored 'General case' 0 N--CA 1.539 3.982 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 173.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.497 ' CG ' HD22 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -86.03 -36.47 19.71 Favored 'General case' 0 N--CA 1.508 2.441 0 CA-C-O 116.218 -1.849 . . . . 0.0 108.784 173.6 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.5 t -68.73 -26.0 31.89 Favored 'Isoleucine or valine' 1 N--CA 1.571 5.606 0 CA-C-N 121.364 1.893 . . . . 0.0 112.645 -176.332 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -76.1 -50.32 15.0 Favored 'General case' 0 N--CA 1.534 3.737 0 CA-C-N 120.017 1.281 . . . . 0.0 107.588 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.7 mp -70.79 -16.46 62.74 Favored 'General case' 0 N--CA 1.527 3.386 0 O-C-N 123.428 0.455 . . . . 0.0 110.013 175.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.407 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -72.16 -36.7 69.37 Favored 'General case' 0 N--CA 1.519 2.997 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 175.762 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.1 tttt -66.02 -20.87 66.33 Favored 'General case' 0 N--CA 1.518 2.939 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.658 176.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -71.75 -40.97 68.99 Favored 'General case' 0 N--CA 1.529 3.485 0 CA-C-N 119.275 0.943 . . . . 0.0 108.722 176.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.89 -8.75 55.36 Favored 'General case' 0 N--CA 1.507 2.382 0 CA-C-O 118.566 -0.73 . . . . 0.0 110.699 177.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -83.02 -28.51 29.59 Favored 'General case' 0 N--CA 1.532 3.64 0 CA-C-N 120.017 1.28 . . . . 0.0 107.768 177.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -64.13 -45.59 87.88 Favored 'General case' 0 N--CA 1.525 3.298 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 176.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -93.31 -89.64 0.2 Allowed 'General case' 0 N--CA 1.513 2.677 0 N-CA-C 106.434 -1.691 . . . . 0.0 106.434 176.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 p30 156.36 51.27 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.918 0 C-N-CA 126.825 2.05 . . . . 0.0 107.877 177.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.8 mt -109.88 12.44 23.87 Favored 'General case' 0 N--CA 1.525 3.289 0 C-N-CA 124.388 1.075 . . . . 0.0 110.669 -178.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.441 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 39.2 p-80 -81.86 2.59 29.65 Favored 'General case' 0 N--CA 1.516 2.841 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 174.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 22.6 mt -95.84 -51.11 0.24 Allowed Pre-proline 0 N--CA 1.508 2.43 0 CA-C-O 117.212 -1.375 . . . . 0.0 109.638 -175.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -65.82 -35.23 36.87 Favored 'Trans proline' 0 CA--C 1.574 2.485 0 N-CA-C 105.975 -2.356 . . . . 0.0 105.975 170.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.441 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 1.9 tm? -59.64 -38.34 81.14 Favored 'General case' 0 N--CA 1.521 3.109 0 C-N-CA 124.149 0.98 . . . . 0.0 108.946 175.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.1 mt -59.95 -44.67 94.26 Favored 'General case' 1 N--CA 1.559 5.005 0 CA-C-N 119.236 0.926 . . . . 0.0 108.903 177.108 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -61.71 -17.75 56.95 Favored 'General case' 1 N--CA 1.542 4.148 0 CA-C-O 118.642 -0.694 . . . . 0.0 112.834 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -97.61 -50.52 4.46 Favored 'General case' 0 N--CA 1.525 3.289 0 CA-C-O 118.067 -0.968 . . . . 0.0 113.115 -177.335 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.9 ptt? -115.36 18.68 15.95 Favored 'General case' 1 N--CA 1.556 4.851 0 CA-C-N 119.829 1.195 . . . . 0.0 113.792 -175.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.8 tp -130.44 -80.78 0.54 Allowed 'General case' 0 N--CA 1.52 3.071 0 CA-C-O 117.481 -1.247 . . . . 0.0 110.233 176.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.6 p 140.73 156.47 0.0 OUTLIER Pre-proline 1 N--CA 1.57 5.538 0 C-N-CA 127.178 2.191 . . . . 0.0 109.271 179.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -67.13 -37.84 17.54 Favored 'Trans proline' 0 N--CA 1.517 2.893 0 C-N-CA 123.167 2.578 . . . . 0.0 110.627 177.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -64.02 -21.98 66.73 Favored 'General case' 0 N--CA 1.532 3.651 0 CA-C-O 118.666 -0.683 . . . . 0.0 110.755 178.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -73.39 -28.97 62.3 Favored 'General case' 0 N--CA 1.52 3.045 0 CA-C-O 117.368 -1.301 . . . . 0.0 110.513 179.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 24.1 ptt180 -83.34 -24.55 32.05 Favored 'General case' 0 N--CA 1.537 3.907 0 CA-C-N 120.175 1.352 . . . . 0.0 107.703 174.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -67.58 -26.41 66.27 Favored 'General case' 1 N--CA 1.542 4.17 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 172.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -92.53 -28.74 16.59 Favored 'General case' 0 N--CA 1.511 2.592 0 C-N-CA 124.809 1.244 . . . . 0.0 111.316 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.427 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 34.8 tp -78.08 -20.05 53.03 Favored 'General case' 0 N--CA 1.537 3.894 0 N-CA-C 105.501 -2.037 . . . . 0.0 105.501 172.137 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.97 -70.96 1.07 Allowed Glycine 0 C--N 1.374 2.686 0 C-N-CA 125.311 1.434 . . . . 0.0 109.557 177.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.6 m -66.18 -25.35 66.9 Favored 'General case' 0 N--CA 1.531 3.607 0 CA-C-O 117.744 -1.122 . . . . 0.0 112.85 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -70.77 -52.07 23.02 Favored 'General case' 0 N--CA 1.534 3.754 0 CA-C-N 120.063 1.302 . . . . 0.0 108.417 177.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 23.0 t -64.42 -16.19 18.85 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.171 0 O-C-N 120.871 -1.143 . . . . 0.0 109.61 175.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -76.75 -46.46 25.17 Favored 'General case' 0 N--CA 1.523 3.199 0 CA-C-N 120.001 1.273 . . . . 0.0 111.793 178.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.58 -23.26 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.41 0 CA-C-N 120.843 1.656 . . . . 0.0 111.297 -179.216 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -88.69 -52.53 10.94 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.846 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -58.02 -24.67 59.22 Favored 'General case' 1 N--CA 1.54 4.034 0 CA-C-O 118.871 -0.585 . . . . 0.0 110.138 178.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -88.35 -32.25 18.5 Favored 'General case' 0 N--CA 1.519 3.009 0 CA-C-O 118.345 -0.836 . . . . 0.0 109.555 177.208 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 16.8 tp -64.09 -58.24 7.24 Favored 'General case' 0 N--CA 1.539 4.0 0 CA-C-N 119.3 0.955 . . . . 0.0 110.463 -179.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 33.1 mt -49.17 -26.7 3.0 Favored 'General case' 1 N--CA 1.542 4.132 0 C-N-CA 123.72 0.808 . . . . 0.0 112.891 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 26.9 mmm180 -88.01 -42.32 12.52 Favored 'General case' 0 N--CA 1.527 3.421 0 CA-C-N 118.474 0.579 . . . . 0.0 110.216 -179.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 67.17 88.09 0.07 OUTLIER Glycine 1 N--CA 1.525 4.602 0 CA-C-O 119.134 -0.814 . . . . 0.0 111.703 178.687 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -160.45 -54.24 0.05 Allowed 'General case' 0 N--CA 1.53 3.563 0 CA-C-N 117.714 0.757 . . . . 0.0 110.468 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 9.0 ptt? -142.32 73.76 1.42 Allowed 'General case' 0 N--CA 1.531 3.622 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 18.1 m -133.38 -13.94 2.62 Favored 'General case' 0 N--CA 1.522 3.126 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 -173.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -111.98 -67.82 0.97 Allowed 'General case' 0 N--CA 1.529 3.482 0 CA-C-N 120.179 1.354 . . . . 0.0 112.776 -177.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 11.0 mtt180 -94.94 -47.1 6.57 Favored 'General case' 0 N--CA 1.532 3.642 0 CA-C-N 118.83 0.741 . . . . 0.0 111.097 -177.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -72.95 -12.17 60.85 Favored 'General case' 0 N--CA 1.517 2.906 0 CA-C-O 118.438 -0.792 . . . . 0.0 112.759 -179.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 26.0 tp -80.21 -54.54 5.65 Favored 'General case' 0 N--CA 1.527 3.401 0 CA-C-O 117.735 -1.126 . . . . 0.0 113.429 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -40.11 -48.7 2.53 Favored 'General case' 1 N--CA 1.558 4.94 0 CA-C-N 119.943 1.247 . . . . 0.0 114.162 -177.39 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -68.88 -34.88 76.16 Favored 'General case' 0 N--CA 1.535 3.782 0 CA-C-O 118.967 -0.54 . . . . 0.0 112.154 -177.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -53.12 -52.67 57.94 Favored 'General case' 0 N--CA 1.534 3.753 0 C-N-CA 124.196 0.998 . . . . 0.0 113.023 -178.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.9 pp -121.6 -41.45 2.48 Favored 'General case' 0 N--CA 1.534 3.733 0 CA-C-O 118.895 -0.574 . . . . 0.0 111.326 -178.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 122.25 64.55 0.22 Allowed Glycine 1 N--CA 1.523 4.463 0 N-CA-C 110.81 -0.916 . . . . 0.0 110.81 179.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -133.3 109.6 9.49 Favored 'General case' 0 N--CA 1.518 2.957 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 178.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -45.14 171.61 0.01 OUTLIER Glycine 1 N--CA 1.546 5.983 0 C-N-CA 124.448 1.023 . . . . 0.0 114.388 -177.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.457 HG23 ' N6 ' ' F' ' 4' ' ' ' DA' . 1.6 mt -82.13 -14.35 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.666 0 CA-C-N 118.69 1.245 . . . . 0.0 108.9 178.468 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.03 -31.72 69.49 Favored 'General case' 0 N--CA 1.523 3.188 0 CA-C-N 119.821 1.191 . . . . 0.0 110.675 176.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.3 p -83.51 -42.61 16.67 Favored 'General case' 1 N--CA 1.541 4.115 0 CA-C-N 119.926 1.239 . . . . 0.0 111.636 -179.702 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -70.61 -23.42 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.873 0 CA-C-O 118.043 -0.98 . . . . 0.0 112.587 -178.18 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 70.8 p -105.5 -25.32 12.37 Favored 'General case' 0 N--CA 1.517 2.901 0 CA-C-N 119.605 1.093 . . . . 0.0 111.321 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.9 ptt180 -79.11 -22.51 45.1 Favored 'General case' 0 N--CA 1.535 3.811 0 CA-C-N 120.105 1.321 . . . . 0.0 108.116 174.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.49 -32.29 82.91 Favored Glycine 1 N--CA 1.516 4.005 0 N-CA-C 110.009 -1.237 . . . . 0.0 110.009 176.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 60.2 p -68.07 -32.3 72.54 Favored 'General case' 0 N--CA 1.537 3.91 0 CA-C-N 118.577 1.189 . . . . 0.0 110.031 177.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -60.15 -30.66 69.45 Favored 'General case' 1 N--CA 1.541 4.093 0 C-N-CA 123.726 0.81 . . . . 0.0 111.132 178.224 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 18.4 m -61.04 -42.0 97.65 Favored 'General case' 0 N--CA 1.537 3.909 0 C-N-CA 123.813 0.845 . . . . 0.0 111.578 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 22.1 mt -57.54 -39.72 77.24 Favored 'General case' 0 N--CA 1.531 3.585 0 C-N-CA 124.064 0.946 . . . . 0.0 111.42 -179.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 12.1 mmpt? -59.3 -20.82 57.58 Favored 'General case' 1 N--CA 1.542 4.131 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -178.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -95.88 -48.15 5.85 Favored 'General case' 0 N--CA 1.52 3.044 0 CA-C-N 119.083 0.856 . . . . 0.0 111.864 -178.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.35 160.7 0.35 Allowed Pre-proline 1 N--CA 1.553 4.716 0 CA-C-O 118.14 -0.933 . . . . 0.0 113.486 -178.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -79.68 174.62 11.52 Favored 'Trans proline' 0 C--N 1.381 2.286 0 C-N-CA 121.661 1.574 . . . . 0.0 110.444 179.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -98.82 -28.65 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.972 0 CA-C-O 117.484 -1.246 . . . . 0.0 111.779 -178.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -63.64 -40.61 97.31 Favored 'General case' 0 N--CA 1.515 2.804 0 CA-C-N 119.966 1.257 . . . . 0.0 110.468 -178.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.5 mp -98.13 -18.29 18.58 Favored 'General case' 0 N--CA 1.512 2.641 0 C-N-CA 123.337 0.655 . . . . 0.0 111.517 178.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.53 -29.18 69.21 Favored 'General case' 1 N--CA 1.547 4.397 0 N-CA-C 103.293 -2.854 . . . . 0.0 103.293 169.029 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -57.36 -39.72 76.58 Favored 'General case' 0 N--CA 1.515 2.797 0 C-N-CA 124.29 1.036 . . . . 0.0 110.335 174.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 53.0 t90 -64.03 -34.98 79.25 Favored 'General case' 0 N--CA 1.533 3.701 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 177.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.78 -38.25 60.8 Favored 'General case' 1 N--CA 1.54 4.056 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 176.408 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -68.03 -38.69 82.85 Favored 'General case' 1 N--CA 1.54 4.062 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 175.772 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -61.58 -22.33 65.11 Favored 'General case' 1 N--CA 1.544 4.263 0 C-N-CA 123.45 0.7 . . . . 0.0 110.983 176.6 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -118.97 6.32 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.543 0 CA-C-N 118.481 0.582 . . . . 0.0 112.192 -177.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -108.27 -56.28 2.27 Favored 'General case' 0 N--CA 1.514 2.757 0 N-CA-C 106.028 -1.842 . . . . 0.0 106.028 176.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 35.2 mt -47.11 -53.74 12.13 Favored 'General case' 1 N--CA 1.544 4.248 0 C-N-CA 125.708 1.603 . . . . 0.0 111.712 179.072 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 47.1 mttp -104.33 55.42 0.72 Allowed 'General case' 0 N--CA 1.516 2.842 0 CA-C-O 122.046 0.927 . . . . 0.0 108.54 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.6 t . . . . . 0 N--CA 1.517 2.9 0 CA-C-O 118.041 -0.98 . . . . 0.0 109.36 179.568 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 . . . . . 0 N--CA 1.502 2.156 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 37.7 p -143.02 136.57 14.21 Favored Pre-proline 0 N--CA 1.528 3.436 0 CA-C-O 117.429 -1.272 . . . . 0.0 110.284 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -76.62 133.69 14.47 Favored 'Trans proline' 0 C--N 1.387 2.585 0 C-N-CA 122.362 2.041 . . . . 0.0 111.16 -179.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -93.18 -48.7 6.33 Favored 'General case' 0 N--CA 1.523 3.22 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 178.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 23.8 m -107.43 -57.53 2.07 Favored 'General case' 0 N--CA 1.514 2.762 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 178.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -170.69 136.51 1.22 Allowed 'General case' 0 N--CA 1.535 3.78 0 C-N-CA 122.999 0.52 . . . . 0.0 111.134 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -141.77 133.08 26.5 Favored 'General case' 0 N--CA 1.525 3.306 0 C-N-CA 122.896 0.478 . . . . 0.0 110.371 179.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 12.1 tpt -92.49 102.95 15.41 Favored 'General case' 0 N--CA 1.521 3.111 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 179.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -165.43 133.75 3.17 Favored 'General case' 0 N--CA 1.529 3.517 0 C-N-CA 122.69 0.396 . . . . 0.0 110.979 -178.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -127.67 108.21 10.56 Favored 'General case' 0 N--CA 1.519 2.992 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 178.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -127.01 -26.8 3.09 Favored 'General case' 0 N--CA 1.53 3.537 0 CA-C-O 118.28 -0.867 . . . . 0.0 112.104 -177.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 55.0 mtt-85 -90.39 176.21 6.8 Favored 'General case' 0 N--CA 1.537 3.884 0 CA-C-N 119.286 0.948 . . . . 0.0 112.277 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 79.6 m80 62.72 122.04 0.01 OUTLIER 'General case' 0 N--CA 1.528 3.461 0 C-N-CA 125.256 1.423 . . . . 0.0 112.134 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -114.0 151.91 31.71 Favored 'General case' 0 N--CA 1.531 3.584 0 C-N-CA 123.684 0.794 . . . . 0.0 110.097 178.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -94.69 -72.53 0.62 Allowed 'General case' 0 N--CA 1.525 3.295 0 CA-C-O 118.947 -0.549 . . . . 0.0 109.749 179.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 519' ' ' TRP . . . . . 0.439 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 64.6 t-105 -40.64 -32.47 0.21 Allowed 'General case' 1 N--CA 1.548 4.449 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -179.297 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 520' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -90.12 -31.06 17.26 Favored 'General case' 0 N--CA 1.525 3.298 0 CA-C-O 117.867 -1.063 . . . . 0.0 113.418 -172.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 31.6 ttt180 -61.51 -23.09 65.67 Favored 'General case' 1 N--CA 1.544 4.269 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 171.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . 0.439 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.1 m-85 -82.02 -39.36 23.65 Favored 'General case' 0 N--CA 1.513 2.722 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 174.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 41.2 t -64.99 -22.45 31.46 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.228 0 CA-C-O 117.911 -1.042 . . . . 0.0 112.08 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -76.62 -52.8 9.01 Favored 'General case' 0 N--CA 1.534 3.761 0 CA-C-N 120.116 1.326 . . . . 0.0 107.963 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 7.4 mp -66.74 -21.64 66.06 Favored 'General case' 0 N--CA 1.533 3.722 0 CA-C-O 119.401 -0.333 . . . . 0.0 110.273 176.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -70.06 -37.16 75.44 Favored 'General case' 0 N--CA 1.52 3.036 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 176.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 10.3 ttmt -66.68 -24.56 66.28 Favored 'General case' 0 N--CA 1.517 2.888 0 CA-C-O 118.153 -0.927 . . . . 0.0 110.695 176.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -69.21 -38.2 78.46 Favored 'General case' 1 N--CA 1.541 4.08 0 CA-C-N 119.544 1.065 . . . . 0.0 109.017 176.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 529' ' ' ALA . . . . . . . . . . . . . . . -91.68 -9.02 45.4 Favored 'General case' 0 N--CA 1.499 1.983 0 CA-C-O 118.019 -0.991 . . . . 0.0 111.242 178.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -81.72 -30.79 32.39 Favored 'General case' 0 N--CA 1.53 3.549 0 CA-C-N 120.73 1.605 . . . . 0.0 108.595 179.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -61.53 -42.87 99.45 Favored 'General case' 0 N--CA 1.538 3.928 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 176.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -95.71 -86.72 0.3 Allowed 'General case' 0 N--CA 1.518 2.969 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 177.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.8 p30 151.26 52.87 0.0 OUTLIER 'General case' 1 N--CA 1.558 4.94 0 C-N-CA 127.755 2.422 . . . . 0.0 107.59 177.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 6.2 mt -111.11 8.02 21.59 Favored 'General case' 0 N--CA 1.532 3.675 0 C-N-CA 124.161 0.985 . . . . 0.0 111.703 -178.226 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 535' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 -81.98 -1.82 49.45 Favored 'General case' 0 N--CA 1.513 2.712 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 175.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 536' ' ' LEU . . . . . 0.401 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 46.3 mt -91.87 -50.32 0.31 Allowed Pre-proline 0 N--CA 1.507 2.388 0 CA-C-O 116.346 -1.787 . . . . 0.0 109.092 -176.446 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 537' ' ' PRO . . . . . 0.401 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 3.3 Cg_exo -64.48 -37.13 40.06 Favored 'Trans proline' 0 C--N 1.394 2.959 0 N-CA-C 107.225 -1.875 . . . . 0.0 107.225 171.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.94 -41.3 97.8 Favored 'General case' 0 N--CA 1.527 3.394 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 175.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 8.1 mt -70.15 -24.11 63.11 Favored 'General case' 0 N--CA 1.536 3.84 0 CA-C-O 118.045 -0.979 . . . . 0.0 111.448 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -78.34 -6.76 56.07 Favored 'General case' 0 N--CA 1.526 3.365 0 CA-C-N 119.405 1.002 . . . . 0.0 110.645 178.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -106.67 -43.22 4.77 Favored 'General case' 0 N--CA 1.513 2.718 0 C-N-CA 124.159 0.984 . . . . 0.0 109.212 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 7.8 ptt? -94.84 -3.44 48.89 Favored 'General case' 0 N--CA 1.53 3.571 0 CA-C-O 117.78 -1.105 . . . . 0.0 112.728 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.67 -108.17 0.3 Allowed 'General case' 0 N--CA 1.526 3.34 0 CA-C-N 120.386 1.448 . . . . 0.0 112.236 -177.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 3.9 t 157.07 140.2 0.0 OUTLIER Pre-proline 1 N--CA 1.567 5.406 0 C-N-CA 126.654 1.982 . . . . 0.0 108.332 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -52.27 -29.57 38.79 Favored 'Trans proline' 0 N--CA 1.524 3.276 0 C-N-CA 123.818 3.012 . . . . 0.0 115.891 -176.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -58.85 -31.48 68.56 Favored 'General case' 1 N--CA 1.545 4.285 0 CA-C-N 118.898 0.772 . . . . 0.0 112.514 -177.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.72 -31.28 63.3 Favored 'General case' 0 N--CA 1.524 3.239 0 CA-C-O 117.947 -1.025 . . . . 0.0 110.782 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -79.57 -20.18 47.62 Favored 'General case' 0 N--CA 1.527 3.41 0 CA-C-N 119.574 1.079 . . . . 0.0 110.633 177.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -70.07 -47.44 61.9 Favored 'General case' 0 N--CA 1.534 3.768 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 174.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -77.5 -11.67 59.88 Favored 'General case' 0 N--CA 1.512 2.664 0 CA-C-O 117.295 -1.335 . . . . 0.0 111.288 176.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 551' ' ' LEU . . . . . 0.497 HD22 ' CG ' ' A' ' 22' ' ' PHE . 13.3 tp -81.5 -33.95 31.58 Favored 'General case' 0 N--CA 1.527 3.4 0 CA-C-N 120.722 1.601 . . . . 0.0 107.486 175.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -68.47 -52.45 26.1 Favored Glycine 0 N--CA 1.509 3.518 0 N-CA-C 108.732 -1.747 . . . . 0.0 108.732 178.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.9 m -67.34 -30.61 70.48 Favored 'General case' 0 N--CA 1.532 3.628 0 CA-C-O 118.205 -0.902 . . . . 0.0 111.891 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 11.5 mtm180 -67.49 -46.74 72.06 Favored 'General case' 1 N--CA 1.545 4.32 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 176.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 19.6 t -69.81 -15.64 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.681 0 CA-C-O 118.158 -0.925 . . . . 0.0 109.5 176.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 6.8 mtm-85 -80.04 -40.82 26.94 Favored 'General case' 0 N--CA 1.523 3.217 0 CA-C-O 117.583 -1.199 . . . . 0.0 111.202 178.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 557' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.36 -25.1 19.27 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.557 0 CA-C-N 121.115 1.78 . . . . 0.0 110.236 -179.547 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 558' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -85.56 -50.92 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.928 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -58.8 -26.6 64.24 Favored 'General case' 0 N--CA 1.537 3.879 0 CA-C-O 118.985 -0.531 . . . . 0.0 110.377 178.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -95.03 -21.87 18.29 Favored 'General case' 0 N--CA 1.525 3.31 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.854 178.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 27.7 tp -71.44 -47.36 56.35 Favored 'General case' 0 N--CA 1.537 3.914 0 CA-C-N 119.751 1.16 . . . . 0.0 108.617 178.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 51.7 mt -59.26 -18.5 37.94 Favored 'General case' 0 N--CA 1.536 3.839 0 CA-C-O 118.143 -0.932 . . . . 0.0 113.157 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -94.21 -46.53 7.04 Favored 'General case' 0 N--CA 1.526 3.369 0 CA-C-N 119.359 0.982 . . . . 0.0 108.971 179.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 68.42 66.75 2.19 Favored Glycine 1 N--CA 1.52 4.262 0 CA-C-O 119.374 -0.681 . . . . 0.0 112.364 178.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -118.31 -59.56 1.88 Allowed 'General case' 0 N--CA 1.525 3.316 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 178.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 75.1 mtm -152.65 80.64 1.22 Allowed 'General case' 0 N--CA 1.522 3.138 0 N-CA-C 105.25 -2.13 . . . . 0.0 105.25 178.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 50.0 m -131.63 -9.0 3.62 Favored 'General case' 0 N--CA 1.524 3.248 0 N-CA-C 114.049 1.129 . . . . 0.0 114.049 -173.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -117.27 -56.15 2.26 Favored 'General case' 0 N--CA 1.526 3.325 0 CA-C-N 119.852 1.205 . . . . 0.0 110.989 -179.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -89.74 -62.8 1.39 Allowed 'General case' 0 N--CA 1.526 3.375 0 C-N-CA 122.661 0.385 . . . . 0.0 111.538 -178.071 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -80.59 -0.45 37.93 Favored 'General case' 0 N--CA 1.521 3.076 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -176.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 21.4 tp -78.84 -45.81 20.01 Favored 'General case' 0 N--CA 1.526 3.337 0 CA-C-N 120.207 1.367 . . . . 0.0 110.398 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -45.81 -28.75 1.14 Allowed 'General case' 0 N--CA 1.534 3.771 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 -177.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -73.25 -41.33 63.82 Favored 'General case' 0 N--CA 1.532 3.666 0 CA-C-N 118.283 0.492 . . . . 0.0 111.358 -178.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -47.29 -51.58 18.73 Favored 'General case' 0 N--CA 1.536 3.836 0 C-N-CA 124.591 1.157 . . . . 0.0 113.672 -178.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -130.07 -39.75 1.36 Allowed 'General case' 0 N--CA 1.535 3.811 0 CA-C-O 118.662 -0.685 . . . . 0.0 111.857 -179.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 107.31 76.02 0.96 Allowed Glycine 1 N--CA 1.52 4.262 0 N-CA-C 110.331 -1.107 . . . . 0.0 110.331 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -114.23 -1.88 13.51 Favored 'General case' 0 N--CA 1.526 3.374 0 C-N-CA 123.463 0.705 . . . . 0.0 111.47 178.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 72.49 169.24 12.95 Favored Glycine 1 N--CA 1.52 4.272 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -178.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 579' ' ' ILE . . . . . 0.443 HG23 ' N6 ' ' E' ' 4' ' ' ' DA' . 1.0 OUTLIER -90.4 -13.18 9.31 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.812 0 CA-C-N 118.554 1.177 . . . . 0.0 108.966 177.937 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 580' ' ' ALA . . . . . 0.41 ' HB3' ' H62' ' F' ' 15' ' ' ' DA' . . . -64.98 -37.65 88.35 Favored 'General case' 0 N--CA 1.526 3.346 0 CA-C-N 120.154 1.343 . . . . 0.0 111.583 178.618 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 2.8 p -82.97 -41.98 18.13 Favored 'General case' 1 N--CA 1.542 4.145 0 CA-C-N 120.1 1.318 . . . . 0.0 111.839 -179.378 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 17.2 pt -70.25 -18.11 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.959 0 CA-C-O 117.685 -1.15 . . . . 0.0 113.385 -177.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 80.0 p -112.76 -27.49 8.13 Favored 'General case' 0 N--CA 1.514 2.774 0 CA-C-N 119.962 1.255 . . . . 0.0 111.038 177.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -75.57 -20.31 58.71 Favored 'General case' 0 N--CA 1.535 3.775 0 CA-C-N 120.049 1.295 . . . . 0.0 108.491 174.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -65.12 -36.59 93.12 Favored Glycine 1 N--CA 1.517 4.037 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 176.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 68.4 p -64.95 -33.85 77.02 Favored 'General case' 1 N--CA 1.541 4.119 0 CA-C-N 118.399 1.099 . . . . 0.0 110.325 177.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -56.52 -35.06 67.62 Favored 'General case' 1 N--CA 1.545 4.289 0 C-N-CA 123.819 0.848 . . . . 0.0 111.134 178.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 28.5 m -57.55 -42.84 83.79 Favored 'General case' 1 N--CA 1.541 4.096 0 C-N-CA 123.651 0.78 . . . . 0.0 111.153 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 19.8 mt -56.46 -44.82 80.9 Favored 'General case' 0 N--CA 1.528 3.447 0 C-N-CA 124.03 0.932 . . . . 0.0 111.63 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 20.9 mmmt -57.46 -26.47 61.27 Favored 'General case' 1 N--CA 1.544 4.229 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -86.86 -39.98 15.33 Favored 'General case' 0 N--CA 1.515 2.801 0 CA-C-N 118.493 0.588 . . . . 0.0 110.728 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.6 162.3 28.42 Favored Pre-proline 1 N--CA 1.542 4.136 0 CA-C-O 118.346 -0.835 . . . . 0.0 111.974 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -84.98 172.07 8.92 Favored 'Trans proline' 0 C--N 1.377 2.068 0 C-N-CA 122.045 1.83 . . . . 0.0 111.309 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.2 t -92.31 -24.64 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.118 0 CA-C-O 117.818 -1.087 . . . . 0.0 111.497 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -62.9 -40.66 98.24 Favored 'General case' 0 N--CA 1.516 2.866 0 CA-C-N 120.004 1.275 . . . . 0.0 110.437 -179.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 7.1 mp -102.14 -12.54 17.99 Favored 'General case' 0 N--CA 1.511 2.59 0 C-N-CA 123.388 0.675 . . . . 0.0 112.188 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -31.46 71.46 Favored 'General case' 1 N--CA 1.544 4.241 0 N-CA-C 102.572 -3.122 . . . . 0.0 102.572 167.055 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.47 -38.29 68.91 Favored 'General case' 0 N--CA 1.52 3.054 0 C-N-CA 124.937 1.295 . . . . 0.0 110.289 174.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 599' ' ' TRP . . . . . 0.406 ' HA ' ' HB2' ' B' ' 602' ' ' GLU . 53.2 t90 -64.72 -35.84 82.37 Favored 'General case' 0 N--CA 1.538 3.946 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 176.798 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.37 -37.44 62.41 Favored 'General case' 0 N--CA 1.535 3.822 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 176.282 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -68.91 -37.53 79.02 Favored 'General case' 1 N--CA 1.544 4.248 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 175.273 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 602' ' ' GLU . . . . . 0.406 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 3.1 mm-40 -60.88 -21.75 63.6 Favored 'General case' 1 N--CA 1.543 4.192 0 C-N-CA 123.362 0.665 . . . . 0.0 110.494 175.867 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -123.9 6.99 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.536 0 C-N-CA 123.269 0.628 . . . . 0.0 112.439 -177.618 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -111.11 -59.43 1.97 Allowed 'General case' 0 N--CA 1.514 2.74 0 N-CA-C 105.385 -2.08 . . . . 0.0 105.385 176.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 12.6 tp -48.99 -31.57 7.7 Favored 'General case' 0 N--CA 1.537 3.917 0 C-N-CA 125.085 1.354 . . . . 0.0 111.546 177.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -82.75 -63.68 1.32 Allowed 'General case' 0 N--CA 1.52 3.038 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 -179.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 41.3 p . . . . . 0 N--CA 1.527 3.388 0 CA-C-O 118.568 -0.73 . . . . 0.0 110.249 -179.281 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.153 0 CA-C-O 118.286 -0.864 . . . . 0.0 108.718 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.106 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.425 -9.258 3 O4'-C1'-N19 119.513 14.641 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.709 5 O4'-C1'-N19 120.418 15.772 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.241 3 O4'-C1'-N19 120.228 15.535 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . 0.511 ' N6 ' HG23 ' B' ' 579' ' ' ILE . . . . . . . . 4 C3'--C2' 1.42 -9.775 4 O4'-C1'-N19 120.422 15.778 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' E' E ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.575 11.081 5 O4'-C1'-N19 118.612 13.515 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.404 -11.351 5 O4'-C1'-N19 120.328 15.66 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' E' E ' 7' ' ' ' DA' . . . . . 0.535 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.399 -11.923 3 C4'-C3'-C2' 113.495 10.295 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' E' E ' 8' ' ' ' DG' . . . . . 0.535 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 O3'--C3' 1.575 11.109 4 O4'-C1'-N19 119.784 14.98 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.576 11.185 5 O4'-C1'-N19 118.848 13.811 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.411 -10.695 3 O4'-C1'-N19 118.966 13.958 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.412 -10.593 5 O4'-C1'-N19 119.614 14.768 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.311 2 O4'-C1'-N19 119.406 14.507 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.41 -10.782 5 O4'-C1'-N19 118.942 13.928 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' E' E ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.503 5 O4'-C1'-N19 118.73 13.662 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' E' E ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.433 -8.523 4 O4'-C1'-N19 119.35 14.437 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.417 -10.064 4 O4'-C1'-N19 119.961 15.201 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.573 10.959 3 O4'-C1'-N19 120.19 15.487 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.608 5 O4'-C1'-N19 119.905 15.131 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.419 -9.945 5 O4'-C1'-N19 119.558 14.698 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.51 6.944 4 O4'-C1'-N19 120.051 15.313 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.556 3 O4'-C1'-N19 118.939 13.923 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.415 -10.312 3 O4'-C1'-N19 118.865 13.831 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.406 -11.177 5 O4'-C1'-N19 120.12 15.399 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' F' F ' 4' ' ' ' DA' . . . . . 0.49 ' N6 ' HG23 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.419 -9.92 4 O4'-C1'-N19 119.548 14.685 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' F' F ' 5' ' ' ' DC' . . . . . 0.446 ' H42' ' HA ' ' A' ' 80' ' ' ALA . . . . . . . . 6 O3'--C3' 1.574 11.007 4 C4'-C3'-C2' 116.069 12.869 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.41 -10.81 4 O4'-C1'-N19 118.815 13.769 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' F' F ' 7' ' ' ' DA' . . . . . 0.739 H2'' H5'' ' F' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.382 -13.637 5 N19-C1'-C2' 129.539 9.587 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' F' F ' 8' ' ' ' DG' . . . . . 0.739 H5'' H2'' ' F' ' 7' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.41 -10.767 4 O4'-C1'-N19 118.116 12.895 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.744 3 O4'-C1'-N19 119.821 15.026 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.459 3 O4'-C1'-N19 119.094 14.117 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.407 -11.119 3 O4'-C1'-N19 120.192 15.489 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.435 4 O4'-C1'-N19 119.026 14.032 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.574 11.033 5 O4'-C1'-N19 119.54 14.675 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' F' F ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.478 3 O4'-C1'-N19 118.931 13.913 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' F' F ' 15' ' ' ' DA' . . . . . 0.409 ' H62' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.425 -9.255 5 O4'-C1'-N19 119.808 15.01 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.286 5 O4'-C1'-N19 119.619 14.774 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.421 -9.678 3 O4'-C1'-N19 119.443 14.554 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -9.952 4 O4'-C1'-N19 119.83 15.038 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -11.013 4 O4'-C1'-N19 120.252 15.565 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.513 7.119 5 O4'-C1'-N19 119.895 15.119 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 17.0 tt0 . . . . . 0 N--CA 1.501 2.099 0 CA-C-O 119.139 -0.458 . . . . 0.0 110.083 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.5 t -155.65 135.3 8.11 Favored Pre-proline 0 N--CA 1.524 3.252 0 CA-C-O 117.353 -1.308 . . . . 0.0 111.143 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -76.04 156.76 38.51 Favored 'Trans proline' 0 C--N 1.386 2.54 0 C-N-CA 122.685 2.257 . . . . 0.0 110.816 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -122.76 -56.74 1.76 Allowed 'General case' 0 N--CA 1.525 3.321 0 CA-C-O 118.96 -0.543 . . . . 0.0 110.405 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 59.8 p -146.77 151.35 37.01 Favored 'General case' 0 N--CA 1.528 3.431 0 N-CA-C 113.045 0.758 . . . . 0.0 113.045 -177.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -105.18 -49.22 3.51 Favored 'General case' 0 N--CA 1.515 2.82 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 60.73 157.58 0.04 OUTLIER 'General case' 0 N--CA 1.537 3.893 0 C-N-CA 124.381 1.072 . . . . 0.0 112.923 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.5 ttt -117.64 -56.76 2.18 Favored 'General case' 0 N--CA 1.514 2.746 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -158.22 125.34 4.97 Favored 'General case' 0 N--CA 1.52 3.03 0 O-C-N 123.037 0.211 . . . . 0.0 110.996 179.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -127.48 -51.89 1.38 Allowed 'General case' 0 N--CA 1.521 3.111 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 179.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 65.52 106.13 0.04 OUTLIER 'General case' 0 N--CA 1.526 3.374 0 C-N-CA 124.674 1.189 . . . . 0.0 111.926 178.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -120.89 -36.12 3.21 Favored 'General case' 0 N--CA 1.527 3.411 0 C-N-CA 123.788 0.835 . . . . 0.0 109.732 178.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 69.36 119.66 0.03 OUTLIER 'General case' 0 N--CA 1.531 3.609 0 C-N-CA 125.283 1.433 . . . . 0.0 111.414 178.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -113.65 102.62 10.44 Favored 'General case' 0 N--CA 1.516 2.837 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -125.36 -73.1 0.64 Allowed 'General case' 0 N--CA 1.516 2.832 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.453 ' HA ' HD21 ' B' ' 551' ' ' LEU . 66.6 t-105 -53.42 -39.46 64.36 Favored 'General case' 0 N--CA 1.536 3.85 0 C-N-CA 123.042 0.537 . . . . 0.0 109.64 175.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -79.93 -27.29 39.86 Favored 'General case' 0 N--CA 1.517 2.898 0 CA-C-O 117.372 -1.299 . . . . 0.0 112.259 -175.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.8 mtt-85 -57.6 -31.72 66.49 Favored 'General case' 1 N--CA 1.547 4.406 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 172.126 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.515 ' CG ' HD22 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -80.78 -36.81 31.31 Favored 'General case' 0 N--CA 1.504 2.247 0 CA-C-O 116.22 -1.847 . . . . 0.0 109.668 174.615 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.7 t -69.98 -22.83 24.87 Favored 'Isoleucine or valine' 1 N--CA 1.565 5.289 0 CA-C-N 121.373 1.897 . . . . 0.0 112.498 -176.147 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -78.21 -48.56 15.56 Favored 'General case' 0 N--CA 1.535 3.781 0 CA-C-N 120.418 1.463 . . . . 0.0 107.496 178.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.2 mp -70.38 -17.9 63.04 Favored 'General case' 0 N--CA 1.535 3.818 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 175.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.53 -38.56 67.99 Favored 'General case' 0 N--CA 1.517 2.907 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 176.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.454 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 32.6 tttt -66.61 -16.94 64.55 Favored 'General case' 0 N--CA 1.514 2.727 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.025 176.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -74.14 -40.08 62.86 Favored 'General case' 0 N--CA 1.528 3.457 0 N-CA-C 108.32 -0.992 . . . . 0.0 108.32 175.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -89.92 -4.5 57.48 Favored 'General case' 0 N--CA 1.505 2.321 0 CA-C-O 118.701 -0.666 . . . . 0.0 110.434 177.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.454 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -87.55 -33.98 18.73 Favored 'General case' 0 N--CA 1.529 3.518 0 CA-C-N 120.364 1.438 . . . . 0.0 108.381 179.34 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -61.64 -41.82 98.03 Favored 'General case' 0 N--CA 1.537 3.907 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -92.55 -85.38 0.26 Allowed 'General case' 0 N--CA 1.511 2.612 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 177.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p30 150.47 46.84 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.071 0 C-N-CA 127.673 2.389 . . . . 0.0 108.56 177.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.8 mt -106.02 16.19 25.41 Favored 'General case' 0 N--CA 1.522 3.171 0 C-N-CA 124.557 1.143 . . . . 0.0 110.365 -178.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 42.7 p-80 -82.65 4.2 25.82 Favored 'General case' 0 N--CA 1.514 2.735 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 175.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.408 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 17.5 mt -92.67 -50.45 0.28 Allowed Pre-proline 0 N--CA 1.509 2.49 0 C-N-CA 125.462 1.505 . . . . 0.0 108.665 -176.116 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.408 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 9.5 Cg_exo -62.51 -35.96 68.14 Favored 'Trans proline' 0 C--N 1.391 2.811 0 N-CA-C 105.945 -2.367 . . . . 0.0 105.945 168.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.1 tt -53.7 -44.24 69.63 Favored 'General case' 0 N--CA 1.534 3.725 0 C-N-CA 124.085 0.954 . . . . 0.0 108.998 174.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.73 -40.91 94.14 Favored 'General case' 1 N--CA 1.557 4.898 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 177.834 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -63.59 -12.97 37.44 Favored 'General case' 0 N--CA 1.535 3.807 0 CA-C-O 118.123 -0.942 . . . . 0.0 113.036 -179.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -110.92 -41.78 4.16 Favored 'General case' 0 N--CA 1.531 3.579 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 -177.41 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 4.0 ptp -128.72 13.27 6.39 Favored 'General case' 1 N--CA 1.55 4.571 0 CA-C-N 119.848 1.204 . . . . 0.0 113.436 -175.359 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -113.2 -72.65 0.7 Allowed 'General case' 0 N--CA 1.496 1.856 0 CA-C-N 118.99 0.814 . . . . 0.0 108.946 179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 14.2 p 126.52 156.98 0.0 OUTLIER Pre-proline 1 N--CA 1.549 4.507 0 C-N-CA 128.629 2.772 . . . . 0.0 107.343 -178.02 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -70.03 -35.74 11.32 Favored 'Trans proline' 0 CA--C 1.571 2.366 0 C-N-CA 122.345 2.03 . . . . 0.0 107.572 174.189 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -65.31 -21.11 66.67 Favored 'General case' 0 N--CA 1.529 3.503 0 CA-C-O 118.175 -0.916 . . . . 0.0 110.296 175.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -75.03 -28.76 60.57 Favored 'General case' 0 N--CA 1.52 3.027 0 CA-C-O 117.283 -1.341 . . . . 0.0 110.137 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.8 ptt180 -87.21 -19.84 27.81 Favored 'General case' 0 N--CA 1.539 3.991 0 CA-C-N 120.406 1.457 . . . . 0.0 107.745 172.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -72.96 -24.09 60.74 Favored 'General case' 0 N--CA 1.525 3.302 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 172.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.404 ' O ' ' HB2' ' A' ' 54' ' ' ARG . . . -87.1 -42.95 12.65 Favored 'General case' 0 N--CA 1.501 2.1 0 CA-C-O 117.982 -1.009 . . . . 0.0 108.71 179.527 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.447 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 24.0 tp -68.24 -20.21 64.79 Favored 'General case' 1 N--CA 1.544 4.252 0 CA-C-N 120.753 1.615 . . . . 0.0 107.747 173.855 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.408 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -68.21 -69.27 1.42 Allowed Glycine 0 N--CA 1.5 2.966 0 C-N-CA 125.493 1.52 . . . . 0.0 111.17 177.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.7 m -75.44 -27.53 58.96 Favored 'General case' 0 N--CA 1.53 3.563 0 CA-C-O 117.838 -1.077 . . . . 0.0 112.442 -177.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.404 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -68.03 -49.4 61.72 Favored 'General case' 0 N--CA 1.531 3.62 0 CA-C-N 120.185 1.357 . . . . 0.0 107.705 177.514 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.3 t -65.67 -18.59 24.19 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.1 0 CA-C-O 117.929 -1.034 . . . . 0.0 109.776 176.258 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -71.84 -51.58 21.7 Favored 'General case' 0 N--CA 1.527 3.38 0 CA-C-N 120.012 1.278 . . . . 0.0 111.558 178.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -23.66 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.428 0 CA-C-N 120.789 1.631 . . . . 0.0 111.863 -178.049 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -86.13 -52.72 11.63 Favored 'Isoleucine or valine' 1 N--CA 1.548 4.454 0 CA-C-N 120.772 1.624 . . . . 0.0 107.308 -179.758 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -59.6 -24.06 63.47 Favored 'General case' 0 N--CA 1.532 3.634 0 CA-C-O 118.579 -0.724 . . . . 0.0 110.453 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -94.36 -24.18 17.49 Favored 'General case' 0 N--CA 1.524 3.23 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.5 177.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.0 mt -72.2 -59.85 2.53 Favored 'General case' 0 N--CA 1.536 3.848 0 CA-C-N 119.521 1.055 . . . . 0.0 110.041 -179.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 46.3 mt -50.56 -29.29 10.39 Favored 'General case' 1 N--CA 1.545 4.308 0 C-N-CA 123.443 0.697 . . . . 0.0 112.732 -179.15 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -79.91 -47.78 14.51 Favored 'General case' 0 N--CA 1.528 3.446 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 71.67 86.99 0.15 Allowed Glycine 1 N--CA 1.519 4.169 0 CA-C-O 119.368 -0.684 . . . . 0.0 112.096 178.156 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -151.39 -54.71 0.14 Allowed 'General case' 0 N--CA 1.53 3.562 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 4.3 ttt -147.2 71.75 1.23 Allowed 'General case' 0 N--CA 1.52 3.045 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 178.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.2 p -142.86 7.41 1.64 Allowed 'General case' 0 N--CA 1.52 3.066 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -175.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -122.53 -62.31 1.38 Allowed 'General case' 0 N--CA 1.529 3.488 0 CA-C-N 119.672 1.124 . . . . 0.0 111.992 -178.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -110.28 -48.79 3.13 Favored 'General case' 0 N--CA 1.524 3.236 0 C-N-CA 123.547 0.739 . . . . 0.0 109.908 -177.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -78.47 4.6 12.77 Favored 'General case' 0 N--CA 1.513 2.71 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -177.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 44.0 tp -89.13 -46.54 8.74 Favored 'General case' 0 N--CA 1.53 3.567 0 CA-C-N 120.285 1.402 . . . . 0.0 113.233 -178.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -41.7 -42.59 2.6 Favored 'General case' 1 N--CA 1.544 4.228 0 N-CA-C 116.169 1.914 . . . . 0.0 116.169 -173.906 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -64.1 -21.52 66.57 Favored 'General case' 1 N--CA 1.545 4.306 0 CA-C-N 119.071 0.85 . . . . 0.0 113.117 -177.592 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -57.65 -59.77 4.69 Favored 'General case' 0 N--CA 1.529 3.476 0 C-N-CA 124.579 1.152 . . . . 0.0 112.587 -178.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -130.78 -42.0 1.15 Allowed 'General case' 0 N--CA 1.526 3.369 0 CA-C-O 118.857 -0.592 . . . . 0.0 111.21 -179.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 120.34 78.26 0.53 Allowed Glycine 0 N--CA 1.514 3.897 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 179.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -104.53 -39.76 6.29 Favored 'General case' 0 N--CA 1.524 3.257 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 177.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.34 162.24 23.52 Favored Glycine 1 N--CA 1.524 4.547 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 -179.007 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.49 HG23 ' N6 ' ' F' ' 4' ' ' ' DA' . 1.5 mt -84.7 -13.82 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.813 0 CA-C-N 119.721 1.761 . . . . 0.0 108.346 178.111 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.446 ' HA ' ' H42' ' F' ' 5' ' ' ' DC' . . . -70.75 -40.31 72.77 Favored 'General case' 0 N--CA 1.517 2.878 0 CA-C-O 117.656 -1.164 . . . . 0.0 110.294 177.09 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 4.6 p -79.52 -42.37 25.32 Favored 'General case' 0 N--CA 1.538 3.961 0 CA-C-N 119.838 1.199 . . . . 0.0 112.807 -178.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 20.5 pt -70.88 -16.49 19.62 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.022 0 CA-C-O 117.853 -1.07 . . . . 0.0 113.749 -176.552 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 80.4 p -113.01 -32.75 6.26 Favored 'General case' 0 N--CA 1.514 2.773 0 CA-C-N 119.795 1.18 . . . . 0.0 110.216 178.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.5 ptt180 -71.91 -20.22 61.81 Favored 'General case' 0 N--CA 1.533 3.68 0 CA-C-N 119.56 1.073 . . . . 0.0 109.005 175.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -64.78 -38.18 95.26 Favored Glycine 1 N--CA 1.52 4.263 0 N-CA-C 108.529 -1.829 . . . . 0.0 108.529 175.43 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.3 m -65.09 -28.13 69.24 Favored 'General case' 1 N--CA 1.54 4.042 0 CA-C-N 117.747 0.773 . . . . 0.0 110.708 176.678 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -60.64 -31.62 70.82 Favored 'General case' 1 N--CA 1.54 4.046 0 CA-C-N 118.542 0.61 . . . . 0.0 111.228 179.218 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 2.6 m -65.59 -35.29 80.38 Favored 'General case' 0 N--CA 1.537 3.89 0 C-N-CA 123.471 0.708 . . . . 0.0 111.219 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 23.8 mt -56.33 -40.11 73.9 Favored 'General case' 0 N--CA 1.534 3.759 0 C-N-CA 124.165 0.986 . . . . 0.0 111.882 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -20.73 18.95 Favored 'General case' 1 N--CA 1.54 4.042 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 -178.756 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -106.56 -30.76 8.84 Favored 'General case' 0 N--CA 1.517 2.913 0 CA-C-N 119.301 0.955 . . . . 0.0 112.511 -179.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -49.88 160.37 0.64 Allowed Pre-proline 1 N--CA 1.55 4.531 0 CA-C-N 119.285 0.948 . . . . 0.0 113.508 -178.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -85.29 151.12 10.6 Favored 'Trans proline' 0 C--N 1.379 2.166 0 C-N-CA 122.497 2.131 . . . . 0.0 110.511 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.8 t -84.08 -25.83 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.217 0 CA-C-O 117.694 -1.146 . . . . 0.0 111.858 -179.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -63.27 -40.6 97.85 Favored 'General case' 0 N--CA 1.52 3.029 0 CA-C-N 120.346 1.43 . . . . 0.0 109.85 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.0 mp -97.87 -13.97 20.97 Favored 'General case' 0 N--CA 1.51 2.542 0 C-N-CA 123.818 0.847 . . . . 0.0 111.344 178.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.07 -36.65 84.7 Favored 'General case' 1 N--CA 1.544 4.237 0 N-CA-C 102.809 -3.034 . . . . 0.0 102.809 168.005 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -52.78 -38.27 60.87 Favored 'General case' 0 N--CA 1.517 2.886 0 C-N-CA 124.585 1.154 . . . . 0.0 111.621 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 50.6 t90 -63.0 -37.1 85.81 Favored 'General case' 0 N--CA 1.532 3.64 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 10.0 mp -55.31 -35.33 65.0 Favored 'General case' 1 N--CA 1.543 4.197 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 176.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -70.5 -35.95 73.51 Favored 'General case' 0 N--CA 1.536 3.853 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 175.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -62.2 -23.78 66.84 Favored 'General case' 1 N--CA 1.542 4.164 0 C-N-CA 123.739 0.816 . . . . 0.0 110.087 175.285 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -120.96 12.82 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.556 0 C-N-CA 123.673 0.789 . . . . 0.0 111.851 -178.052 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 43.4 mt -124.85 -62.32 1.25 Allowed 'General case' 0 N--CA 1.526 3.351 0 N-CA-C 106.573 -1.639 . . . . 0.0 106.573 176.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.8 tt -46.68 -38.4 9.75 Favored 'General case' 1 N--CA 1.548 4.448 0 C-N-CA 125.278 1.431 . . . . 0.0 111.899 179.073 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 32.6 ttmt 89.19 102.03 0.03 OUTLIER 'General case' 1 N--CA 1.54 4.051 0 C-N-CA 125.793 1.637 . . . . 0.0 108.045 -179.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 28.3 p . . . . . 0 N--CA 1.525 3.317 0 CA-C-O 118.557 -0.735 . . . . 0.0 109.458 -179.763 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 . . . . . 0 N--CA 1.502 2.171 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 82.3 p 61.84 117.73 0.02 OUTLIER Pre-proline 0 N--CA 1.536 3.827 0 C-N-CA 125.412 1.485 . . . . 0.0 111.242 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -70.91 165.02 33.64 Favored 'Trans proline' 0 C--N 1.389 2.693 0 C-N-CA 122.421 2.081 . . . . 0.0 112.575 -179.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -121.61 -54.64 1.95 Allowed 'General case' 0 N--CA 1.518 2.96 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 178.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 71.5 m -112.83 146.32 39.08 Favored 'General case' 0 N--CA 1.522 3.174 0 C-N-CA 123.139 0.576 . . . . 0.0 111.609 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -101.9 126.72 48.86 Favored 'General case' 0 N--CA 1.52 3.03 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -78.15 129.81 35.6 Favored 'General case' 0 N--CA 1.524 3.238 0 C-N-CA 122.395 0.278 . . . . 0.0 110.773 -178.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 48.2 mtt -145.88 126.79 14.49 Favored 'General case' 0 N--CA 1.526 3.333 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 179.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -115.35 135.63 53.94 Favored 'General case' 0 N--CA 1.521 3.078 0 C-N-CA 122.998 0.519 . . . . 0.0 111.275 -178.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -136.32 -54.97 0.75 Allowed 'General case' 0 N--CA 1.523 3.202 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 178.724 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -102.0 91.84 4.52 Favored 'General case' 0 N--CA 1.518 2.939 0 N-CA-C 108.323 -0.992 . . . . 0.0 108.323 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -139.57 132.08 28.67 Favored 'General case' 0 N--CA 1.527 3.418 0 C-N-CA 122.935 0.494 . . . . 0.0 110.075 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 12.1 p80 -150.49 113.66 4.85 Favored 'General case' 0 N--CA 1.524 3.27 0 C-N-CA 122.691 0.396 . . . . 0.0 110.145 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -101.49 129.74 47.6 Favored 'General case' 0 N--CA 1.527 3.394 0 C-N-CA 123.004 0.522 . . . . 0.0 110.242 -179.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -119.41 -77.16 0.57 Allowed 'General case' 0 N--CA 1.517 2.894 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 519' ' ' TRP . . . . . 0.455 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 68.5 t-105 -43.33 -28.09 0.3 Allowed 'General case' 1 N--CA 1.545 4.324 0 C-N-CA 124.206 1.002 . . . . 0.0 113.679 179.834 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 520' ' ' LEU . . . . . 0.414 ' CD2' ' N ' ' B' ' 520' ' ' LEU . 2.2 mm? -96.12 -30.38 13.56 Favored 'General case' 0 N--CA 1.528 3.434 0 CA-C-O 117.847 -1.073 . . . . 0.0 113.733 -172.12 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 21.1 tpp180 -64.8 -23.44 67.24 Favored 'General case' 0 N--CA 1.533 3.679 0 N-CA-C 105.882 -1.896 . . . . 0.0 105.882 172.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . 0.455 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 2.1 m-85 -76.42 -41.39 47.85 Favored 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 106.059 -1.83 . . . . 0.0 106.059 172.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 72.2 t -64.53 -18.32 22.98 Favored 'Isoleucine or valine' 1 N--CA 1.559 4.986 0 CA-C-N 119.52 1.055 . . . . 0.0 111.685 177.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -76.53 -56.22 4.82 Favored 'General case' 0 N--CA 1.532 3.669 0 CA-C-N 120.276 1.398 . . . . 0.0 107.842 -179.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 5.6 mp -67.61 -18.98 65.17 Favored 'General case' 0 N--CA 1.533 3.678 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 175.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.36 -39.78 74.44 Favored 'General case' 0 N--CA 1.513 2.716 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 177.688 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -67.07 -18.65 65.43 Favored 'General case' 0 N--CA 1.524 3.24 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.884 177.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -72.97 -39.88 65.77 Favored 'General case' 0 N--CA 1.529 3.517 0 CA-C-N 119.46 1.027 . . . . 0.0 108.665 176.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 529' ' ' ALA . . . . . 0.415 ' HB2' ' N ' ' B' ' 535' ' ' HIS . . . -92.83 -7.6 45.9 Favored 'General case' 0 N--CA 1.507 2.399 0 CA-C-O 118.629 -0.7 . . . . 0.0 111.166 178.221 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.73 -34.51 24.86 Favored 'General case' 0 N--CA 1.535 3.803 0 CA-C-N 120.35 1.432 . . . . 0.0 108.515 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -62.68 -41.35 99.05 Favored 'General case' 0 N--CA 1.534 3.728 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 177.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -91.85 -87.62 0.21 Allowed 'General case' 0 N--CA 1.514 2.732 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 176.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.9 p30 150.33 51.27 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.07 0 C-N-CA 127.755 2.422 . . . . 0.0 108.415 177.227 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 4.8 mt -110.75 9.15 22.71 Favored 'General case' 0 N--CA 1.529 3.486 0 C-N-CA 124.624 1.17 . . . . 0.0 111.024 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 535' ' ' HIS . . . . . 0.415 ' N ' ' HB2' ' B' ' 529' ' ' ALA . 57.2 p-80 -82.53 -0.9 48.81 Favored 'General case' 0 N--CA 1.515 2.793 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 174.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 536' ' ' LEU . . . . . . . . . . . . . 39.2 mt -91.29 -49.82 0.33 Allowed Pre-proline 0 N--CA 1.505 2.277 0 CA-C-O 116.317 -1.802 . . . . 0.0 109.212 -176.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 537' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -66.26 -35.19 33.15 Favored 'Trans proline' 0 C--N 1.395 2.996 0 N-CA-C 107.345 -1.829 . . . . 0.0 107.345 171.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.17 -39.6 93.19 Favored 'General case' 0 N--CA 1.533 3.682 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 175.111 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 9.8 mt -73.32 -23.08 60.21 Favored 'General case' 0 N--CA 1.535 3.817 0 CA-C-O 118.583 -0.722 . . . . 0.0 111.125 177.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -71.53 -17.14 62.34 Favored 'General case' 0 N--CA 1.531 3.596 0 CA-C-N 118.853 0.751 . . . . 0.0 110.802 178.212 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 1.9 tt -101.01 -52.86 3.18 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 123.495 0.718 . . . . 0.0 110.916 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 12.2 ptm -54.55 -41.52 69.87 Favored 'General case' 0 N--CA 1.531 3.611 0 CA-C-O 117.754 -1.117 . . . . 0.0 113.301 -174.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 1.3 tt -134.37 -104.3 0.23 Allowed 'General case' 0 N--CA 1.533 3.722 0 CA-C-O 117.307 -1.33 . . . . 0.0 113.545 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 31.0 p -156.27 163.47 24.77 Favored Pre-proline 1 N--CA 1.545 4.278 0 CA-C-N 121.322 1.874 . . . . 0.0 112.389 -177.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -67.54 -27.48 39.19 Favored 'Trans proline' 0 C--N 1.392 2.85 0 C-N-CA 122.849 2.366 . . . . 0.0 111.287 176.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -61.36 -21.57 64.16 Favored 'General case' 1 N--CA 1.54 4.03 0 CA-C-O 118.327 -0.844 . . . . 0.0 111.122 178.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -71.27 -38.48 71.85 Favored 'General case' 0 N--CA 1.528 3.446 0 CA-C-N 119.061 0.846 . . . . 0.0 108.923 177.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -79.78 -19.71 47.98 Favored 'General case' 0 N--CA 1.525 3.285 0 CA-C-O 117.792 -1.099 . . . . 0.0 111.126 177.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -68.65 -45.89 70.58 Favored 'General case' 0 N--CA 1.539 3.998 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 175.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -79.53 -16.41 56.02 Favored 'General case' 0 N--CA 1.509 2.508 0 CA-C-O 117.376 -1.297 . . . . 0.0 110.726 176.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 551' ' ' LEU . . . . . 0.515 HD22 ' CG ' ' A' ' 22' ' ' PHE . 5.7 tp -74.89 -31.54 61.6 Favored 'General case' 0 N--CA 1.528 3.451 0 CA-C-N 120.758 1.617 . . . . 0.0 107.765 174.759 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -70.74 -62.06 3.79 Favored Glycine 0 N--CA 1.5 2.918 0 N-CA-C 109.051 -1.62 . . . . 0.0 109.051 178.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 3.1 m -61.05 -27.37 68.29 Favored 'General case' 1 N--CA 1.54 4.058 0 CA-C-O 118.393 -0.813 . . . . 0.0 112.119 -179.34 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 7.5 mtm180 -69.5 -49.33 55.61 Favored 'General case' 0 N--CA 1.539 3.997 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 176.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 21.8 t -66.23 -15.51 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.865 0 CA-C-O 118.144 -0.931 . . . . 0.0 109.809 175.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 26.3 mtp180 -77.75 -46.71 20.94 Favored 'General case' 0 N--CA 1.52 3.067 0 CA-C-N 119.568 1.076 . . . . 0.0 110.807 178.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 557' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -71.56 -24.71 23.76 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.502 0 CA-C-N 120.282 1.401 . . . . 0.0 111.084 -179.054 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 558' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -87.83 -52.64 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.76 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 -179.07 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -59.88 -22.95 63.02 Favored 'General case' 0 N--CA 1.534 3.741 0 CA-C-O 118.81 -0.614 . . . . 0.0 110.701 178.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -91.51 -28.34 17.65 Favored 'General case' 0 N--CA 1.524 3.249 0 CA-C-O 118.546 -0.74 . . . . 0.0 109.935 177.257 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -68.04 -46.17 71.92 Favored 'General case' 1 N--CA 1.539 4.015 0 CA-C-N 119.224 0.92 . . . . 0.0 109.249 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 33.3 mt -55.88 -25.71 43.78 Favored 'General case' 0 N--CA 1.535 3.781 0 C-N-CA 124.533 1.133 . . . . 0.0 112.234 178.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -82.99 -52.59 6.53 Favored 'General case' 0 N--CA 1.515 2.799 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 179.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 80.21 77.34 0.96 Allowed Glycine 0 N--CA 1.512 3.729 0 N-CA-C 110.018 -1.233 . . . . 0.0 110.018 179.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -144.61 -60.7 0.37 Allowed 'General case' 0 N--CA 1.523 3.208 0 CA-C-N 117.294 0.547 . . . . 0.0 109.615 -179.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 43.6 mtt -148.86 79.73 1.42 Allowed 'General case' 0 N--CA 1.524 3.251 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 17.4 m -140.46 -16.13 0.93 Allowed 'General case' 0 N--CA 1.522 3.169 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 -174.191 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -110.75 -53.43 2.7 Favored 'General case' 0 N--CA 1.531 3.6 0 CA-C-N 120.626 1.557 . . . . 0.0 112.159 -177.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -106.68 -53.37 2.63 Favored 'General case' 0 N--CA 1.528 3.458 0 C-N-CA 123.116 0.566 . . . . 0.0 110.475 -177.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -74.79 -0.13 17.27 Favored 'General case' 0 N--CA 1.515 2.812 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -177.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 42.5 tp -88.64 -49.19 7.02 Favored 'General case' 0 N--CA 1.528 3.469 0 CA-C-N 120.142 1.337 . . . . 0.0 113.682 -177.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -44.39 -46.5 9.49 Favored 'General case' 1 N--CA 1.544 4.252 0 N-CA-C 114.935 1.457 . . . . 0.0 114.935 -175.11 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -62.47 -29.97 70.92 Favored 'General case' 1 N--CA 1.54 4.032 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -177.565 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -54.83 -57.36 11.87 Favored 'General case' 0 N--CA 1.528 3.437 0 C-N-CA 124.056 0.942 . . . . 0.0 112.636 -179.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -126.12 -38.99 2.11 Favored 'General case' 0 N--CA 1.533 3.709 0 CA-C-O 118.623 -0.703 . . . . 0.0 111.616 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 123.33 65.66 0.21 Allowed Glycine 1 N--CA 1.519 4.225 0 CA-C-N 118.971 0.805 . . . . 0.0 111.122 179.281 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -120.89 102.76 8.57 Favored 'General case' 0 N--CA 1.518 2.957 0 N-CA-C 105.506 -2.035 . . . . 0.0 105.506 177.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -40.4 162.82 0.01 OUTLIER Glycine 1 N--CA 1.539 5.513 0 C-N-CA 124.758 1.17 . . . . 0.0 114.653 -177.402 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 579' ' ' ILE . . . . . 0.511 HG23 ' N6 ' ' E' ' 4' ' ' ' DA' . 1.1 mt -79.43 -20.59 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.627 0 CA-C-N 119.028 1.414 . . . . 0.0 108.944 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 580' ' ' ALA . . . . . 0.409 ' HB3' ' H62' ' F' ' 15' ' ' ' DA' . . . -63.41 -33.53 75.75 Favored 'General case' 0 N--CA 1.53 3.545 0 CA-C-N 120.294 1.406 . . . . 0.0 109.853 175.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.8 p -80.24 -52.47 7.7 Favored 'General case' 0 N--CA 1.532 3.638 0 CA-C-N 118.997 0.817 . . . . 0.0 111.578 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 24.2 pt -67.33 -18.7 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.83 0 CA-C-O 117.701 -1.143 . . . . 0.0 113.482 -176.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 61.0 p -107.57 -25.61 11.28 Favored 'General case' 0 N--CA 1.516 2.844 0 CA-C-N 119.814 1.188 . . . . 0.0 110.781 178.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 13.8 ptt180 -75.64 -22.27 56.95 Favored 'General case' 0 N--CA 1.532 3.653 0 CA-C-N 120.232 1.378 . . . . 0.0 108.087 174.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -69.59 -34.64 73.45 Favored Glycine 0 N--CA 1.513 3.826 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 175.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 60.2 p -72.32 -39.59 68.09 Favored 'General case' 0 N--CA 1.536 3.831 0 CA-C-N 118.362 1.081 . . . . 0.0 110.052 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -60.58 -32.59 71.69 Favored 'General case' 1 N--CA 1.541 4.09 0 C-N-CA 123.126 0.571 . . . . 0.0 110.523 179.085 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 1.4 m -58.87 -38.88 79.8 Favored 'General case' 1 N--CA 1.541 4.114 0 C-N-CA 123.436 0.695 . . . . 0.0 110.381 178.488 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 42.1 mt -61.47 -44.91 96.26 Favored 'General case' 0 N--CA 1.525 3.286 0 C-N-CA 123.955 0.902 . . . . 0.0 110.725 179.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.92 -26.21 64.14 Favored 'General case' 1 N--CA 1.543 4.202 0 C-N-CA 123.678 0.791 . . . . 0.0 112.158 179.53 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -84.05 -39.99 18.91 Favored 'General case' 0 N--CA 1.517 2.911 0 CA-C-N 118.627 0.649 . . . . 0.0 111.917 -178.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -55.63 161.58 3.07 Favored Pre-proline 1 N--CA 1.546 4.373 0 CA-C-O 118.258 -0.877 . . . . 0.0 113.098 -179.591 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -80.05 -179.89 5.65 Favored 'Trans proline' 0 C--N 1.379 2.171 0 C-N-CA 121.777 1.651 . . . . 0.0 110.355 178.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -97.83 -28.34 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.036 0 CA-C-O 117.865 -1.064 . . . . 0.0 111.489 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -61.1 -44.04 97.97 Favored 'General case' 0 N--CA 1.517 2.903 0 CA-C-N 119.808 1.185 . . . . 0.0 110.373 -178.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 6.9 mp -99.47 -14.39 19.11 Favored 'General case' 0 N--CA 1.509 2.503 0 CA-C-O 118.653 -0.689 . . . . 0.0 112.023 179.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.85 -27.84 66.18 Favored 'General case' 1 N--CA 1.54 4.052 0 N-CA-C 103.35 -2.833 . . . . 0.0 103.35 168.75 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -56.87 -38.76 73.18 Favored 'General case' 0 N--CA 1.519 3.01 0 C-N-CA 123.889 0.876 . . . . 0.0 109.641 173.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 599' ' ' TRP . . . . . . . . . . . . . 44.0 t90 -63.75 -36.09 82.75 Favored 'General case' 0 N--CA 1.529 3.482 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 177.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.28 -37.08 54.51 Favored 'General case' 0 N--CA 1.535 3.803 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 177.073 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -69.9 -38.93 76.44 Favored 'General case' 0 N--CA 1.539 3.983 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 175.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.97 -23.8 48.42 Favored 'General case' 1 N--CA 1.546 4.367 0 C-N-CA 123.199 0.6 . . . . 0.0 110.598 175.295 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -120.57 0.85 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.321 0 CA-C-O 118.351 -0.833 . . . . 0.0 113.159 -176.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -112.87 -59.73 1.98 Allowed 'General case' 0 N--CA 1.509 2.522 0 N-CA-C 105.964 -1.865 . . . . 0.0 105.964 176.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.29 -40.52 94.47 Favored 'General case' 1 N--CA 1.542 4.138 0 C-N-CA 123.948 0.899 . . . . 0.0 110.552 178.7 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 23.1 tttp 76.75 101.81 0.07 Allowed 'General case' 0 N--CA 1.527 3.395 0 C-N-CA 125.015 1.326 . . . . 0.0 108.884 -179.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 75.0 m . . . . . 0 N--CA 1.525 3.296 0 C-N-CA 123.451 0.701 . . . . 0.0 109.854 -179.814 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.112 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.146 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.42 -9.796 3 O4'-C1'-N19 119.549 14.686 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' E' E ' 2' ' ' ' DG' . . . . . 0.421 " H4'" ' OP1' ' E' ' 3' ' ' ' DT' . . . . . . . . 6 C3'--C2' 1.415 -10.338 2 O4'-C1'-N19 120.093 15.366 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' E' E ' 3' ' ' ' DT' . . . . . 0.421 ' OP1' " H4'" ' E' ' 2' ' ' ' DG' . . . . . . . . 5 C3'--C2' 1.419 -9.92 4 O4'-C1'-N19 119.233 14.292 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.416 -10.169 4 O4'-C1'-N19 120.453 15.816 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' E' E ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.574 11.009 4 O4'-C1'-N19 119.855 15.069 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.399 -11.864 6 O4'-C1'-N19 119.427 14.534 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' E' E ' 7' ' ' ' DA' . . . . . 0.446 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 6 C3'--C2' 1.4 -11.801 4 C4'-C3'-C2' 113.12 9.92 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' E' E ' 8' ' ' ' DG' . . . . . 0.446 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 O3'--C3' 1.563 10.177 2 O4'-C1'-N19 119.82 15.026 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -10.989 5 O4'-C1'-N19 119.996 15.245 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.409 -10.88 5 O4'-C1'-N19 117.784 12.481 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.407 -11.063 6 O4'-C1'-N19 120.385 15.731 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.403 -11.489 2 O4'-C1'-N19 120.768 16.21 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' E' E ' 13' ' ' ' DC' . . . . . 0.48 H2'' " O5'" ' E' ' 14' ' ' ' DT' . . . . . . . . 6 O3'--C3' 1.556 9.643 4 O4'-C1'-N19 119.038 14.047 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' E' E ' 14' ' ' ' DT' . . . . . 0.48 " O5'" H2'' ' E' ' 13' ' ' ' DC' . . . . . . . . 6 C3'--C2' 1.404 -11.382 6 O4'-C1'-N19 118.983 13.979 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' E' E ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -10.009 5 O4'-C1'-N19 120.014 15.267 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.417 -10.062 5 O4'-C1'-N19 120.279 15.599 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.566 10.396 3 O4'-C1'-N19 119.65 14.812 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.413 -10.478 5 O4'-C1'-N19 120.503 15.879 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.418 5 O4'-C1'-N19 119.805 15.007 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.509 6.836 4 O4'-C1'-N19 119.659 14.824 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.565 10.317 2 C4'-C3'-C2' 116.735 13.535 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.769 5 O4'-C1'-N19 119.926 15.157 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.093 4 O4'-C1'-N19 120.302 15.628 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' F' F ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.415 -10.31 4 O4'-C1'-N19 120.944 16.43 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' F' F ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.578 11.3 4 O4'-C1'-N19 118.738 13.672 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.402 -11.601 6 O4'-C1'-N19 119.172 14.215 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C4'--C3' 1.42 -10.81 3 N19-C1'-C2' 131.227 10.642 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.412 -10.627 5 O4'-C1'-N19 119.716 14.896 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.43 5 O4'-C1'-N19 119.282 14.352 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.402 -11.623 4 O4'-C1'-N19 118.084 12.855 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.521 5 O4'-C1'-N19 119.879 15.098 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.402 -11.565 2 O4'-C1'-N19 120.355 15.694 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.553 9.409 4 O4'-C1'-N19 124.167 20.458 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' F' F ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.405 -11.332 6 O4'-C1'-N19 120.103 15.379 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' F' F ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.426 -9.182 3 O4'-C1'-N19 120.083 15.353 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' F' F ' 16' ' ' ' DG' . . . . . 0.467 ' O6 ' ' HB ' ' B' ' 579' ' ' ILE . . . . . . . . 5 C3'--C2' 1.417 -10.111 4 O4'-C1'-N19 119.973 15.216 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.607 3 O4'-C1'-N19 118.734 13.668 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.383 4 O4'-C1'-N19 119.644 14.804 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.565 10.273 3 O4'-C1'-N19 119.789 14.986 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.511 7.034 4 O4'-C1'-N19 119.817 15.021 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 . . . . . 0 N--CA 1.501 2.106 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.2 t -89.38 133.39 34.88 Favored Pre-proline 0 N--CA 1.524 3.255 0 CA-C-O 117.423 -1.275 . . . . 0.0 109.762 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_endo -68.58 -34.13 20.38 Favored 'Trans proline' 0 C--N 1.391 2.787 0 C-N-CA 122.561 2.174 . . . . 0.0 111.685 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -88.28 130.58 35.07 Favored 'General case' 0 N--CA 1.521 3.09 0 CA-C-N 118.24 0.473 . . . . 0.0 110.048 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 10.6 t -127.17 119.47 26.52 Favored 'General case' 0 N--CA 1.521 3.121 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 178.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 68.53 131.01 0.03 OUTLIER 'General case' 1 N--CA 1.542 4.135 0 C-N-CA 123.621 0.768 . . . . 0.0 109.117 -177.179 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.64 -54.64 38.94 Favored 'General case' 1 N--CA 1.543 4.189 0 C-N-CA 122.956 0.502 . . . . 0.0 111.937 -178.482 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 29.7 mtt -115.89 115.21 25.82 Favored 'General case' 0 N--CA 1.517 2.92 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -159.15 132.07 6.99 Favored 'General case' 0 N--CA 1.524 3.23 0 C-N-CA 122.632 0.373 . . . . 0.0 110.896 -179.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 64.46 124.17 0.02 OUTLIER 'General case' 0 N--CA 1.538 3.97 0 C-N-CA 124.673 1.189 . . . . 0.0 110.948 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -148.9 129.6 14.12 Favored 'General case' 0 N--CA 1.534 3.736 0 C-N-CA 122.878 0.471 . . . . 0.0 110.008 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 44.0 mtp180 -75.4 139.25 42.23 Favored 'General case' 0 N--CA 1.533 3.681 0 C-N-CA 122.534 0.334 . . . . 0.0 111.3 -178.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -71.69 149.46 45.46 Favored 'General case' 0 N--CA 1.534 3.765 0 C-N-CA 123.128 0.571 . . . . 0.0 111.961 -178.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 43.5 mt-30 -83.12 135.61 34.75 Favored 'General case' 0 N--CA 1.533 3.711 0 C-N-CA 122.792 0.437 . . . . 0.0 110.919 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -122.02 -68.53 0.89 Allowed 'General case' 0 N--CA 1.521 3.112 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 179.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.418 ' CE3' ' CD2' ' B' ' 551' ' ' LEU . 76.4 t-105 -51.37 -44.42 62.1 Favored 'General case' 1 N--CA 1.541 4.093 0 C-N-CA 123.471 0.708 . . . . 0.0 109.736 177.29 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -77.41 -25.61 50.93 Favored 'General case' 0 N--CA 1.524 3.271 0 CA-C-O 117.557 -1.211 . . . . 0.0 111.745 -177.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.0 tpm_? -55.64 -30.54 61.17 Favored 'General case' 1 N--CA 1.544 4.266 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 173.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.509 ' O ' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -84.89 -37.57 20.46 Favored 'General case' 0 N--CA 1.507 2.411 0 CA-C-O 116.125 -1.893 . . . . 0.0 109.482 173.496 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 22.0 t -70.67 -29.9 40.03 Favored 'Isoleucine or valine' 1 N--CA 1.574 5.769 0 CA-C-N 121.382 1.901 . . . . 0.0 113.475 -174.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -73.05 -50.64 21.83 Favored 'General case' 0 N--CA 1.533 3.719 0 CA-C-N 120.298 1.408 . . . . 0.0 108.3 -179.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.7 mp -72.8 -15.69 61.63 Favored 'General case' 0 N--CA 1.525 3.314 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 175.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.509 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -69.79 -37.0 76.16 Favored 'General case' 0 N--CA 1.517 2.896 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 175.294 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.429 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 35.4 tttt -63.42 -21.68 66.44 Favored 'General case' 0 N--CA 1.522 3.169 0 CA-C-O 118.437 -0.792 . . . . 0.0 111.247 176.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -70.6 -41.47 72.27 Favored 'General case' 0 N--CA 1.534 3.768 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 175.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.72 -6.19 57.6 Favored 'General case' 0 N--CA 1.507 2.398 0 CA-C-O 118.676 -0.678 . . . . 0.0 110.908 178.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.429 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -83.94 -36.06 23.54 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-N 120.218 1.372 . . . . 0.0 108.52 179.486 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -61.08 -39.06 88.46 Favored 'General case' 0 N--CA 1.532 3.658 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 177.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -97.32 -85.45 0.36 Allowed 'General case' 0 N--CA 1.516 2.872 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 177.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p30 149.78 51.97 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.044 0 C-N-CA 127.515 2.326 . . . . 0.0 107.982 178.312 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.3 mt -112.32 11.56 20.1 Favored 'General case' 0 N--CA 1.532 3.652 0 C-N-CA 123.74 0.816 . . . . 0.0 111.354 -178.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.412 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 52.8 p-80 -81.4 0.29 38.12 Favored 'General case' 0 N--CA 1.518 2.966 0 C-N-CA 123.381 0.672 . . . . 0.0 109.473 174.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.424 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 22.8 mt -91.3 -50.98 0.31 Allowed Pre-proline 0 N--CA 1.51 2.555 0 C-N-CA 125.266 1.426 . . . . 0.0 109.148 -176.333 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.424 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 9.1 Cg_exo -62.11 -39.9 45.97 Favored 'Trans proline' 0 C--N 1.386 2.523 0 N-CA-C 106.428 -2.182 . . . . 0.0 106.428 170.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.412 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.3 OUTLIER -56.59 -38.64 72.29 Favored 'General case' 0 N--CA 1.531 3.606 0 C-N-CA 123.928 0.891 . . . . 0.0 109.736 176.11 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.0 mt -60.08 -42.25 94.2 Favored 'General case' 1 N--CA 1.561 5.093 0 CA-C-N 119.478 1.035 . . . . 0.0 109.237 175.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -63.27 -25.62 68.4 Favored 'General case' 1 N--CA 1.544 4.244 0 CA-C-O 118.614 -0.707 . . . . 0.0 112.732 -179.646 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.8 mp -81.19 -41.14 22.79 Favored 'General case' 0 N--CA 1.534 3.771 0 CA-C-N 118.827 0.74 . . . . 0.0 109.112 -179.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 11.9 ptt? -97.82 44.29 1.05 Allowed 'General case' 0 N--CA 1.53 3.537 0 N-CA-C 104.05 -2.574 . . . . 0.0 104.05 173.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.9 tp -30.73 -103.64 0.0 OUTLIER 'General case' 0 N--CA 1.531 3.611 0 C-N-CA 127.338 2.255 . . . . 0.0 115.41 -173.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 54.0 p 52.5 126.94 0.0 OUTLIER Pre-proline 0 N--CA 1.535 3.795 0 CA-C-N 120.624 1.557 . . . . 0.0 111.69 -178.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -62.09 -32.06 83.46 Favored 'Trans proline' 0 C--N 1.382 2.316 0 C-N-CA 121.27 1.313 . . . . 0.0 110.335 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -48.85 -21.78 0.7 Allowed 'General case' 1 N--CA 1.551 4.585 0 C-N-CA 124.394 1.078 . . . . 0.0 113.71 178.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -62.45 -73.81 0.1 Allowed 'General case' 0 N--CA 1.538 3.936 0 CA-C-N 119.671 1.123 . . . . 0.0 110.522 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -89.64 6.18 42.45 Favored 'General case' 0 N--CA 1.535 3.806 0 CA-C-N 119.806 1.184 . . . . 0.0 111.837 177.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -86.67 -30.77 21.48 Favored 'General case' 0 N--CA 1.518 2.975 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 172.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.88 -48.71 6.85 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.454 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 13.1 tp -65.06 -28.77 69.7 Favored 'General case' 1 N--CA 1.54 4.071 0 CA-C-N 119.98 1.263 . . . . 0.0 107.853 175.304 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.401 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -68.46 -73.72 0.67 Allowed Glycine 0 N--CA 1.505 3.262 0 C-N-CA 124.474 1.035 . . . . 0.0 112.64 177.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.5 m -69.78 -29.0 66.21 Favored 'General case' 0 N--CA 1.537 3.915 0 CA-C-O 117.989 -1.005 . . . . 0.0 113.418 -175.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.6 mtt180 -73.39 -46.89 46.19 Favored 'General case' 0 N--CA 1.53 3.532 0 CA-C-N 120.179 1.354 . . . . 0.0 107.644 178.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.5 t -66.18 -16.96 21.57 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.9 0 O-C-N 120.648 -1.282 . . . . 0.0 109.41 174.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.32 -51.48 20.5 Favored 'General case' 0 N--CA 1.529 3.51 0 CA-C-N 120.022 1.283 . . . . 0.0 111.499 177.752 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -71.84 -23.57 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.51 0 CA-C-N 120.336 1.426 . . . . 0.0 112.123 -177.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -86.11 -51.51 13.15 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.088 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 -179.697 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -58.57 -25.0 62.07 Favored 'General case' 0 N--CA 1.538 3.931 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.505 178.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -94.45 -24.3 17.37 Favored 'General case' 0 N--CA 1.526 3.341 0 CA-C-O 118.303 -0.856 . . . . 0.0 110.859 177.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 20.7 tp -79.14 -70.2 0.52 Allowed 'General case' 0 N--CA 1.529 3.506 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.8 mt -42.84 -31.93 0.55 Allowed 'General case' 1 N--CA 1.544 4.232 0 C-N-CA 125.163 1.385 . . . . 0.0 113.683 -178.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.7 mmm180 -87.99 -43.33 11.82 Favored 'General case' 0 N--CA 1.526 3.345 0 CA-C-O 119.149 -0.453 . . . . 0.0 110.115 -179.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.37 87.12 0.59 Allowed Glycine 1 N--CA 1.517 4.097 0 N-CA-C 110.678 -0.969 . . . . 0.0 110.678 178.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -148.68 -54.53 0.19 Allowed 'General case' 0 N--CA 1.522 3.146 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 76.3 mtm -148.42 83.12 1.48 Allowed 'General case' 0 N--CA 1.516 2.83 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.8 t -146.95 14.9 1.18 Allowed 'General case' 0 N--CA 1.528 3.436 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -178.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 8.4 mp0 -116.29 -72.18 0.7 Allowed 'General case' 0 N--CA 1.526 3.341 0 CA-C-N 119.154 0.888 . . . . 0.0 111.097 179.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -110.86 -46.29 3.37 Favored 'General case' 0 N--CA 1.522 3.149 0 C-N-CA 123.278 0.631 . . . . 0.0 110.135 -178.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -68.17 -14.62 63.12 Favored 'General case' 0 N--CA 1.517 2.892 0 CA-C-O 117.866 -1.064 . . . . 0.0 113.441 -178.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 13.6 tp -76.89 -60.34 2.4 Favored 'General case' 0 N--CA 1.529 3.485 0 CA-C-N 120.117 1.326 . . . . 0.0 112.701 -177.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -39.03 -32.63 0.09 Allowed 'General case' 1 N--CA 1.552 4.67 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -177.783 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -72.78 -44.64 61.31 Favored 'General case' 0 N--CA 1.532 3.642 0 CA-C-N 118.361 0.528 . . . . 0.0 110.46 -178.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -41.34 -51.65 3.63 Favored 'General case' 1 N--CA 1.541 4.094 0 C-N-CA 125.548 1.539 . . . . 0.0 113.39 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.99 -77.2 0.59 Allowed 'General case' 0 N--CA 1.532 3.674 0 CA-C-O 118.739 -0.648 . . . . 0.0 109.374 -179.703 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 157.63 45.89 0.01 OUTLIER Glycine 1 N--CA 1.522 4.38 0 CA-C-O 119.177 -0.79 . . . . 0.0 111.522 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -113.3 113.48 25.34 Favored 'General case' 0 N--CA 1.514 2.755 0 N-CA-C 107.4 -1.334 . . . . 0.0 107.4 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -44.67 176.24 0.01 OUTLIER Glycine 1 N--CA 1.541 5.652 0 C-N-CA 124.966 1.27 . . . . 0.0 115.184 -177.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.4 mt -81.55 -18.81 11.36 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.913 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 177.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.43 -0.19 19.2 Favored 'General case' 0 N--CA 1.513 2.694 0 CA-C-O 117.86 -1.067 . . . . 0.0 111.084 174.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.74 -47.94 3.91 Favored 'General case' 0 N--CA 1.536 3.864 0 CA-C-N 120.758 1.617 . . . . 0.0 109.283 176.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -66.16 -41.01 88.56 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.912 0 CA-C-O 118.938 -0.553 . . . . 0.0 111.373 -178.192 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 50.3 p -82.64 -26.28 32.33 Favored 'General case' 0 N--CA 1.519 2.991 0 CA-C-O 118.743 -0.646 . . . . 0.0 109.991 178.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.6 ttp180 -65.15 -35.16 80.22 Favored 'General case' 1 N--CA 1.544 4.264 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 175.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -56.56 -36.61 71.66 Favored Glycine 1 N--CA 1.529 4.849 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 176.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 14.7 m -62.25 -41.43 98.43 Favored 'General case' 1 N--CA 1.542 4.158 0 CA-C-N 117.552 0.676 . . . . 0.0 110.181 177.526 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -61.67 -32.72 72.92 Favored 'General case' 1 N--CA 1.541 4.084 0 C-N-CA 123.893 0.877 . . . . 0.0 112.219 -179.677 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 2.5 m -68.32 -39.43 81.96 Favored 'General case' 1 N--CA 1.54 4.026 0 CA-C-N 118.311 0.505 . . . . 0.0 111.07 -178.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.4 mt -59.35 -40.46 86.47 Favored 'General case' 0 N--CA 1.528 3.471 0 C-N-CA 123.764 0.826 . . . . 0.0 111.588 -179.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -56.82 -28.69 61.87 Favored 'General case' 1 N--CA 1.543 4.219 0 CA-C-O 118.771 -0.633 . . . . 0.0 112.064 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.96 -38.0 21.55 Favored 'General case' 0 N--CA 1.516 2.874 0 CA-C-N 118.323 0.51 . . . . 0.0 111.216 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.11 161.86 0.68 Allowed Pre-proline 1 N--CA 1.548 4.434 0 CA-C-O 118.206 -0.902 . . . . 0.0 112.897 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -81.64 170.73 14.03 Favored 'Trans proline' 0 C--N 1.379 2.155 0 C-N-CA 121.687 1.591 . . . . 0.0 110.72 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.8 t -95.34 -29.08 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.029 0 CA-C-O 117.92 -1.038 . . . . 0.0 111.076 -179.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -62.3 -42.61 99.5 Favored 'General case' 0 N--CA 1.513 2.685 0 CA-C-N 119.764 1.166 . . . . 0.0 109.962 -179.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.2 mp -98.84 -14.04 19.82 Favored 'General case' 0 N--CA 1.508 2.47 0 CA-C-O 118.302 -0.856 . . . . 0.0 112.221 179.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.42 -30.57 70.35 Favored 'General case' 1 N--CA 1.549 4.522 0 N-CA-C 102.728 -3.064 . . . . 0.0 102.728 168.254 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -57.04 -39.59 75.14 Favored 'General case' 0 N--CA 1.517 2.914 0 C-N-CA 123.871 0.868 . . . . 0.0 110.201 174.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.404 ' HA ' ' HB2' ' A' ' 102' ' ' GLU . 47.8 t90 -65.1 -33.96 77.27 Favored 'General case' 0 N--CA 1.527 3.407 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 177.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.23 -36.68 61.3 Favored 'General case' 0 N--CA 1.538 3.928 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 176.429 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -69.51 -38.7 77.69 Favored 'General case' 1 N--CA 1.54 4.052 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 175.213 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.404 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 1.2 mm-40 -59.17 -23.99 62.69 Favored 'General case' 1 N--CA 1.546 4.341 0 C-N-CA 123.4 0.68 . . . . 0.0 110.63 175.865 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.37 -2.9 10.66 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.348 0 CA-C-O 118.11 -0.947 . . . . 0.0 112.399 -176.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 54.5 mt -102.99 -62.24 1.3 Allowed 'General case' 0 N--CA 1.527 3.378 0 N-CA-C 105.088 -2.19 . . . . 0.0 105.088 174.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.6 tp -54.83 -33.3 61.53 Favored 'General case' 0 N--CA 1.53 3.538 0 C-N-CA 125.077 1.351 . . . . 0.0 111.384 177.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.8 mttp 70.01 5.04 5.09 Favored 'General case' 1 N--CA 1.539 4.008 0 C-N-CA 124.987 1.315 . . . . 0.0 113.364 -179.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.525 3.295 0 CA-C-N 119.791 1.178 . . . . 0.0 110.07 178.837 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 . . . . . 0 N--CA 1.508 2.445 0 CA-C-O 119.653 -0.213 . . . . 0.0 110.851 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 37.4 p -84.39 123.66 74.6 Favored Pre-proline 0 N--CA 1.527 3.392 0 CA-C-O 117.248 -1.358 . . . . 0.0 109.499 179.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -73.95 -1.93 11.55 Favored 'Trans proline' 0 CA--C 1.579 2.734 0 C-N-CA 122.452 2.101 . . . . 0.0 113.445 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 67.67 117.67 0.03 OUTLIER 'General case' 0 N--CA 1.537 3.897 0 CA-C-N 120.016 1.28 . . . . 0.0 108.933 -177.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 7.1 t -117.28 -43.38 2.84 Favored 'General case' 0 N--CA 1.53 3.546 0 CA-C-O 118.969 -0.539 . . . . 0.0 111.238 -178.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -93.62 126.63 38.89 Favored 'General case' 0 N--CA 1.523 3.219 0 CA-C-N 118.294 0.497 . . . . 0.0 110.158 -179.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . 64.56 139.73 0.02 OUTLIER 'General case' 0 N--CA 1.537 3.91 0 C-N-CA 124.519 1.128 . . . . 0.0 111.77 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 17.5 ptt? -103.38 -40.44 6.38 Favored 'General case' 0 N--CA 1.527 3.422 0 CA-C-O 119.074 -0.488 . . . . 0.0 110.17 179.299 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -156.45 139.3 15.25 Favored 'General case' 0 N--CA 1.523 3.213 0 CA-C-N 118.063 0.392 . . . . 0.0 111.618 -179.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -106.5 126.69 52.57 Favored 'General case' 0 N--CA 1.523 3.206 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -99.69 -54.23 2.98 Favored 'General case' 0 N--CA 1.528 3.444 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -178.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? 63.06 123.57 0.01 OUTLIER 'General case' 0 N--CA 1.536 3.864 0 C-N-CA 124.308 1.043 . . . . 0.0 112.3 178.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 3.4 t-80 62.16 136.56 0.01 OUTLIER 'General case' 0 N--CA 1.535 3.816 0 C-N-CA 124.85 1.26 . . . . 0.0 112.848 177.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -112.26 124.92 53.51 Favored 'General case' 0 N--CA 1.522 3.165 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 177.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -95.87 -71.03 0.69 Allowed 'General case' 0 N--CA 1.522 3.137 0 CA-C-O 118.66 -0.686 . . . . 0.0 110.924 -178.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 519' ' ' TRP . . . . . 0.479 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 70.8 t-105 -43.7 -28.68 0.43 Allowed 'General case' 1 N--CA 1.55 4.559 0 N-CA-C 113.658 0.985 . . . . 0.0 113.658 -178.542 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 520' ' ' LEU . . . . . 0.413 ' CD2' ' N ' ' B' ' 520' ' ' LEU . 2.1 mm? -97.76 -28.34 13.92 Favored 'General case' 0 N--CA 1.529 3.485 0 CA-C-O 117.637 -1.173 . . . . 0.0 113.715 -172.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -63.05 -24.84 68.1 Favored 'General case' 1 N--CA 1.54 4.039 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 171.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . 0.479 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.5 m-85 -76.73 -41.54 44.7 Favored 'General case' 0 N--CA 1.513 2.724 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 173.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 43.4 t -67.12 -22.51 29.38 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.25 0 CA-C-O 117.645 -1.169 . . . . 0.0 112.631 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -78.03 -51.45 10.31 Favored 'General case' 0 N--CA 1.528 3.44 0 CA-C-N 120.202 1.364 . . . . 0.0 109.153 -177.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 5.0 mp -75.71 -18.84 59.46 Favored 'General case' 0 N--CA 1.524 3.249 0 O-C-N 123.395 0.434 . . . . 0.0 109.979 176.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.89 -32.84 67.83 Favored 'General case' 0 N--CA 1.524 3.228 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 173.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -65.02 -26.35 68.23 Favored 'General case' 0 N--CA 1.518 2.966 0 CA-C-O 118.398 -0.81 . . . . 0.0 110.386 176.173 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -66.6 -41.93 87.67 Favored 'General case' 1 N--CA 1.54 4.071 0 CA-C-N 119.088 0.858 . . . . 0.0 108.861 176.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 529' ' ' ALA . . . . . . . . . . . . . . . -88.11 -10.47 49.96 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 118.035 -0.983 . . . . 0.0 111.548 178.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -81.31 -34.3 31.99 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-N 120.925 1.693 . . . . 0.0 108.864 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -60.31 -43.02 96.71 Favored 'General case' 0 N--CA 1.538 3.972 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 177.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 61.5 m-80 -92.96 -85.81 0.26 Allowed 'General case' 0 N--CA 1.516 2.864 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 177.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.9 p30 150.14 48.98 0.0 OUTLIER 'General case' 1 N--CA 1.559 5.017 0 C-N-CA 127.89 2.476 . . . . 0.0 108.245 177.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 534' ' ' LEU . . . . . . . . . . . . . 6.0 mt -105.45 7.7 33.21 Favored 'General case' 0 N--CA 1.53 3.564 0 C-N-CA 124.3 1.04 . . . . 0.0 111.012 -179.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 535' ' ' HIS . . . . . . . . . . . . . 46.6 p-80 -82.52 0.47 42.39 Favored 'General case' 0 N--CA 1.508 2.469 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 175.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 536' ' ' LEU . . . . . . . . . . . . . 42.5 mt -92.93 -49.16 0.29 Allowed Pre-proline 0 N--CA 1.508 2.458 0 CA-C-O 116.391 -1.766 . . . . 0.0 109.282 -176.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 537' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -67.11 -37.01 19.9 Favored 'Trans proline' 0 C--N 1.394 2.921 0 N-CA-C 107.179 -1.893 . . . . 0.0 107.179 171.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.85 -43.69 98.0 Favored 'General case' 0 N--CA 1.529 3.507 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 176.455 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 11.6 mt -66.36 -31.04 71.57 Favored 'General case' 0 N--CA 1.537 3.893 0 CA-C-O 118.865 -0.588 . . . . 0.0 110.781 179.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -54.63 -23.48 17.28 Favored 'General case' 1 N--CA 1.542 4.158 0 CA-C-N 118.952 0.796 . . . . 0.0 111.996 178.701 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -102.18 -41.34 6.43 Favored 'General case' 0 N--CA 1.519 2.98 0 C-N-CA 123.734 0.814 . . . . 0.0 109.297 -179.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 4.3 ptt? -101.46 25.11 8.74 Favored 'General case' 1 N--CA 1.541 4.108 0 CA-C-N 119.061 0.846 . . . . 0.0 112.789 -178.427 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 18.7 tp -131.64 -96.43 0.34 Allowed 'General case' 0 N--CA 1.536 3.84 0 CA-C-O 117.559 -1.21 . . . . 0.0 112.67 178.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 18.1 p 129.14 140.23 0.0 OUTLIER Pre-proline 1 N--CA 1.558 4.952 0 C-N-CA 128.727 2.811 . . . . 0.0 106.94 -177.145 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -57.49 -32.56 94.5 Favored 'Trans proline' 0 N--CA 1.521 3.098 0 C-N-CA 122.84 2.36 . . . . 0.0 113.368 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -63.17 -34.76 78.32 Favored 'General case' 1 N--CA 1.539 4.024 0 CA-C-O 118.886 -0.578 . . . . 0.0 111.02 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -68.67 -40.97 79.91 Favored 'General case' 0 N--CA 1.53 3.534 0 CA-C-O 118.469 -0.777 . . . . 0.0 110.759 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 19.8 ptt180 -76.21 -20.5 57.41 Favored 'General case' 0 N--CA 1.529 3.519 0 CA-C-O 118.045 -0.979 . . . . 0.0 111.592 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -69.17 -44.26 72.57 Favored 'General case' 0 N--CA 1.536 3.842 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 174.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -80.18 -11.12 59.77 Favored 'General case' 0 N--CA 1.512 2.66 0 CA-C-O 117.736 -1.126 . . . . 0.0 111.538 177.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 551' ' ' LEU . . . . . 0.44 HD22 ' CG ' ' A' ' 22' ' ' PHE . 10.2 tp -77.23 -44.04 31.41 Favored 'General case' 0 N--CA 1.528 3.43 0 CA-C-N 120.779 1.627 . . . . 0.0 107.827 176.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -69.78 -49.23 37.22 Favored Glycine 0 N--CA 1.506 3.309 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.6 m -65.21 -33.81 76.88 Favored 'General case' 0 N--CA 1.532 3.667 0 CA-C-O 118.535 -0.745 . . . . 0.0 112.037 -178.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 22.6 mtt180 -65.31 -52.34 54.71 Favored 'General case' 1 N--CA 1.541 4.082 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 176.294 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 17.5 t -64.86 -16.81 20.51 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.806 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.559 177.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 11.4 mmt180 -79.11 -43.49 23.98 Favored 'General case' 0 N--CA 1.52 3.03 0 CA-C-N 119.884 1.22 . . . . 0.0 110.5 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 557' ' ' ILE . . . . . 0.474 HD12 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -75.94 -25.68 17.23 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.93 0 CA-C-N 120.124 1.329 . . . . 0.0 111.421 -178.89 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 558' ' ' VAL . . . . . 0.474 ' N ' HD12 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -86.43 -51.42 13.16 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.902 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 -178.708 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -61.08 -28.28 68.97 Favored 'General case' 0 N--CA 1.527 3.381 0 CA-C-O 118.6 -0.714 . . . . 0.0 110.326 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -89.49 -22.64 22.36 Favored 'General case' 0 N--CA 1.522 3.156 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.326 177.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.14 -46.62 70.31 Favored 'General case' 1 N--CA 1.543 4.185 0 CA-C-N 119.749 1.159 . . . . 0.0 108.379 177.503 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 15.2 mt -50.25 -28.61 7.97 Favored 'General case' 0 N--CA 1.537 3.911 0 C-N-CA 124.048 0.939 . . . . 0.0 111.978 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 24.8 mmm180 -82.61 -52.73 6.54 Favored 'General case' 0 N--CA 1.526 3.369 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 66.02 83.71 0.1 OUTLIER Glycine 1 N--CA 1.524 4.559 0 CA-C-O 119.308 -0.718 . . . . 0.0 112.949 177.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -161.8 -52.26 0.04 OUTLIER 'General case' 0 N--CA 1.528 3.46 0 CA-C-N 117.581 0.69 . . . . 0.0 109.729 178.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 86.9 mtp -145.02 54.53 1.22 Allowed 'General case' 0 N--CA 1.525 3.299 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 75.7 p -130.75 -4.88 4.09 Favored 'General case' 0 N--CA 1.522 3.16 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -176.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -107.29 -57.81 2.03 Favored 'General case' 0 N--CA 1.527 3.387 0 CA-C-N 119.938 1.244 . . . . 0.0 111.238 -178.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 3.5 ttm180 -99.53 -51.4 3.78 Favored 'General case' 0 N--CA 1.529 3.512 0 C-N-CA 123.234 0.613 . . . . 0.0 110.617 -177.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -73.73 3.77 6.03 Favored 'General case' 0 N--CA 1.515 2.797 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -176.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 571' ' ' LEU . . . . . . . . . . . . . 45.8 tp -91.12 -56.01 3.32 Favored 'General case' 0 N--CA 1.526 3.349 0 CA-C-N 120.219 1.372 . . . . 0.0 113.299 -178.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -30.12 -34.19 0.01 OUTLIER 'General case' 1 N--CA 1.551 4.615 0 N-CA-C 117.662 2.468 . . . . 0.0 117.662 -174.67 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -55.23 -20.36 10.63 Favored 'General case' 1 N--CA 1.545 4.276 0 CA-C-N 119.155 0.889 . . . . 0.0 112.779 -179.331 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -101.95 -83.1 0.47 Allowed 'General case' 0 N--CA 1.509 2.485 0 C-N-CA 124.287 1.035 . . . . 0.0 109.143 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 55.4 mt -139.17 17.85 2.6 Favored 'General case' 0 N--CA 1.53 3.529 0 CA-C-N 119.14 0.882 . . . . 0.0 111.51 -179.086 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . -47.68 -28.75 5.39 Favored Glycine 1 N--CA 1.548 6.138 0 O-C-N 120.866 -1.146 . . . . 0.0 113.851 -179.164 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . 67.5 39.99 2.72 Favored 'General case' 1 N--CA 1.545 4.288 0 CA-C-N 118.539 1.17 . . . . 0.0 112.071 178.523 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 86.21 167.4 43.51 Favored Glycine 1 N--CA 1.519 4.195 0 CA-C-O 119.449 -0.639 . . . . 0.0 112.317 178.182 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 579' ' ' ILE . . . . . 0.467 ' HB ' ' O6 ' ' F' ' 16' ' ' ' DG' . 36.2 mm -84.63 -17.79 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.709 0 CA-C-N 118.621 1.21 . . . . 0.0 108.466 176.194 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -63.82 -39.39 94.12 Favored 'General case' 0 N--CA 1.523 3.218 0 CA-C-N 120.17 1.35 . . . . 0.0 110.097 177.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 15.2 p -77.44 -40.69 42.48 Favored 'General case' 1 N--CA 1.542 4.134 0 CA-C-N 119.208 0.913 . . . . 0.0 111.64 178.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 582' ' ' ILE . . . . . . . . . . . . . 1.1 tt -63.31 -36.8 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.258 0 C-N-CA 123.563 0.745 . . . . 0.0 112.682 -175.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 41.3 p -99.24 -30.15 12.42 Favored 'General case' 0 N--CA 1.513 2.722 0 CA-C-O 118.053 -0.975 . . . . 0.0 111.428 -178.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 21.3 ptt180 -71.91 -22.66 61.45 Favored 'General case' 0 N--CA 1.533 3.676 0 CA-C-N 119.891 1.223 . . . . 0.0 109.411 175.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -77.99 -28.06 57.17 Favored Glycine 0 N--CA 1.511 3.662 0 N-CA-C 109.428 -1.469 . . . . 0.0 109.428 176.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 10.9 m -63.16 -40.35 97.31 Favored 'General case' 0 N--CA 1.537 3.9 0 CA-C-N 118.239 1.019 . . . . 0.0 111.074 179.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -61.24 -24.93 66.72 Favored 'General case' 1 N--CA 1.54 4.03 0 CA-C-O 118.783 -0.627 . . . . 0.0 112.318 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 7.8 m -64.12 -41.88 97.07 Favored 'General case' 1 N--CA 1.541 4.093 0 CA-C-N 118.726 0.694 . . . . 0.0 110.663 179.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 42.1 mt -54.7 -43.3 72.41 Favored 'General case' 0 N--CA 1.531 3.588 0 C-N-CA 124.406 1.082 . . . . 0.0 111.944 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.86 -31.98 73.12 Favored 'General case' 1 N--CA 1.541 4.117 0 C-N-CA 123.339 0.656 . . . . 0.0 112.382 -178.83 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -74.35 -35.1 63.55 Favored 'General case' 0 N--CA 1.525 3.281 0 CA-C-N 118.352 0.524 . . . . 0.0 111.983 -179.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -45.07 163.61 0.2 Allowed Pre-proline 1 N--CA 1.548 4.452 0 N-CA-C 115.207 1.558 . . . . 0.0 115.207 -178.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -86.81 173.82 5.89 Favored 'Trans proline' 0 C--N 1.38 2.229 0 C-N-CA 122.125 1.884 . . . . 0.0 107.407 174.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.9 t -98.92 -27.62 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.311 0 CA-C-N 120.188 1.358 . . . . 0.0 111.662 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -62.55 -43.4 98.91 Favored 'General case' 0 N--CA 1.517 2.905 0 CA-C-N 120.079 1.309 . . . . 0.0 110.792 -178.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 596' ' ' LEU . . . . . . . . . . . . . 7.2 mp -99.97 -14.35 18.72 Favored 'General case' 0 N--CA 1.511 2.61 0 CA-C-O 118.723 -0.656 . . . . 0.0 112.26 179.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.07 -30.17 69.3 Favored 'General case' 0 N--CA 1.538 3.927 0 N-CA-C 103.245 -2.872 . . . . 0.0 103.245 168.412 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -54.73 -37.97 66.55 Favored 'General case' 0 N--CA 1.521 3.115 0 C-N-CA 123.868 0.867 . . . . 0.0 110.094 173.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 599' ' ' TRP . . . . . . . . . . . . . 43.3 t90 -63.06 -38.41 91.07 Favored 'General case' 0 N--CA 1.536 3.828 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.85 -36.86 59.49 Favored 'General case' 0 N--CA 1.535 3.796 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 177.24 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -70.12 -36.24 74.67 Favored 'General case' 1 N--CA 1.541 4.117 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 175.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -62.27 -23.82 66.92 Favored 'General case' 1 N--CA 1.543 4.199 0 C-N-CA 123.619 0.768 . . . . 0.0 110.402 176.229 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 603' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -115.73 9.79 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.497 0 C-N-CA 123.163 0.585 . . . . 0.0 111.832 -177.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 26.7 mt -110.03 -63.1 1.42 Allowed 'General case' 0 N--CA 1.519 2.977 0 N-CA-C 105.281 -2.118 . . . . 0.0 105.281 175.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.57 -45.22 60.25 Favored 'General case' 0 N--CA 1.525 3.285 0 C-N-CA 124.484 1.114 . . . . 0.0 109.932 179.395 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 57.9 mttp 69.04 97.02 0.06 Allowed 'General case' 0 N--CA 1.527 3.394 0 C-N-CA 124.786 1.234 . . . . 0.0 108.766 -178.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 52.9 p . . . . . 0 N--CA 1.524 3.261 0 CA-C-O 118.184 -0.912 . . . . 0.0 110.347 -178.671 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.209 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.049 0 CA-C-O 118.099 -0.953 . . . . 0.0 108.441 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.47 ' O ' HD21 ' B' ' 551' ' ' LEU . 44.2 mt-10 . . . . . 0 N--CA 1.531 3.594 0 N-CA-C 106.908 -1.516 . . . . 0.0 106.908 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.711 ' N ' HD11 ' B' ' 551' ' ' LEU . 68.5 t-105 -57.23 -21.09 31.44 Favored 'General case' 0 N--CA 1.534 3.771 0 CA-C-O 118.073 -0.965 . . . . 0.0 111.76 175.479 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.563 ' N ' HD22 ' A' ' 20' ' ' LEU . 2.3 mm? -91.29 -30.6 16.5 Favored 'General case' 0 N--CA 1.529 3.476 0 CA-C-O 118.182 -0.913 . . . . 0.0 111.861 -177.07 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.9 mtt180 -64.12 -26.82 68.71 Favored 'General case' 0 N--CA 1.535 3.796 0 N-CA-C 106.122 -1.807 . . . . 0.0 106.122 172.48 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.465 ' O ' HD23 ' A' ' 26' ' ' LEU . 9.4 t80 -83.21 -32.74 26.36 Favored 'General case' 0 N--CA 1.506 2.361 0 CA-C-O 116.739 -1.6 . . . . 0.0 108.564 174.704 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.687 HG23 ' O ' ' A' ' 19' ' ' TRP . 61.3 t -76.25 -25.25 16.55 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.227 0 CA-C-N 121.682 2.037 . . . . 0.0 112.885 -177.933 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -77.97 -43.79 28.64 Favored 'General case' 0 N--CA 1.532 3.648 0 CA-C-N 120.454 1.479 . . . . 0.0 108.83 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.4 mp -71.43 -27.2 63.12 Favored 'General case' 0 N--CA 1.53 3.557 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 176.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.465 HD23 ' O ' ' A' ' 22' ' ' PHE . 1.2 mm? -67.57 -35.82 79.76 Favored 'General case' 0 N--CA 1.53 3.55 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 176.672 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.9 ttmt -68.66 -25.68 64.94 Favored 'General case' 0 N--CA 1.515 2.781 0 CA-C-O 118.074 -0.965 . . . . 0.0 110.931 177.432 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -70.39 -38.51 74.71 Favored 'General case' 0 N--CA 1.533 3.676 0 CA-C-N 119.435 1.016 . . . . 0.0 109.434 178.01 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.555 ' HB1' ' N ' ' A' ' 35' ' ' HIS . . . -89.59 -8.85 51.71 Favored 'General case' 0 N--CA 1.499 2.02 0 CA-C-O 118.371 -0.823 . . . . 0.0 110.762 178.441 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -79.01 -33.82 44.55 Favored 'General case' 0 N--CA 1.53 3.526 0 CA-C-N 120.136 1.335 . . . . 0.0 108.994 179.016 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -65.61 -43.74 88.69 Favored 'General case' 0 N--CA 1.535 3.818 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 66.9 m-80 -88.28 -88.7 0.14 Allowed 'General case' 0 N--CA 1.513 2.704 0 N-CA-C 106.341 -1.726 . . . . 0.0 106.341 176.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.8 p30 152.9 48.46 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.039 0 C-N-CA 127.318 2.247 . . . . 0.0 108.418 177.276 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.439 HD22 ' CD2' ' B' ' 596' ' ' LEU . 6.6 mt -109.99 14.06 23.15 Favored 'General case' 0 N--CA 1.528 3.435 0 C-N-CA 124.493 1.117 . . . . 0.0 110.456 -178.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.555 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 30.2 p-80 -81.43 3.65 23.81 Favored 'General case' 0 N--CA 1.518 2.939 0 C-N-CA 123.381 0.672 . . . . 0.0 109.352 175.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.766 ' HA ' HD23 ' A' ' 39' ' ' LEU . 22.9 mt -94.03 -51.46 0.26 Allowed Pre-proline 0 N--CA 1.507 2.382 0 CA-C-O 116.857 -1.544 . . . . 0.0 108.565 -175.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.457 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 8.2 Cg_exo -61.63 -32.61 87.36 Favored 'Trans proline' 0 C--N 1.397 3.101 0 N-CA-C 106.257 -2.247 . . . . 0.0 106.257 169.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.7 tt -60.25 -46.34 90.14 Favored 'General case' 0 N--CA 1.529 3.518 0 C-N-CA 124.598 1.159 . . . . 0.0 109.05 174.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.766 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.0 OUTLIER -74.35 -12.26 60.48 Favored 'General case' 0 N--CA 1.533 3.7 0 CA-C-O 118.526 -0.749 . . . . 0.0 111.199 179.664 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -87.84 -19.18 27.79 Favored 'General case' 0 N--CA 1.514 2.75 0 CA-C-O 117.282 -1.342 . . . . 0.0 111.273 178.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -113.93 -23.7 9.46 Favored 'General case' 0 N--CA 1.534 3.729 0 CA-C-N 120.591 1.541 . . . . 0.0 114.038 -178.301 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 23.6 ptp -129.23 27.76 5.32 Favored 'General case' 1 N--CA 1.546 4.33 0 CA-C-N 120.6 1.545 . . . . 0.0 111.46 178.853 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.461 HD22 ' HB2' ' A' ' 39' ' ' LEU . 0.7 OUTLIER -135.16 -68.25 0.53 Allowed 'General case' 0 N--CA 1.515 2.795 0 CA-C-O 117.922 -1.037 . . . . 0.0 109.233 177.923 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 25.5 p 121.47 160.59 0.0 OUTLIER Pre-proline 1 N--CA 1.571 5.624 0 C-N-CA 128.003 2.521 . . . . 0.0 109.8 -179.232 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -68.14 -28.62 34.21 Favored 'Trans proline' 0 C--N 1.394 2.942 0 C-N-CA 122.3 2.0 . . . . 0.0 109.297 175.299 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -66.95 -19.05 65.65 Favored 'General case' 0 N--CA 1.532 3.636 0 CA-C-O 118.407 -0.806 . . . . 0.0 110.462 176.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.448 ' HB3' HD23 ' A' ' 43' ' ' LEU . 7.7 mm-40 -75.7 -29.67 59.05 Favored 'General case' 0 N--CA 1.525 3.281 0 CA-C-O 117.853 -1.07 . . . . 0.0 109.656 178.364 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 12.7 ptt180 -91.35 -14.32 30.93 Favored 'General case' 0 N--CA 1.535 3.806 0 CA-C-N 119.39 0.996 . . . . 0.0 108.535 173.33 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -79.8 -22.81 42.64 Favored 'General case' 0 N--CA 1.518 2.953 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 173.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -93.96 -36.04 12.36 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 123.854 0.862 . . . . 0.0 109.156 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.495 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 18.1 tp -75.05 -25.5 58.71 Favored 'General case' 0 N--CA 1.533 3.699 0 N-CA-C 106.684 -1.598 . . . . 0.0 106.684 174.181 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.452 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -69.8 -70.91 1.08 Allowed Glycine 0 N--CA 1.503 3.164 0 C-N-CA 125.39 1.471 . . . . 0.0 111.492 177.615 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.5 m -71.83 -27.13 62.7 Favored 'General case' 0 N--CA 1.532 3.635 0 CA-C-O 118.008 -0.996 . . . . 0.0 113.009 -176.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 39.6 mtt180 -74.31 -45.46 47.27 Favored 'General case' 0 N--CA 1.524 3.251 0 CA-C-N 120.12 1.327 . . . . 0.0 108.195 178.118 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 30.9 t -64.89 -18.12 23.03 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.002 0 O-C-N 120.636 -1.29 . . . . 0.0 109.164 174.457 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.31 -50.73 20.55 Favored 'General case' 0 N--CA 1.531 3.602 0 CA-C-N 119.734 1.152 . . . . 0.0 111.571 177.544 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.462 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -70.75 -22.57 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.823 0 CA-C-N 120.779 1.627 . . . . 0.0 111.826 -178.55 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -87.54 -51.49 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.986 0 CA-C-N 120.257 1.389 . . . . 0.0 107.688 -179.014 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -61.13 -22.03 64.3 Favored 'General case' 0 N--CA 1.531 3.594 0 CA-C-O 118.782 -0.627 . . . . 0.0 110.576 177.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -95.27 -24.05 16.95 Favored 'General case' 0 N--CA 1.52 3.046 0 CA-C-O 118.089 -0.958 . . . . 0.0 110.8 178.008 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.3 tp -77.01 -57.29 3.93 Favored 'General case' 0 N--CA 1.535 3.787 0 CA-C-N 119.662 1.119 . . . . 0.0 108.484 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 42.5 mt -45.97 -29.82 1.58 Allowed 'General case' 1 N--CA 1.544 4.262 0 C-N-CA 124.775 1.23 . . . . 0.0 112.858 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.89 -53.23 5.23 Favored 'General case' 0 N--CA 1.519 3.02 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.812 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.11 80.29 0.82 Allowed Glycine 0 N--CA 1.512 3.704 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 179.134 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -138.41 -59.4 0.63 Allowed 'General case' 0 N--CA 1.526 3.327 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 87.7 mtp -149.51 76.13 1.3 Allowed 'General case' 0 N--CA 1.525 3.304 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.491 ' HA ' HD22 ' A' ' 71' ' ' LEU . 5.6 t -142.02 3.64 1.61 Allowed 'General case' 0 N--CA 1.524 3.271 0 N-CA-C 114.245 1.202 . . . . 0.0 114.245 -176.141 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -116.21 -55.29 2.41 Favored 'General case' 0 N--CA 1.526 3.333 0 CA-C-N 120.018 1.281 . . . . 0.0 112.124 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -110.63 -57.23 2.25 Favored 'General case' 0 N--CA 1.527 3.424 0 C-N-CA 123.198 0.599 . . . . 0.0 111.233 -176.188 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -74.11 -4.85 38.16 Favored 'General case' 0 N--CA 1.518 2.968 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.638 HD23 HG21 ' A' ' 82' ' ' ILE . 60.8 tp -76.71 -48.32 19.19 Favored 'General case' 0 N--CA 1.525 3.293 0 CA-C-N 119.91 1.232 . . . . 0.0 111.446 -178.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -35.65 -40.48 0.17 Allowed 'General case' 1 N--CA 1.541 4.102 0 N-CA-C 115.514 1.672 . . . . 0.0 115.514 -175.903 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -78.03 -40.31 39.24 Favored 'General case' 0 N--CA 1.529 3.524 0 CA-C-N 118.126 0.421 . . . . 0.0 110.811 -178.336 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -51.97 -35.19 45.44 Favored 'General case' 0 N--CA 1.531 3.576 0 C-N-CA 124.174 0.99 . . . . 0.0 113.149 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.3 pp -132.98 -44.94 0.86 Allowed 'General case' 0 N--CA 1.533 3.712 0 CA-C-N 118.76 0.709 . . . . 0.0 111.588 -179.192 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 104.93 73.96 0.93 Allowed Glycine 1 N--CA 1.528 4.803 0 CA-C-N 118.975 0.807 . . . . 0.0 112.099 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.08 -12.01 6.41 Favored 'General case' 0 N--CA 1.531 3.621 0 CA-C-N 117.886 0.843 . . . . 0.0 112.831 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 86.59 167.12 43.29 Favored Glycine 1 N--CA 1.532 5.09 0 CA-C-N 119.634 1.106 . . . . 0.0 111.128 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -87.05 -20.81 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.337 0 CA-C-N 119.483 1.641 . . . . 0.0 109.107 179.069 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.05 -30.87 71.06 Favored 'General case' 0 N--CA 1.525 3.317 0 CA-C-N 120.145 1.338 . . . . 0.0 111.995 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.5 p -83.53 -43.17 16.03 Favored 'General case' 1 N--CA 1.55 4.534 0 CA-C-N 120.249 1.386 . . . . 0.0 111.16 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.638 HG21 HD23 ' A' ' 71' ' ' LEU . 14.9 pt -70.8 -18.56 20.99 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.031 0 CA-C-O 117.958 -1.02 . . . . 0.0 112.98 -177.655 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 59.1 p -109.68 -31.91 7.29 Favored 'General case' 0 N--CA 1.516 2.871 0 CA-C-N 119.656 1.116 . . . . 0.0 110.688 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.2 ptt180 -73.22 -25.55 60.79 Favored 'General case' 0 N--CA 1.535 3.821 0 CA-C-N 119.475 1.034 . . . . 0.0 108.435 175.12 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -62.79 -31.35 79.97 Favored Glycine 1 N--CA 1.522 4.413 0 N-CA-C 108.991 -1.644 . . . . 0.0 108.991 175.155 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 18.3 m -63.1 -41.54 99.4 Favored 'General case' 0 N--CA 1.538 3.943 0 CA-C-N 118.004 0.902 . . . . 0.0 109.335 176.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -55.25 -28.01 50.41 Favored 'General case' 1 N--CA 1.547 4.423 0 C-N-CA 123.941 0.896 . . . . 0.0 111.942 178.797 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.434 ' HB3' ' HA ' ' B' ' 541' ' ' LEU . 39.4 m -65.81 -40.42 91.86 Favored 'General case' 0 N--CA 1.534 3.739 0 C-N-CA 123.193 0.597 . . . . 0.0 111.049 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.7 mt -58.92 -41.48 87.39 Favored 'General case' 0 N--CA 1.534 3.74 0 C-N-CA 124.291 1.036 . . . . 0.0 111.021 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.49 -21.02 65.18 Favored 'General case' 1 N--CA 1.54 4.025 0 CA-C-O 118.458 -0.782 . . . . 0.0 112.61 -179.636 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.59 -42.41 11.42 Favored 'General case' 0 N--CA 1.517 2.896 0 CA-C-N 118.915 0.78 . . . . 0.0 111.367 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.54 158.19 8.58 Favored Pre-proline 1 N--CA 1.542 4.165 0 CA-C-O 118.308 -0.853 . . . . 0.0 112.857 -179.616 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -84.66 170.2 10.33 Favored 'Trans proline' 0 C--N 1.377 2.048 0 C-N-CA 122.215 1.944 . . . . 0.0 110.401 178.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.462 ' HA ' ' HB3' ' A' ' 97' ' ' ARG . 2.9 t -90.83 -25.36 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.074 0 CA-C-O 117.912 -1.042 . . . . 0.0 111.543 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -61.91 -43.85 98.0 Favored 'General case' 0 N--CA 1.516 2.851 0 CA-C-N 119.966 1.257 . . . . 0.0 110.135 -179.055 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.5 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.3 mp -99.07 -16.09 18.78 Favored 'General case' 0 N--CA 1.511 2.588 0 C-N-CA 123.344 0.658 . . . . 0.0 111.704 178.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.462 ' HB3' ' HA ' ' A' ' 94' ' ' VAL . 0.2 OUTLIER -68.12 -26.25 65.71 Favored 'General case' 1 N--CA 1.541 4.084 0 N-CA-C 103.809 -2.663 . . . . 0.0 103.809 169.174 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -57.5 -40.1 77.92 Favored 'General case' 0 N--CA 1.516 2.874 0 C-N-CA 123.688 0.795 . . . . 0.0 109.519 174.271 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.635 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 57.2 t90 -63.93 -34.98 79.2 Favored 'General case' 0 N--CA 1.527 3.419 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 177.282 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.57 -38.73 60.52 Favored 'General case' 0 N--CA 1.536 3.835 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 176.227 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -67.61 -38.61 84.19 Favored 'General case' 1 N--CA 1.545 4.286 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 175.677 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 1.0 OUTLIER -59.31 -22.7 61.63 Favored 'General case' 1 N--CA 1.549 4.475 0 C-N-CA 123.633 0.773 . . . . 0.0 110.391 175.732 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.538 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.3 OUTLIER -122.58 5.25 5.64 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.259 0 C-N-CA 123.468 0.707 . . . . 0.0 112.682 -177.336 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.85 -55.89 2.34 Favored 'General case' 0 N--CA 1.516 2.863 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 175.726 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 5.4 tt . . . . . 0 N--CA 1.534 3.762 0 C-N-CA 125.181 1.392 . . . . 0.0 110.802 178.629 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 . . . . . 0 N--CA 1.532 3.633 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 519' ' ' TRP . . . . . 0.678 ' CE2' HD22 ' A' ' 39' ' ' LEU . 76.2 t-105 -36.74 -29.32 0.02 OUTLIER 'General case' 1 N--CA 1.548 4.468 0 N-CA-C 116.131 1.9 . . . . 0.0 116.131 -174.72 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 520' ' ' LEU . . . . . 0.596 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.1 mm? -98.6 -31.0 12.17 Favored 'General case' 0 N--CA 1.537 3.915 0 CA-C-O 117.98 -1.009 . . . . 0.0 113.497 -172.543 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 -62.72 -25.59 68.26 Favored 'General case' 1 N--CA 1.544 4.231 0 N-CA-C 105.639 -1.986 . . . . 0.0 105.639 171.429 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 522' ' ' PHE . . . . . 0.537 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.9 m-85 -75.29 -43.19 52.49 Favored 'General case' 0 N--CA 1.511 2.618 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 173.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 523' ' ' VAL . . . . . 0.436 HG23 ' O ' ' B' ' 519' ' ' TRP . 74.4 t -63.6 -18.56 22.37 Favored 'Isoleucine or valine' 1 N--CA 1.563 5.224 0 CA-C-O 117.999 -1.0 . . . . 0.0 111.334 177.518 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -74.66 -52.7 10.96 Favored 'General case' 0 N--CA 1.531 3.621 0 CA-C-N 119.996 1.271 . . . . 0.0 107.82 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 4.8 mp -63.33 -26.18 68.64 Favored 'General case' 0 N--CA 1.537 3.893 0 CA-C-O 119.134 -0.46 . . . . 0.0 110.165 175.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 526' ' ' LEU . . . . . 0.51 HD23 ' O ' ' B' ' 522' ' ' PHE . 3.1 mm? -67.52 -39.34 85.11 Favored 'General case' 0 N--CA 1.519 2.991 0 CA-C-O 118.206 -0.902 . . . . 0.0 108.602 178.068 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 527' ' ' LYS . . . . . 0.436 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 13.7 mttt -69.17 -19.8 64.0 Favored 'General case' 0 N--CA 1.525 3.31 0 CA-C-O 118.078 -0.963 . . . . 0.0 111.262 177.661 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -75.25 -37.35 61.06 Favored 'General case' 0 N--CA 1.529 3.524 0 CA-C-N 119.629 1.104 . . . . 0.0 109.056 176.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 529' ' ' ALA . . . . . 0.635 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -92.81 -8.63 43.06 Favored 'General case' 0 N--CA 1.504 2.238 0 CA-C-O 118.537 -0.744 . . . . 0.0 110.475 178.248 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 530' ' ' TYR . . . . . 0.436 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.5 OUTLIER -81.53 -29.1 33.64 Favored 'General case' 0 N--CA 1.532 3.673 0 CA-C-N 119.953 1.252 . . . . 0.0 109.272 179.841 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -68.69 -43.35 76.26 Favored 'General case' 0 N--CA 1.531 3.613 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 176.696 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 41.5 m-80 -90.54 -91.85 0.14 Allowed 'General case' 0 N--CA 1.516 2.853 0 N-CA-C 106.625 -1.62 . . . . 0.0 106.625 176.607 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 3.0 p30 155.1 54.47 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.868 0 C-N-CA 127.474 2.31 . . . . 0.0 107.397 177.25 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 534' ' ' LEU . . . . . 0.5 HD22 ' CD2' ' A' ' 96' ' ' LEU . 7.4 mt -114.64 11.6 16.99 Favored 'General case' 0 N--CA 1.53 3.531 0 C-N-CA 124.029 0.932 . . . . 0.0 111.197 -177.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 535' ' ' HIS . . . . . 0.585 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 42.2 p-80 -81.15 0.27 37.07 Favored 'General case' 0 N--CA 1.515 2.805 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 175.142 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 536' ' ' LEU . . . . . 0.443 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 35.4 mt -93.92 -51.52 0.26 Allowed Pre-proline 0 N--CA 1.506 2.37 0 CA-C-O 116.381 -1.771 . . . . 0.0 109.175 -176.166 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 537' ' ' PRO . . . . . 0.443 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 2.7 Cg_exo -64.28 -33.93 57.59 Favored 'Trans proline' 0 C--N 1.395 3.009 0 N-CA-C 107.104 -1.922 . . . . 0.0 107.104 171.227 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 538' ' ' LEU . . . . . 0.411 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 1.2 tm? -61.94 -41.99 98.59 Favored 'General case' 0 N--CA 1.529 3.487 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 175.24 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 13.7 mt -70.86 -22.43 62.3 Favored 'General case' 0 N--CA 1.537 3.909 0 CA-C-O 118.419 -0.8 . . . . 0.0 111.084 177.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -76.29 -8.52 57.26 Favored 'General case' 0 N--CA 1.526 3.375 0 CA-C-N 118.934 0.788 . . . . 0.0 110.228 176.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 541' ' ' LEU . . . . . 0.612 HD13 ' N ' ' B' ' 542' ' ' MET . 0.0 OUTLIER -106.12 -46.85 3.97 Favored 'General case' 0 N--CA 1.511 2.595 0 C-N-CA 124.247 1.019 . . . . 0.0 110.238 -178.512 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 542' ' ' MET . . . . . 0.612 ' N ' HD13 ' B' ' 541' ' ' LEU . 8.2 ptt? -94.41 -21.7 18.77 Favored 'General case' 0 N--CA 1.536 3.854 0 CA-C-O 116.85 -1.548 . . . . 0.0 114.966 -175.756 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 543' ' ' LEU . . . . . 0.644 ' O ' HG23 ' B' ' 544' ' ' THR . 3.1 mp -119.09 -106.97 0.38 Allowed 'General case' 0 N--CA 1.534 3.752 0 CA-C-N 121.464 1.938 . . . . 0.0 113.539 -176.537 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 544' ' ' THR . . . . . 0.644 HG23 ' O ' ' B' ' 543' ' ' LEU . 7.6 p 179.13 165.78 0.69 Allowed Pre-proline 1 N--CA 1.56 5.05 0 CA-C-N 121.381 1.901 . . . . 0.0 110.788 -176.838 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -69.37 -33.98 16.88 Favored 'Trans proline' 0 CA--C 1.574 2.512 0 C-N-CA 122.427 2.085 . . . . 0.0 109.031 172.225 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -59.94 -18.86 48.36 Favored 'General case' 0 N--CA 1.533 3.718 0 CA-C-O 118.078 -0.963 . . . . 0.0 111.633 177.743 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -76.74 -44.86 31.47 Favored 'General case' 0 N--CA 1.525 3.315 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 177.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 548' ' ' ARG . . . . . 0.523 ' HA ' HD12 ' B' ' 551' ' ' LEU . 31.0 ptt180 -81.4 -1.85 47.19 Favored 'General case' 0 N--CA 1.533 3.707 0 CA-C-N 118.627 0.649 . . . . 0.0 110.95 176.21 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -84.53 -47.53 10.5 Favored 'General case' 0 N--CA 1.524 3.275 0 N-CA-C 105.07 -2.196 . . . . 0.0 105.07 174.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -75.63 -17.14 60.1 Favored 'General case' 0 N--CA 1.509 2.499 0 CA-C-O 117.414 -1.279 . . . . 0.0 111.448 177.495 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 551' ' ' LEU . . . . . 0.711 HD11 ' N ' ' A' ' 19' ' ' TRP . 0.0 OUTLIER -74.91 -39.71 61.28 Favored 'General case' 0 N--CA 1.53 3.557 0 N-CA-C 106.35 -1.722 . . . . 0.0 106.35 175.139 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 552' ' ' GLY . . . . . 0.683 ' N ' HD13 ' B' ' 551' ' ' LEU . . . -62.79 -58.71 10.99 Favored Glycine 0 N--CA 1.495 2.577 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 -177.33 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 553' ' ' THR . . . . . 0.537 ' O ' HG23 ' B' ' 557' ' ' ILE . 2.8 m -71.73 -34.59 69.69 Favored 'General case' 0 N--CA 1.537 3.904 0 CA-C-O 118.168 -0.92 . . . . 0.0 112.604 -178.031 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -68.25 -58.15 4.87 Favored 'General case' 1 N--CA 1.541 4.082 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 178.344 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 47.8 t -58.09 -18.9 11.77 Favored 'Isoleucine or valine' 1 N--CA 1.549 4.48 0 CA-C-O 117.621 -1.18 . . . . 0.0 110.264 175.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 13.6 mtt-85 -84.88 -32.74 23.02 Favored 'General case' 0 N--CA 1.52 3.062 0 CA-C-O 117.077 -1.439 . . . . 0.0 111.729 178.515 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 557' ' ' ILE . . . . . 0.537 HG23 ' O ' ' B' ' 553' ' ' THR . 0.0 OUTLIER -77.2 -20.92 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.182 0 CA-C-N 122.049 2.204 . . . . 0.0 109.728 177.722 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 558' ' ' VAL . . . . . 0.476 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.0 OUTLIER -89.44 -50.33 13.26 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.911 0 N-CA-C 106.954 -1.499 . . . . 0.0 106.954 -179.205 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -60.69 -24.78 65.89 Favored 'General case' 0 N--CA 1.531 3.607 0 CA-C-O 119.004 -0.522 . . . . 0.0 109.822 177.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -96.97 -23.74 16.15 Favored 'General case' 0 N--CA 1.522 3.13 0 CA-C-O 117.831 -1.08 . . . . 0.0 111.306 178.271 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 27.6 tp -75.75 -51.92 11.6 Favored 'General case' 1 N--CA 1.542 4.129 0 CA-C-N 120.108 1.322 . . . . 0.0 108.306 179.63 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 40.5 mt -48.24 -27.55 2.53 Favored 'General case' 1 N--CA 1.543 4.195 0 C-N-CA 124.375 1.07 . . . . 0.0 112.3 179.389 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.69 -51.03 13.65 Favored 'General case' 0 N--CA 1.53 3.54 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 178.348 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 62.78 54.91 30.15 Favored Glycine 1 N--CA 1.521 4.324 0 C-N-CA 123.975 0.797 . . . . 0.0 114.228 175.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -115.73 -56.15 2.36 Favored 'General case' 0 N--CA 1.517 2.877 0 N-CA-C 106.657 -1.608 . . . . 0.0 106.657 177.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 52.1 ttp -139.64 76.06 1.54 Allowed 'General case' 0 N--CA 1.524 3.225 0 N-CA-C 104.271 -2.492 . . . . 0.0 104.271 177.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 567' ' ' SER . . . . . 0.446 ' HA ' ' HB2' ' B' ' 571' ' ' LEU . 29.6 m -135.53 -3.28 2.38 Favored 'General case' 0 N--CA 1.522 3.173 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -173.534 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -98.03 -84.66 0.38 Allowed 'General case' 0 N--CA 1.52 3.029 0 CA-C-N 119.809 1.186 . . . . 0.0 110.654 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 3.9 mtt-85 -75.67 -55.91 5.2 Favored 'General case' 0 N--CA 1.527 3.386 0 CA-C-N 119.857 1.208 . . . . 0.0 111.851 -178.165 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -70.98 -2.4 15.17 Favored 'General case' 0 N--CA 1.523 3.21 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -174.29 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 571' ' ' LEU . . . . . 0.814 HD23 HD11 ' B' ' 582' ' ' ILE . 34.0 tp -85.41 -47.23 10.17 Favored 'General case' 0 N--CA 1.533 3.699 0 CA-C-N 120.664 1.575 . . . . 0.0 111.773 -178.36 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.79 -35.88 0.55 Allowed 'General case' 1 N--CA 1.557 4.888 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -179.444 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -71.49 -39.16 71.03 Favored 'General case' 0 N--CA 1.536 3.874 0 CA-C-N 118.806 0.73 . . . . 0.0 111.02 -178.267 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -53.91 -59.99 3.91 Favored 'General case' 0 N--CA 1.53 3.531 0 C-N-CA 123.976 0.911 . . . . 0.0 111.743 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 5.5 mp -93.81 -64.64 1.06 Allowed 'General case' 0 N--CA 1.519 3.018 0 C-N-CA 123.224 0.61 . . . . 0.0 110.012 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 124.78 46.54 0.24 Allowed Glycine 1 N--CA 1.518 4.158 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -178.632 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -119.32 115.73 24.76 Favored 'General case' 0 N--CA 1.517 2.876 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -39.45 171.48 0.01 OUTLIER Glycine 1 N--CA 1.541 5.674 0 C-N-CA 125.493 1.52 . . . . 0.0 116.168 -177.514 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 579' ' ' ILE . . . . . 0.665 HD13 ' CG2' ' B' ' 582' ' ' ILE . 0.6 OUTLIER -80.24 -16.37 12.8 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.386 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.504 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -68.85 -39.45 79.9 Favored 'General case' 0 N--CA 1.527 3.379 0 CA-C-N 119.502 1.046 . . . . 0.0 109.967 176.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.5 p -77.76 -38.79 46.11 Favored 'General case' 0 N--CA 1.535 3.776 0 CA-C-N 118.888 0.767 . . . . 0.0 111.502 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 582' ' ' ILE . . . . . 0.814 HD11 HD23 ' B' ' 571' ' ' LEU . 2.1 tt -67.27 -35.34 73.63 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.185 0 CA-C-O 118.849 -0.596 . . . . 0.0 112.411 -175.81 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 82.0 p -102.27 -25.1 13.8 Favored 'General case' 0 N--CA 1.515 2.78 0 CA-C-O 117.904 -1.046 . . . . 0.0 111.573 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -73.12 -24.86 60.66 Favored 'General case' 0 N--CA 1.538 3.953 0 CA-C-N 119.981 1.264 . . . . 0.0 108.544 174.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -62.71 -36.1 92.82 Favored Glycine 1 N--CA 1.521 4.35 0 N-CA-C 107.325 -2.31 . . . . 0.0 107.325 173.504 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 1.7 m -60.65 -39.74 89.41 Favored 'General case' 1 N--CA 1.541 4.106 0 C-N-CA 123.94 0.896 . . . . 0.0 110.32 176.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -59.7 -32.65 70.71 Favored 'General case' 1 N--CA 1.548 4.445 0 C-N-CA 123.539 0.736 . . . . 0.0 111.683 -179.702 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 4.8 m -65.29 -37.62 87.73 Favored 'General case' 0 N--CA 1.535 3.817 0 C-N-CA 123.039 0.536 . . . . 0.0 110.867 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 29.8 mt -58.31 -45.23 88.4 Favored 'General case' 0 N--CA 1.529 3.52 0 C-N-CA 124.094 0.958 . . . . 0.0 111.519 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -14.82 63.27 Favored 'General case' 0 N--CA 1.538 3.934 0 CA-C-O 118.04 -0.981 . . . . 0.0 112.926 -178.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -88.52 -43.55 11.33 Favored 'General case' 0 N--CA 1.521 3.11 0 CA-C-N 119.534 1.061 . . . . 0.0 110.849 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -57.12 163.83 2.85 Favored Pre-proline 1 N--CA 1.542 4.161 0 C-N-CA 123.647 0.779 . . . . 0.0 112.934 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 593' ' ' PRO . . . . . 0.43 ' O ' ' HB2' ' B' ' 597' ' ' ARG . 45.5 Cg_endo -80.51 173.32 12.45 Favored 'Trans proline' 0 C--N 1.381 2.26 0 C-N-CA 121.777 1.651 . . . . 0.0 110.54 178.671 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -94.73 -25.89 4.53 Favored 'Isoleucine or valine' 0 N--CA 1.522 3.173 0 CA-C-O 117.875 -1.059 . . . . 0.0 111.579 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -62.83 -41.16 99.22 Favored 'General case' 0 N--CA 1.517 2.893 0 CA-C-N 120.02 1.282 . . . . 0.0 110.246 -179.194 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 596' ' ' LEU . . . . . 0.439 ' CD2' HD22 ' A' ' 34' ' ' LEU . 7.0 mp -98.45 -15.37 19.65 Favored 'General case' 0 N--CA 1.512 2.639 0 CA-C-O 118.687 -0.673 . . . . 0.0 111.878 178.859 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 597' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' B' ' 593' ' ' PRO . 0.0 OUTLIER -65.18 -34.37 78.22 Favored 'General case' 1 N--CA 1.544 4.231 0 N-CA-C 103.338 -2.838 . . . . 0.0 103.338 168.632 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -52.76 -40.47 63.16 Favored 'General case' 0 N--CA 1.516 2.872 0 C-N-CA 124.328 1.051 . . . . 0.0 111.001 174.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 599' ' ' TRP . . . . . 0.504 ' O ' HG22 ' B' ' 603' ' ' VAL . 52.3 t90 -64.68 -37.38 87.38 Favored 'General case' 0 N--CA 1.532 3.64 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 177.793 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -51.71 -36.86 48.45 Favored 'General case' 1 N--CA 1.541 4.106 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 176.554 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -70.51 -39.55 74.03 Favored 'General case' 0 N--CA 1.537 3.88 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 175.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 602' ' ' GLU . . . . . 0.426 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.9 OUTLIER -57.43 -24.35 55.08 Favored 'General case' 1 N--CA 1.546 4.372 0 C-N-CA 124.045 0.938 . . . . 0.0 111.505 176.41 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' B' B ' 603' ' ' VAL . . . . . 0.504 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.0 OUTLIER -107.22 -6.3 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.358 0 CA-C-O 117.862 -1.066 . . . . 0.0 113.526 -175.322 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 6.7 mp -104.88 -61.12 1.51 Allowed 'General case' 0 N--CA 1.525 3.307 0 N-CA-C 106.314 -1.736 . . . . 0.0 106.314 174.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 5.4 tp . . . . . 0 N--CA 1.535 3.81 0 C-N-CA 125.507 1.523 . . . . 0.0 113.55 -179.388 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.542 ' O ' HD21 ' B' ' 551' ' ' LEU . 47.1 mt-10 . . . . . 0 N--CA 1.523 3.181 0 N-CA-C 105.441 -2.059 . . . . 0.0 105.441 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.768 ' O ' HG23 ' A' ' 23' ' ' VAL . 75.1 t-105 -59.99 -20.09 55.82 Favored 'General case' 0 N--CA 1.537 3.909 0 CA-C-O 117.824 -1.084 . . . . 0.0 110.973 174.414 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.546 ' N ' HD22 ' A' ' 20' ' ' LEU . 1.8 mm? -92.25 -31.42 15.42 Favored 'General case' 0 N--CA 1.52 3.039 0 C-N-CA 124.114 0.966 . . . . 0.0 110.765 -177.802 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.7 mtt180 -60.83 -27.48 68.11 Favored 'General case' 0 N--CA 1.534 3.743 0 N-CA-C 106.395 -1.706 . . . . 0.0 106.395 172.073 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.513 ' HB2' HD23 ' B' ' 551' ' ' LEU . 20.9 t80 -88.53 -31.55 18.63 Favored 'General case' 0 CA--C 1.595 2.695 0 CA-C-O 116.645 -1.645 . . . . 0.0 109.332 175.088 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.768 HG23 ' O ' ' A' ' 19' ' ' TRP . 93.3 t -74.54 -62.38 1.34 Allowed 'Isoleucine or valine' 1 N--CA 1.565 5.285 0 CA-C-N 122.215 2.28 . . . . 0.0 110.425 -178.597 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -52.91 -36.18 59.16 Favored 'General case' 1 N--CA 1.548 4.452 0 CA-C-N 119.106 0.866 . . . . 0.0 111.62 -178.156 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.94 -35.32 66.96 Favored 'General case' 0 N--CA 1.533 3.699 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 177.358 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.03 -40.84 95.12 Favored 'General case' 0 N--CA 1.529 3.477 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 176.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.439 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 22.3 tttt -56.47 -30.46 62.96 Favored 'General case' 0 N--CA 1.531 3.609 0 C-N-CA 123.216 0.606 . . . . 0.0 111.743 179.101 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -71.67 -42.33 67.63 Favored 'General case' 0 N--CA 1.529 3.511 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.097 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.603 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -87.81 3.35 48.57 Favored 'General case' 0 N--CA 1.517 2.889 0 O-C-N 123.176 0.297 . . . . 0.0 110.295 177.235 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.439 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -87.54 -45.65 10.27 Favored 'General case' 0 N--CA 1.524 3.236 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 -179.917 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -58.21 -39.72 79.74 Favored 'General case' 1 N--CA 1.541 4.088 0 C-N-CA 123.292 0.637 . . . . 0.0 109.3 178.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 65.5 m-80 -92.63 -83.21 0.31 Allowed 'General case' 0 N--CA 1.512 2.669 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 177.494 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 p30 145.51 44.16 0.0 OUTLIER 'General case' 1 N--CA 1.562 5.157 0 C-N-CA 128.444 2.698 . . . . 0.0 107.879 178.673 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.43 HD22 ' CD2' ' B' ' 596' ' ' LEU . 13.3 mt -98.22 12.02 35.96 Favored 'General case' 0 N--CA 1.53 3.541 0 O-C-N 121.368 -0.832 . . . . 0.0 110.693 -179.591 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.555 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -89.86 16.39 8.21 Favored 'General case' 0 N--CA 1.515 2.799 0 C-N-CA 123.984 0.913 . . . . 0.0 109.071 174.894 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.503 HD21 HD11 ' B' ' 520' ' ' LEU . 23.6 mt -98.96 -51.93 0.2 Allowed Pre-proline 0 N--CA 1.503 2.198 0 C-N-CA 125.335 1.454 . . . . 0.0 107.581 -178.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.484 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 6.1 Cg_exo -70.03 -33.43 15.57 Favored 'Trans proline' 0 C--N 1.393 2.869 0 N-CA-C 107.098 -1.924 . . . . 0.0 107.098 170.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.5 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.1 OUTLIER -65.79 -42.08 91.2 Favored 'General case' 0 N--CA 1.517 2.903 0 CA-C-O 117.93 -1.033 . . . . 0.0 108.495 177.357 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.518 HD22 ' CE2' ' B' ' 519' ' ' TRP 0.268 0.1 OUTLIER -77.42 -11.08 59.8 Favored 'General case' 1 N--CA 1.552 4.649 0 CA-C-N 120.316 1.416 . . . . 0.0 110.934 176.628 . . . . . . . . 5 4 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -91.59 9.77 30.79 Favored 'General case' 0 N--CA 1.524 3.228 0 CA-C-N 119.057 0.844 . . . . 0.0 110.038 176.252 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.647 HD13 ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -125.57 -50.08 1.63 Allowed 'General case' 0 N--CA 1.522 3.166 0 CA-C-N 119.407 1.003 . . . . 0.0 109.686 -178.872 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.647 ' N ' HD13 ' A' ' 41' ' ' LEU . 7.9 ptp -93.95 -14.0 26.44 Favored 'General case' 1 N--CA 1.543 4.222 0 CA-C-O 118.273 -0.87 . . . . 0.0 113.298 -177.661 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.464 ' O ' HG23 ' A' ' 44' ' ' THR . 3.6 mp -110.88 -83.38 0.57 Allowed 'General case' 0 N--CA 1.502 2.167 0 CA-C-O 117.934 -1.031 . . . . 0.0 110.911 -177.25 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.464 HG23 ' O ' ' A' ' 43' ' ' LEU . 0.9 OUTLIER 150.52 166.09 0.0 OUTLIER Pre-proline 1 N--CA 1.564 5.233 0 C-N-CA 126.144 1.778 . . . . 0.0 109.1 -178.445 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -68.86 -33.86 19.35 Favored 'Trans proline' 0 CA--C 1.574 2.515 0 C-N-CA 122.304 2.003 . . . . 0.0 108.399 173.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -62.66 -19.69 64.08 Favored 'General case' 0 N--CA 1.529 3.476 0 CA-C-O 118.058 -0.972 . . . . 0.0 111.15 177.21 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -73.2 -32.6 64.9 Favored 'General case' 0 N--CA 1.523 3.203 0 CA-C-O 117.684 -1.15 . . . . 0.0 109.969 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.8 ptt180 -89.5 -14.27 35.62 Favored 'General case' 0 N--CA 1.538 3.956 0 CA-C-N 119.689 1.131 . . . . 0.0 108.779 173.071 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -79.52 -19.35 49.81 Favored 'General case' 0 N--CA 1.516 2.847 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 172.261 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -95.46 -38.06 10.63 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 123.932 0.893 . . . . 0.0 109.467 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.483 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 23.3 tp -75.26 -21.77 58.31 Favored 'General case' 0 N--CA 1.534 3.753 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 173.111 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.452 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -69.08 -71.34 0.99 Allowed Glycine 0 N--CA 1.497 2.704 0 C-N-CA 125.104 1.335 . . . . 0.0 110.553 176.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.6 m -70.33 -28.44 65.16 Favored 'General case' 0 N--CA 1.537 3.893 0 CA-C-O 117.842 -1.075 . . . . 0.0 112.991 -177.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -69.47 -51.7 33.57 Favored 'General case' 0 N--CA 1.534 3.751 0 CA-C-N 120.007 1.276 . . . . 0.0 107.848 178.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 33.2 t -61.78 -19.31 21.0 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.241 0 CA-C-O 117.683 -1.151 . . . . 0.0 109.793 175.888 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.5 mtp180 -77.39 -43.94 30.97 Favored 'General case' 0 N--CA 1.526 3.355 0 CA-C-N 120.371 1.441 . . . . 0.0 112.299 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.422 HD13 ' N ' ' A' ' 58' ' ' VAL . 0.0 OUTLIER -73.03 -21.69 19.33 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.75 0 CA-C-N 121.719 2.054 . . . . 0.0 111.011 179.508 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.473 HG11 HD11 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -89.15 -52.18 11.25 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.024 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 -178.855 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -59.61 -23.06 62.66 Favored 'General case' 0 N--CA 1.529 3.509 0 CA-C-O 119.087 -0.482 . . . . 0.0 109.984 177.281 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -96.34 -22.52 17.14 Favored 'General case' 0 N--CA 1.526 3.357 0 CA-C-O 117.861 -1.066 . . . . 0.0 110.97 177.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.3 mt -75.3 -54.66 6.7 Favored 'General case' 1 N--CA 1.544 4.235 0 CA-C-N 119.999 1.272 . . . . 0.0 107.903 178.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.3 -36.34 4.02 Favored 'General case' 1 N--CA 1.545 4.278 0 C-N-CA 125.346 1.458 . . . . 0.0 112.003 179.727 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.9 mmm180 -81.85 -52.6 6.93 Favored 'General case' 0 N--CA 1.527 3.397 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.06 59.73 3.31 Favored Glycine 1 N--CA 1.517 4.081 0 CA-C-O 119.349 -0.695 . . . . 0.0 111.795 178.098 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -116.05 -54.52 2.48 Favored 'General case' 0 N--CA 1.524 3.234 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 178.17 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 10.7 ptp -149.39 77.64 1.35 Allowed 'General case' 0 N--CA 1.526 3.351 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 178.326 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.41 ' HA ' HD22 ' A' ' 71' ' ' LEU . 5.6 t -128.97 -8.54 4.9 Favored 'General case' 0 N--CA 1.528 3.429 0 N-CA-C 114.066 1.136 . . . . 0.0 114.066 -176.161 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -114.97 -59.24 2.04 Favored 'General case' 0 N--CA 1.528 3.468 0 CA-C-N 120.056 1.298 . . . . 0.0 111.955 -178.389 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 3.2 mmt-85 -94.68 -55.12 3.24 Favored 'General case' 0 N--CA 1.528 3.432 0 CA-C-N 118.093 0.406 . . . . 0.0 111.46 -177.193 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -76.87 -9.3 58.59 Favored 'General case' 0 N--CA 1.524 3.273 0 N-CA-C 114.05 1.129 . . . . 0.0 114.05 -177.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.55 HD23 HG21 ' A' ' 82' ' ' ILE . 36.4 tp -77.66 -49.65 14.08 Favored 'General case' 0 N--CA 1.526 3.37 0 CA-C-N 119.973 1.26 . . . . 0.0 112.299 -177.787 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.45 -34.07 15.75 Favored 'General case' 0 N--CA 1.534 3.747 0 N-CA-C 114.306 1.225 . . . . 0.0 114.306 -176.135 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -68.34 -33.54 74.47 Favored 'General case' 0 N--CA 1.535 3.805 0 CA-C-O 119.051 -0.5 . . . . 0.0 111.709 -178.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -52.54 -46.42 66.76 Favored 'General case' 0 N--CA 1.531 3.611 0 C-N-CA 124.275 1.03 . . . . 0.0 112.584 -178.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.407 HD23 ' N ' ' A' ' 75' ' ' LEU . 1.2 pt? -138.16 -40.56 0.53 Allowed 'General case' 0 N--CA 1.527 3.388 0 CA-C-O 118.63 -0.7 . . . . 0.0 111.852 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 107.87 79.21 1.16 Allowed Glycine 1 N--CA 1.524 4.517 0 CA-C-N 119.185 0.902 . . . . 0.0 111.712 178.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -112.47 -9.78 13.78 Favored 'General case' 0 N--CA 1.526 3.367 0 C-N-CA 123.626 0.77 . . . . 0.0 111.269 177.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 87.81 162.88 38.47 Favored Glycine 0 N--CA 1.513 3.78 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 -178.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -85.33 -23.31 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.522 3.17 0 CA-C-N 118.825 1.313 . . . . 0.0 108.387 178.625 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.32 -29.21 70.29 Favored 'General case' 0 N--CA 1.515 2.776 0 CA-C-O 116.921 -1.514 . . . . 0.0 111.509 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.8 p -83.08 -46.91 12.25 Favored 'General case' 1 N--CA 1.545 4.296 0 CA-C-N 120.809 1.64 . . . . 0.0 110.545 178.887 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.55 HG21 HD23 ' A' ' 71' ' ' LEU . 15.9 pt -68.36 -16.3 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.99 0 CA-C-O 117.879 -1.058 . . . . 0.0 113.114 -177.74 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 62.7 p -111.19 -29.88 7.67 Favored 'General case' 0 N--CA 1.516 2.861 0 CA-C-N 120.022 1.283 . . . . 0.0 110.721 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -74.96 -21.76 58.97 Favored 'General case' 0 N--CA 1.53 3.564 0 CA-C-N 119.528 1.058 . . . . 0.0 108.309 174.033 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.07 -29.65 74.81 Favored Glycine 0 N--CA 1.516 3.983 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 176.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.2 t -64.37 -39.55 94.1 Favored 'General case' 0 N--CA 1.539 3.978 0 CA-C-N 118.402 1.101 . . . . 0.0 109.326 176.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -62.04 -19.1 62.52 Favored 'General case' 1 N--CA 1.543 4.187 0 CA-C-O 118.41 -0.805 . . . . 0.0 112.367 179.075 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 14.3 m -72.04 -39.93 68.74 Favored 'General case' 0 N--CA 1.535 3.79 0 CA-C-N 119.297 0.953 . . . . 0.0 110.288 179.664 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 54.9 mt -56.47 -49.28 75.12 Favored 'General case' 0 N--CA 1.525 3.285 0 C-N-CA 124.324 1.05 . . . . 0.0 112.525 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.66 -11.94 59.36 Favored 'General case' 1 N--CA 1.54 4.071 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -179.421 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.03 -44.72 12.79 Favored 'General case' 0 N--CA 1.519 2.997 0 CA-C-N 119.537 1.062 . . . . 0.0 110.974 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.39 161.98 5.01 Favored Pre-proline 1 N--CA 1.546 4.344 0 CA-C-O 118.249 -0.882 . . . . 0.0 112.663 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.429 ' O ' ' HB2' ' A' ' 97' ' ' ARG . 39.1 Cg_endo -78.22 174.61 12.19 Favored 'Trans proline' 0 C--N 1.38 2.21 0 C-N-CA 121.758 1.639 . . . . 0.0 110.43 178.43 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -94.56 -28.08 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.077 0 CA-C-O 117.302 -1.332 . . . . 0.0 111.721 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -64.24 -39.6 94.29 Favored 'General case' 0 N--CA 1.517 2.903 0 CA-C-N 120.37 1.441 . . . . 0.0 110.904 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.474 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.2 mp -98.9 -17.55 18.32 Favored 'General case' 0 N--CA 1.513 2.721 0 C-N-CA 123.291 0.636 . . . . 0.0 111.751 178.668 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.429 ' HB2' ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -65.35 -32.85 74.71 Favored 'General case' 1 N--CA 1.545 4.3 0 N-CA-C 103.047 -2.946 . . . . 0.0 103.047 168.459 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -55.18 -40.28 70.53 Favored 'General case' 0 N--CA 1.515 2.808 0 C-N-CA 124.371 1.068 . . . . 0.0 110.686 174.426 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.615 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 54.4 t90 -62.65 -35.49 79.79 Favored 'General case' 0 N--CA 1.536 3.855 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 177.721 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -52.25 -39.1 59.91 Favored 'General case' 1 N--CA 1.542 4.147 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 175.905 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -68.83 -37.25 79.04 Favored 'General case' 1 N--CA 1.542 4.129 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 175.734 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.425 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 1.2 mm-40 -60.79 -23.39 64.99 Favored 'General case' 1 N--CA 1.546 4.362 0 C-N-CA 123.542 0.737 . . . . 0.0 110.609 175.965 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.511 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -115.49 -3.19 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.179 0 CA-C-O 118.375 -0.821 . . . . 0.0 111.921 -177.268 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.25 -56.24 2.53 Favored 'General case' 0 N--CA 1.516 2.842 0 N-CA-C 106.121 -1.807 . . . . 0.0 106.121 175.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.2 tt . . . . . 0 N--CA 1.535 3.777 0 C-N-CA 124.95 1.3 . . . . 0.0 110.014 178.423 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 . . . . . 0 N--CA 1.524 3.228 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.019 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 519' ' ' TRP . . . . . 0.539 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 73.6 t-105 -44.65 -27.27 0.46 Allowed 'General case' 1 N--CA 1.55 4.57 0 CA-C-N 119.961 1.255 . . . . 0.0 113.291 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 520' ' ' LEU . . . . . 0.608 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.2 mm? -99.3 -28.08 13.48 Favored 'General case' 0 N--CA 1.529 3.491 0 CA-C-O 117.645 -1.169 . . . . 0.0 113.273 -173.339 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 18.8 ttm180 -61.33 -26.11 67.59 Favored 'General case' 1 N--CA 1.544 4.228 0 N-CA-C 105.38 -2.081 . . . . 0.0 105.38 171.278 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 522' ' ' PHE . . . . . 0.539 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.8 m-85 -77.05 -43.8 33.16 Favored 'General case' 0 N--CA 1.507 2.423 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 174.311 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 523' ' ' VAL . . . . . 0.522 HG23 ' O ' ' B' ' 519' ' ' TRP . 99.2 t -71.57 -17.45 19.56 Favored 'Isoleucine or valine' 1 N--CA 1.571 5.604 0 CA-C-O 117.755 -1.116 . . . . 0.0 113.203 -178.899 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -79.34 -48.64 13.72 Favored 'General case' 0 N--CA 1.534 3.772 0 CA-C-N 120.631 1.56 . . . . 0.0 108.45 -178.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 5.1 mp -76.95 -18.77 58.04 Favored 'General case' 0 N--CA 1.525 3.301 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 175.667 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 526' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' B' ' 522' ' ' PHE . 0.2 OUTLIER -69.43 -34.4 74.39 Favored 'General case' 0 N--CA 1.519 2.989 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 173.779 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 52.5 tttt -64.37 -27.7 69.19 Favored 'General case' 0 N--CA 1.519 3.003 0 CA-C-O 118.569 -0.729 . . . . 0.0 110.543 176.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -64.67 -41.62 95.96 Favored 'General case' 0 N--CA 1.536 3.873 0 CA-C-N 118.981 0.809 . . . . 0.0 109.492 177.336 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 529' ' ' ALA . . . . . 0.615 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -83.33 -13.34 55.28 Favored 'General case' 0 N--CA 1.505 2.308 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.894 178.028 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -76.54 -31.79 57.82 Favored 'General case' 0 N--CA 1.539 3.991 0 CA-C-N 120.401 1.455 . . . . 0.0 109.62 179.393 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -64.79 -44.66 89.24 Favored 'General case' 0 N--CA 1.536 3.872 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 178.075 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -89.63 -90.01 0.15 Allowed 'General case' 0 N--CA 1.515 2.782 0 N-CA-C 105.779 -1.934 . . . . 0.0 105.779 176.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.3 p30 155.56 48.9 0.0 OUTLIER 'General case' 1 N--CA 1.559 4.979 0 C-N-CA 127.447 2.299 . . . . 0.0 108.021 176.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 534' ' ' LEU . . . . . 0.474 HD22 ' CD2' ' A' ' 96' ' ' LEU . 9.4 mt -105.38 12.6 31.41 Favored 'General case' 0 N--CA 1.52 3.041 0 C-N-CA 124.531 1.132 . . . . 0.0 110.257 -178.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 535' ' ' HIS . . . . . 0.555 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 30.9 p-80 -85.17 5.57 29.45 Favored 'General case' 0 N--CA 1.51 2.565 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 175.425 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 536' ' ' LEU . . . . . 0.473 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 31.3 mt -97.03 -51.33 0.22 Allowed Pre-proline 0 N--CA 1.501 2.11 0 CA-C-O 116.362 -1.78 . . . . 0.0 108.45 -175.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 537' ' ' PRO . . . . . 0.473 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 6.3 Cg_exo -68.44 -36.47 15.38 Favored 'Trans proline' 0 C--N 1.394 2.925 0 N-CA-C 106.999 -1.962 . . . . 0.0 106.999 171.397 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 538' ' ' LEU . . . . . 0.51 HD11 ' HE1' ' B' ' 542' ' ' MET . 0.8 OUTLIER -59.87 -45.11 93.52 Favored 'General case' 0 N--CA 1.526 3.326 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 176.382 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 39.9 mt -73.43 -20.89 60.61 Favored 'General case' 0 N--CA 1.535 3.802 0 CA-C-O 118.224 -0.893 . . . . 0.0 111.456 179.25 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -74.2 -23.33 59.18 Favored 'General case' 0 N--CA 1.532 3.638 0 CA-C-N 119.772 1.169 . . . . 0.0 110.049 176.278 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 541' ' ' LEU . . . . . 0.563 HD13 ' N ' ' B' ' 542' ' ' MET . 0.1 OUTLIER -86.1 -51.83 6.07 Favored 'General case' 0 N--CA 1.514 2.757 0 C-N-CA 123.82 0.848 . . . . 0.0 109.649 -179.098 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 542' ' ' MET . . . . . 0.563 ' N ' HD13 ' B' ' 541' ' ' LEU . 8.8 ptt? -99.49 17.17 21.01 Favored 'General case' 0 N--CA 1.53 3.531 0 CA-C-O 118.024 -0.989 . . . . 0.0 113.588 -177.44 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -134.34 -98.85 0.25 Allowed 'General case' 0 N--CA 1.535 3.798 0 CA-C-N 120.467 1.485 . . . . 0.0 113.31 178.291 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 158.17 175.11 0.02 OUTLIER Pre-proline 1 N--CA 1.586 6.331 0 CA-C-N 120.985 1.72 . . . . 0.0 109.511 -177.187 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -63.18 -23.81 72.85 Favored 'Trans proline' 0 N--CA 1.525 3.364 0 C-N-CA 122.135 1.89 . . . . 0.0 110.544 174.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -54.03 -22.45 10.69 Favored 'General case' 1 N--CA 1.55 4.53 0 C-N-CA 123.894 0.877 . . . . 0.0 110.751 176.067 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -45.71 -76.23 0.03 OUTLIER 'General case' 0 N--CA 1.519 3.001 0 C-N-CA 126.333 1.853 . . . . 0.0 112.19 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 548' ' ' ARG . . . . . 0.515 ' HA ' HD12 ' B' ' 551' ' ' LEU . 28.7 ptt180 -93.77 -0.6 55.82 Favored 'General case' 0 N--CA 1.526 3.356 0 N-CA-C 113.634 0.975 . . . . 0.0 113.634 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -75.69 -52.46 10.44 Favored 'General case' 1 N--CA 1.544 4.243 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 173.259 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -73.88 -22.05 59.86 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 117.016 -1.469 . . . . 0.0 111.656 177.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 551' ' ' LEU . . . . . 0.673 HD13 ' N ' ' B' ' 552' ' ' GLY . 0.0 OUTLIER -74.22 -40.24 62.56 Favored 'General case' 0 N--CA 1.533 3.701 0 CA-C-N 121.039 1.745 . . . . 0.0 107.67 176.242 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 552' ' ' GLY . . . . . 0.673 ' N ' HD13 ' B' ' 551' ' ' LEU . . . -63.46 -47.77 84.34 Favored Glycine 0 N--CA 1.507 3.378 0 N-CA-C 110.803 -0.919 . . . . 0.0 110.803 -177.221 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.2 m -79.52 -39.56 31.69 Favored 'General case' 0 N--CA 1.534 3.754 0 CA-C-N 118.244 1.022 . . . . 0.0 112.086 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.2 -49.05 71.22 Favored 'General case' 0 N--CA 1.539 3.994 0 CA-C-N 119.511 1.05 . . . . 0.0 108.982 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 46.2 t -67.74 -19.82 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.761 0 CA-C-O 117.484 -1.246 . . . . 0.0 109.697 177.365 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 34.1 mtt180 -82.97 -33.49 26.65 Favored 'General case' 0 N--CA 1.521 3.101 0 CA-C-O 116.413 -1.756 . . . . 0.0 112.574 178.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 557' ' ' ILE . . . . . 0.464 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -78.19 -22.12 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.484 0 CA-C-N 122.984 2.629 . . . . 0.0 109.573 178.221 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 558' ' ' VAL . . . . . 0.464 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.0 OUTLIER -85.75 -52.97 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.738 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 179.826 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -60.87 -28.29 68.75 Favored 'General case' 0 N--CA 1.53 3.53 0 CA-C-O 118.653 -0.689 . . . . 0.0 110.659 178.829 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -86.52 -26.73 24.4 Favored 'General case' 0 N--CA 1.529 3.514 0 CA-C-N 118.667 0.667 . . . . 0.0 109.592 176.52 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 15.9 tp -65.69 -44.07 87.33 Favored 'General case' 1 N--CA 1.54 4.046 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.741 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 21.4 mt -59.65 -21.66 60.8 Favored 'General case' 0 N--CA 1.533 3.685 0 C-N-CA 123.752 0.821 . . . . 0.0 111.719 178.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 14.2 mmm180 -77.83 -53.44 7.49 Favored 'General case' 0 N--CA 1.524 3.235 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 69.04 77.1 0.42 Allowed Glycine 1 N--CA 1.523 4.458 0 CA-C-O 119.195 -0.781 . . . . 0.0 111.197 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -162.51 -52.69 0.04 OUTLIER 'General case' 0 N--CA 1.529 3.512 0 CA-C-N 117.834 0.817 . . . . 0.0 110.36 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 75.3 mtm -136.03 62.82 1.61 Allowed 'General case' 0 N--CA 1.521 3.108 0 N-CA-C 106.106 -1.813 . . . . 0.0 106.106 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 57.9 m -136.42 9.62 3.18 Favored 'General case' 0 N--CA 1.518 2.949 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.718 -176.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -112.15 -64.31 1.31 Allowed 'General case' 0 N--CA 1.517 2.907 0 CA-C-N 119.259 0.936 . . . . 0.0 110.404 -179.352 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -110.03 -43.53 3.96 Favored 'General case' 0 N--CA 1.519 3.01 0 C-N-CA 123.166 0.586 . . . . 0.0 110.271 -178.793 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -70.07 -13.12 62.06 Favored 'General case' 0 N--CA 1.514 2.767 0 CA-C-O 117.89 -1.052 . . . . 0.0 113.551 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 571' ' ' LEU . . . . . 0.853 HD23 HD11 ' B' ' 582' ' ' ILE . 18.2 tp -82.4 -51.46 7.83 Favored 'General case' 0 N--CA 1.527 3.411 0 CA-C-N 120.245 1.384 . . . . 0.0 110.615 -179.004 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -44.56 -30.51 0.91 Allowed 'General case' 1 N--CA 1.55 4.563 0 CA-C-N 119.125 0.875 . . . . 0.0 113.308 179.956 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -67.21 -43.59 81.71 Favored 'General case' 0 N--CA 1.535 3.806 0 C-N-CA 122.882 0.473 . . . . 0.0 110.795 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -47.68 -50.55 24.57 Favored 'General case' 0 N--CA 1.534 3.741 0 C-N-CA 124.734 1.214 . . . . 0.0 113.449 -178.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 2.0 pp -135.97 -43.86 0.65 Allowed 'General case' 0 N--CA 1.537 3.885 0 CA-C-O 118.938 -0.554 . . . . 0.0 111.604 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 113.85 82.37 1.1 Allowed Glycine 1 N--CA 1.523 4.479 0 N-CA-C 110.305 -1.118 . . . . 0.0 110.305 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -103.2 -43.04 5.57 Favored 'General case' 0 N--CA 1.526 3.352 0 C-N-CA 123.426 0.691 . . . . 0.0 109.594 178.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 108.61 157.94 18.99 Favored Glycine 0 N--CA 1.515 3.913 0 N-CA-C 109.734 -1.346 . . . . 0.0 109.734 -179.074 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 579' ' ' ILE . . . . . 0.464 ' HA ' HG22 ' B' ' 582' ' ' ILE . 0.8 OUTLIER -82.74 -15.82 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.898 0 CA-C-N 119.235 1.518 . . . . 0.0 108.265 177.701 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -69.4 -42.62 74.87 Favored 'General case' 0 N--CA 1.525 3.318 0 CA-C-N 120.047 1.294 . . . . 0.0 109.149 176.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.2 p -75.94 -38.68 57.35 Favored 'General case' 1 N--CA 1.542 4.142 0 CA-C-N 119.127 0.876 . . . . 0.0 112.365 179.31 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 582' ' ' ILE . . . . . 0.853 HD11 HD23 ' B' ' 571' ' ' LEU . 0.8 OUTLIER -67.66 -37.19 78.23 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.356 0 C-N-CA 123.347 0.659 . . . . 0.0 112.35 -175.112 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 75.6 p -101.07 -24.79 14.23 Favored 'General case' 0 N--CA 1.511 2.608 0 CA-C-O 117.897 -1.049 . . . . 0.0 111.685 -179.412 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 13.7 ptt180 -74.59 -23.69 58.78 Favored 'General case' 0 N--CA 1.526 3.365 0 CA-C-N 119.936 1.244 . . . . 0.0 109.004 175.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -63.02 -35.03 91.54 Favored Glycine 1 N--CA 1.528 4.781 0 N-CA-C 107.871 -2.092 . . . . 0.0 107.871 173.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 19.4 m -65.35 -34.52 78.52 Favored 'General case' 1 N--CA 1.541 4.104 0 C-N-CA 123.136 0.575 . . . . 0.0 110.403 176.55 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -62.85 -35.09 78.83 Favored 'General case' 1 N--CA 1.547 4.408 0 C-N-CA 123.354 0.662 . . . . 0.0 110.274 178.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.84 -35.26 76.1 Favored 'General case' 0 N--CA 1.534 3.758 0 C-N-CA 123.773 0.829 . . . . 0.0 111.133 179.337 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 24.1 mt -58.25 -42.47 86.46 Favored 'General case' 0 N--CA 1.531 3.575 0 C-N-CA 123.724 0.81 . . . . 0.0 110.731 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 3.1 mptt -60.29 -29.41 68.81 Favored 'General case' 1 N--CA 1.543 4.21 0 C-N-CA 123.205 0.602 . . . . 0.0 111.89 179.148 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -71.8 -40.88 68.87 Favored 'General case' 0 N--CA 1.517 2.884 0 CA-C-O 119.226 -0.416 . . . . 0.0 110.241 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -70.82 159.0 86.77 Favored Pre-proline 0 N--CA 1.527 3.41 0 CA-C-O 118.5 -0.762 . . . . 0.0 111.439 178.714 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -82.07 178.88 5.99 Favored 'Trans proline' 0 C--N 1.376 2.015 0 C-N-CA 122.013 1.809 . . . . 0.0 111.731 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.8 t -92.36 -26.97 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.906 0 CA-C-O 117.558 -1.211 . . . . 0.0 110.272 179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -65.35 -38.14 89.18 Favored 'General case' 0 N--CA 1.515 2.819 0 CA-C-N 119.938 1.244 . . . . 0.0 110.195 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 596' ' ' LEU . . . . . 0.43 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.8 mp -97.95 -20.92 17.14 Favored 'General case' 0 N--CA 1.513 2.676 0 C-N-CA 123.443 0.697 . . . . 0.0 110.973 178.754 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -27.42 66.83 Favored 'General case' 0 N--CA 1.536 3.854 0 N-CA-C 103.389 -2.819 . . . . 0.0 103.389 168.627 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.16 -39.88 79.98 Favored 'General case' 0 N--CA 1.523 3.224 0 C-N-CA 124.345 1.058 . . . . 0.0 109.742 173.401 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 599' ' ' TRP . . . . . 0.603 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 45.7 t90 -61.86 -35.72 79.14 Favored 'General case' 0 N--CA 1.526 3.374 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 178.034 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.81 -36.26 47.27 Favored 'General case' 1 N--CA 1.541 4.092 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 176.781 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -73.38 -37.28 66.07 Favored 'General case' 0 N--CA 1.533 3.716 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 175.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 602' ' ' GLU . . . . . 0.445 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.2 OUTLIER -59.65 -22.16 61.5 Favored 'General case' 1 N--CA 1.544 4.261 0 CA-C-O 118.675 -0.679 . . . . 0.0 110.912 175.513 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' B' B ' 603' ' ' VAL . . . . . 0.519 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.0 OUTLIER -112.93 3.15 8.32 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.763 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -176.548 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 75.6 mt -114.43 -60.26 1.91 Allowed 'General case' 0 N--CA 1.519 3.017 0 N-CA-C 106.395 -1.705 . . . . 0.0 106.395 175.25 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 4.1 mp . . . . . 0 N--CA 1.536 3.841 0 C-N-CA 124.467 1.107 . . . . 0.0 111.768 -179.504 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 . . . . . 0 N--CA 1.514 2.74 0 CA-C-O 118.205 -0.902 . . . . 0.0 109.265 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.681 ' CZ3' HD22 ' B' ' 551' ' ' LEU . 72.6 t-105 -48.45 -38.49 19.96 Favored 'General case' 0 N--CA 1.534 3.728 0 CA-C-N 119.862 1.21 . . . . 0.0 112.148 179.349 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.505 ' N ' HD22 ' A' ' 20' ' ' LEU . 2.6 mm? -87.37 -27.11 22.99 Favored 'General case' 0 N--CA 1.524 3.239 0 CA-C-O 117.369 -1.3 . . . . 0.0 112.891 -174.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.71 -28.4 68.63 Favored 'General case' 1 N--CA 1.54 4.059 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 173.272 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.488 ' HB2' HG21 ' B' ' 555' ' ' VAL . 0.1 OUTLIER -79.6 -39.44 31.65 Favored 'General case' 0 N--CA 1.5 2.046 0 CA-C-O 116.366 -1.778 . . . . 0.0 108.075 173.585 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 19' ' ' TRP . 86.7 t -68.22 -21.28 26.45 Favored 'Isoleucine or valine' 1 N--CA 1.568 5.456 0 CA-C-N 121.138 1.79 . . . . 0.0 112.569 -177.631 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -78.19 -53.02 7.81 Favored 'General case' 0 N--CA 1.534 3.741 0 CA-C-N 120.112 1.324 . . . . 0.0 107.51 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.6 mp -70.03 -15.94 63.08 Favored 'General case' 0 N--CA 1.529 3.492 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 175.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.473 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -72.34 -37.8 68.77 Favored 'General case' 0 N--CA 1.513 2.694 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 176.305 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.677 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 11.0 tptp -69.16 -15.02 63.31 Favored 'General case' 0 N--CA 1.515 2.804 0 CA-C-O 117.924 -1.036 . . . . 0.0 111.483 176.171 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -74.16 -41.28 61.75 Favored 'General case' 0 N--CA 1.533 3.681 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 175.003 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.601 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -87.62 -7.1 57.91 Favored 'General case' 0 N--CA 1.505 2.301 0 CA-C-O 118.671 -0.681 . . . . 0.0 110.364 177.216 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.677 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -82.99 -33.34 26.62 Favored 'General case' 0 N--CA 1.537 3.92 0 CA-C-N 120.071 1.305 . . . . 0.0 109.073 179.532 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -65.56 -40.12 92.47 Favored 'General case' 0 N--CA 1.532 3.649 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 176.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -90.94 -90.61 0.15 Allowed 'General case' 0 N--CA 1.514 2.736 0 N-CA-C 106.143 -1.799 . . . . 0.0 106.143 176.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 152.93 50.73 0.0 OUTLIER 'General case' 1 N--CA 1.558 4.93 0 C-N-CA 127.629 2.372 . . . . 0.0 108.474 176.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.483 HD22 ' CD2' ' B' ' 596' ' ' LEU . 5.7 mt -112.16 13.29 20.54 Favored 'General case' 0 N--CA 1.527 3.389 0 C-N-CA 124.312 1.045 . . . . 0.0 109.855 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.497 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 43.6 p-80 -83.07 3.61 29.74 Favored 'General case' 0 N--CA 1.506 2.341 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 175.566 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.803 ' HA ' HD23 ' A' ' 39' ' ' LEU . 21.2 mt -94.92 -50.95 0.25 Allowed Pre-proline 0 N--CA 1.509 2.503 0 CA-C-O 116.957 -1.497 . . . . 0.0 108.971 -175.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.472 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 3.9 Cg_exo -65.41 -30.87 52.8 Favored 'Trans proline' 0 C--N 1.396 3.036 0 N-CA-C 106.563 -2.13 . . . . 0.0 106.563 170.523 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.497 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.2 OUTLIER -67.32 -37.83 83.96 Favored 'General case' 0 N--CA 1.52 3.068 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 175.88 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.803 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -73.99 -15.98 61.08 Favored 'General case' 1 N--CA 1.543 4.186 0 CA-C-N 119.549 1.068 . . . . 0.0 110.407 175.956 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -82.58 -17.91 43.18 Favored 'General case' 0 N--CA 1.523 3.218 0 CA-C-N 119.651 1.114 . . . . 0.0 110.151 177.013 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 pp -99.83 -44.91 5.9 Favored 'General case' 0 N--CA 1.531 3.578 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -177.538 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 12.8 ptp -109.94 2.04 19.49 Favored 'General case' 1 N--CA 1.551 4.579 0 CA-C-N 118.962 0.801 . . . . 0.0 112.637 -175.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.0 mt -115.89 -65.39 1.19 Allowed 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 117.729 -1.129 . . . . 0.0 110.416 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 35.4 p 119.45 159.66 0.0 OUTLIER Pre-proline 1 N--CA 1.573 5.705 0 C-N-CA 128.32 2.648 . . . . 0.0 109.542 -178.77 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -67.24 -30.97 36.74 Favored 'Trans proline' 0 C--N 1.39 2.761 0 C-N-CA 122.026 1.817 . . . . 0.0 109.276 175.157 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -65.63 -26.42 67.81 Favored 'General case' 0 N--CA 1.531 3.604 0 CA-C-O 118.476 -0.773 . . . . 0.0 109.77 176.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -69.64 -33.35 72.5 Favored 'General case' 0 N--CA 1.524 3.275 0 CA-C-O 117.584 -1.198 . . . . 0.0 109.579 178.074 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 25.3 ptt180 -83.97 -18.12 38.27 Favored 'General case' 0 N--CA 1.53 3.533 0 CA-C-N 119.653 1.115 . . . . 0.0 108.906 174.546 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -75.23 -21.77 58.38 Favored 'General case' 0 N--CA 1.521 3.116 0 N-CA-C 107.2 -1.408 . . . . 0.0 107.2 173.456 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.474 ' HB1' ' CZ ' ' A' ' 54' ' ' ARG . . . -92.91 -35.22 13.45 Favored 'General case' 0 N--CA 1.506 2.368 0 CA-C-O 118.124 -0.941 . . . . 0.0 109.05 179.028 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.465 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 25.7 tp -71.99 -21.81 61.52 Favored 'General case' 0 N--CA 1.536 3.873 0 N-CA-C 106.232 -1.766 . . . . 0.0 106.232 172.637 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.47 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -68.91 -75.55 0.52 Allowed Glycine 0 C--N 1.374 2.648 0 C-N-CA 125.585 1.564 . . . . 0.0 110.684 177.068 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.4 m -66.97 -26.08 66.64 Favored 'General case' 0 N--CA 1.534 3.757 0 CA-C-O 117.774 -1.108 . . . . 0.0 113.389 -177.518 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.474 ' CZ ' ' HB1' ' A' ' 50' ' ' ALA . 29.2 mtm180 -72.53 -47.06 51.37 Favored 'General case' 0 N--CA 1.532 3.637 0 CA-C-N 120.105 1.321 . . . . 0.0 108.329 178.417 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.6 t -66.77 -18.41 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.978 0 CA-C-N 119.638 1.108 . . . . 0.0 108.839 174.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.3 mtp180 -73.49 -46.81 45.81 Favored 'General case' 0 N--CA 1.528 3.454 0 CA-C-O 117.16 -1.4 . . . . 0.0 111.792 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.531 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -75.24 -23.54 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.733 0 CA-C-N 121.626 2.012 . . . . 0.0 111.304 -179.049 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.67 HG11 HD11 ' B' ' 541' ' ' LEU . 0.0 OUTLIER -83.46 -47.32 18.16 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.261 0 CA-C-N 120.374 1.443 . . . . 0.0 107.59 -179.529 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -63.88 -29.39 70.58 Favored 'General case' 0 N--CA 1.528 3.446 0 N-CA-C 109.435 -0.579 . . . . 0.0 109.435 177.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -88.28 -17.99 29.52 Favored 'General case' 0 N--CA 1.524 3.237 0 CA-C-O 118.084 -0.96 . . . . 0.0 110.549 177.433 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.7 mt -79.93 -40.97 26.99 Favored 'General case' 0 N--CA 1.531 3.58 0 CA-C-N 119.439 1.018 . . . . 0.0 108.342 178.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.2 tt -50.05 -36.94 31.06 Favored 'General case' 1 N--CA 1.543 4.184 0 C-N-CA 124.402 1.081 . . . . 0.0 110.537 178.46 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -80.07 -59.79 2.58 Favored 'General case' 0 N--CA 1.524 3.271 0 N-CA-C 106.824 -1.546 . . . . 0.0 106.824 177.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 57.11 67.59 2.14 Favored Glycine 1 N--CA 1.524 4.506 0 C-N-CA 124.222 0.915 . . . . 0.0 113.264 176.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -130.06 -52.17 1.12 Allowed 'General case' 0 N--CA 1.517 2.921 0 CA-C-N 117.765 0.782 . . . . 0.0 109.027 179.019 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 73.4 mtp -141.86 15.82 2.12 Favored 'General case' 0 N--CA 1.527 3.387 0 C-N-CA 122.895 0.478 . . . . 0.0 111.761 -179.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 5.1 t -115.67 37.37 3.62 Favored 'General case' 0 N--CA 1.531 3.603 0 CA-C-N 119.517 1.053 . . . . 0.0 111.581 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -114.92 -47.07 2.89 Favored 'General case' 0 N--CA 1.518 2.928 0 C-N-CA 124.381 1.072 . . . . 0.0 109.26 178.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -105.21 -55.6 2.3 Favored 'General case' 0 N--CA 1.526 3.342 0 C-N-CA 123.745 0.818 . . . . 0.0 109.555 -179.301 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -69.29 -9.2 52.15 Favored 'General case' 0 N--CA 1.52 3.055 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -178.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.705 HD23 HG21 ' A' ' 82' ' ' ILE . 22.1 tp -69.0 -46.99 66.59 Favored 'General case' 0 N--CA 1.528 3.43 0 CA-C-N 119.526 1.057 . . . . 0.0 111.229 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -41.42 -41.42 2.02 Favored 'General case' 1 N--CA 1.549 4.519 0 N-CA-C 114.555 1.316 . . . . 0.0 114.555 -178.093 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -68.32 -36.14 78.85 Favored 'General case' 0 N--CA 1.538 3.943 0 C-N-CA 122.859 0.464 . . . . 0.0 111.94 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -47.61 -55.99 8.15 Favored 'General case' 0 N--CA 1.535 3.814 0 C-N-CA 124.838 1.255 . . . . 0.0 113.383 -178.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -128.81 -38.87 1.64 Allowed 'General case' 0 N--CA 1.532 3.663 0 CA-C-O 118.621 -0.705 . . . . 0.0 111.68 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 125.3 78.98 0.34 Allowed Glycine 1 N--CA 1.522 4.38 0 CA-C-N 119.181 0.9 . . . . 0.0 111.539 178.81 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.56 104.99 4.11 Favored 'General case' 0 N--CA 1.523 3.204 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 177.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -38.69 168.37 0.01 OUTLIER Glycine 1 N--CA 1.536 5.309 0 C-N-CA 125.576 1.56 . . . . 0.0 116.021 -176.875 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -80.68 -20.37 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.981 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 177.754 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.2 -32.49 73.9 Favored 'General case' 0 N--CA 1.522 3.171 0 CA-C-O 117.797 -1.097 . . . . 0.0 110.158 177.33 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 5.3 p -80.97 -50.17 10.04 Favored 'General case' 0 N--CA 1.536 3.873 0 CA-C-N 119.614 1.097 . . . . 0.0 111.962 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.705 HG21 HD23 ' A' ' 71' ' ' LEU . 0.3 OUTLIER -65.83 -20.73 27.83 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.239 0 CA-C-O 117.831 -1.081 . . . . 0.0 112.888 -178.004 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 46.1 p -107.96 -25.68 11.06 Favored 'General case' 0 N--CA 1.514 2.763 0 CA-C-N 119.794 1.179 . . . . 0.0 111.904 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 14.4 ptt180 -79.28 -21.92 45.4 Favored 'General case' 0 N--CA 1.532 3.633 0 CA-C-N 119.722 1.147 . . . . 0.0 108.3 174.239 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.14 -32.67 69.13 Favored Glycine 0 N--CA 1.513 3.808 0 N-CA-C 110.259 -1.137 . . . . 0.0 110.259 177.266 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 51.5 p -67.88 -35.34 78.33 Favored 'General case' 1 N--CA 1.541 4.082 0 CA-C-N 118.579 1.189 . . . . 0.0 111.084 179.052 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -61.28 -30.53 70.53 Favored 'General case' 1 N--CA 1.541 4.114 0 C-N-CA 123.31 0.644 . . . . 0.0 110.962 179.037 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.3 m -69.0 -38.91 79.56 Favored 'General case' 0 N--CA 1.534 3.746 0 C-N-CA 123.422 0.689 . . . . 0.0 110.46 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 15.5 mt -59.54 -40.43 87.22 Favored 'General case' 0 N--CA 1.528 3.465 0 C-N-CA 124.02 0.928 . . . . 0.0 111.506 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.08 -19.72 54.6 Favored 'General case' 1 N--CA 1.541 4.112 0 CA-C-O 118.309 -0.853 . . . . 0.0 112.682 -179.322 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -96.27 -35.82 11.12 Favored 'General case' 0 N--CA 1.517 2.92 0 CA-C-N 119.179 0.9 . . . . 0.0 111.907 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -48.1 160.77 0.4 Allowed Pre-proline 1 N--CA 1.55 4.568 0 CA-C-O 118.253 -0.88 . . . . 0.0 113.259 -179.126 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -81.77 150.11 16.34 Favored 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 121.996 1.798 . . . . 0.0 109.946 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -84.11 -25.12 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.865 0 CA-C-O 117.817 -1.087 . . . . 0.0 111.24 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -62.83 -39.48 94.48 Favored 'General case' 0 N--CA 1.518 2.967 0 CA-C-N 120.16 1.346 . . . . 0.0 109.881 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.528 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.4 mp -98.08 -16.35 19.62 Favored 'General case' 0 N--CA 1.513 2.723 0 C-N-CA 123.836 0.854 . . . . 0.0 111.438 178.092 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -34.93 79.09 Favored 'General case' 1 N--CA 1.544 4.252 0 N-CA-C 103.458 -2.793 . . . . 0.0 103.458 169.348 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -56.17 -39.9 73.08 Favored 'General case' 0 N--CA 1.508 2.432 0 C-N-CA 124.401 1.08 . . . . 0.0 111.144 175.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.593 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 63.8 t90 -63.39 -34.67 78.23 Favored 'General case' 0 N--CA 1.53 3.548 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 177.696 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.16 -40.85 64.64 Favored 'General case' 0 N--CA 1.539 3.992 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 175.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -67.5 -36.79 81.76 Favored 'General case' 1 N--CA 1.54 4.045 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 175.581 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.476 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 3.0 mt-10 -60.75 -22.8 64.41 Favored 'General case' 1 N--CA 1.542 4.149 0 C-N-CA 123.635 0.774 . . . . 0.0 110.737 176.645 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -121.81 6.67 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.366 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -177.104 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.36 -55.4 2.52 Favored 'General case' 0 N--CA 1.513 2.715 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 176.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.9 tp . . . . . 0 N--CA 1.529 3.489 0 C-N-CA 124.861 1.264 . . . . 0.0 111.68 -179.768 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 . . . . . 0 N--CA 1.524 3.242 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 519' ' ' TRP . . . . . 0.704 ' CE2' HD22 ' A' ' 39' ' ' LEU . 72.1 t-105 -42.69 -29.27 0.29 Allowed 'General case' 1 N--CA 1.546 4.354 0 C-N-CA 124.373 1.069 . . . . 0.0 113.509 179.676 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 520' ' ' LEU . . . . . 0.571 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.4 mm? -94.34 -29.15 15.17 Favored 'General case' 0 N--CA 1.529 3.476 0 CA-C-O 117.769 -1.11 . . . . 0.0 113.863 -172.403 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 37.0 mtm180 -64.26 -23.77 67.42 Favored 'General case' 0 N--CA 1.533 3.686 0 N-CA-C 106.266 -1.753 . . . . 0.0 106.266 171.541 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 522' ' ' PHE . . . . . 0.545 ' O ' HD23 ' B' ' 526' ' ' LEU . 1.9 m-85 -77.61 -38.74 47.46 Favored 'General case' 0 N--CA 1.514 2.739 0 N-CA-C 106.7 -1.593 . . . . 0.0 106.7 173.323 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.75 -24.31 34.08 Favored 'Isoleucine or valine' 1 N--CA 1.551 4.622 0 CA-C-O 116.924 -1.512 . . . . 0.0 112.627 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -77.48 -42.14 36.88 Favored 'General case' 1 N--CA 1.542 4.136 0 CA-C-N 121.463 1.938 . . . . 0.0 108.443 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 525' ' ' LEU . . . . . 0.411 HD12 ' HB ' ' A' ' 103' ' ' VAL . 0.8 OUTLIER -68.79 -28.99 67.26 Favored 'General case' 1 N--CA 1.539 4.003 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 175.473 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' B' B ' 526' ' ' LEU . . . . . 0.545 HD23 ' O ' ' B' ' 522' ' ' PHE . 2.7 mm? -72.25 -32.78 66.99 Favored 'General case' 0 N--CA 1.524 3.243 0 CA-C-O 118.511 -0.757 . . . . 0.0 109.459 177.719 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 31.1 ttmt -71.6 -28.88 64.11 Favored 'General case' 0 N--CA 1.517 2.901 0 CA-C-O 118.388 -0.815 . . . . 0.0 110.641 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -71.71 -35.94 70.37 Favored 'General case' 0 N--CA 1.533 3.702 0 CA-C-N 119.052 0.842 . . . . 0.0 108.98 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 529' ' ' ALA . . . . . 0.593 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -89.44 -9.38 50.4 Favored 'General case' 0 CA--C 1.578 2.028 0 CA-C-O 118.358 -0.829 . . . . 0.0 110.209 178.132 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -82.07 -34.41 29.42 Favored 'General case' 0 N--CA 1.533 3.678 0 CA-C-N 120.411 1.459 . . . . 0.0 108.574 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -61.69 -41.0 96.99 Favored 'General case' 0 N--CA 1.538 3.926 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 177.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 66.2 m-80 -95.42 -88.9 0.25 Allowed 'General case' 0 N--CA 1.514 2.736 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 176.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.8 p30 153.54 49.74 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.062 0 C-N-CA 127.764 2.426 . . . . 0.0 108.228 177.169 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 534' ' ' LEU . . . . . 0.528 HD22 ' CD2' ' A' ' 96' ' ' LEU . 10.0 mt -101.73 2.05 38.09 Favored 'General case' 0 N--CA 1.529 3.523 0 C-N-CA 124.561 1.144 . . . . 0.0 111.197 -179.175 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 535' ' ' HIS . . . . . 0.582 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 56.7 p-80 -80.64 0.48 34.06 Favored 'General case' 0 N--CA 1.511 2.617 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 174.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 536' ' ' LEU . . . . . . . . . . . . . 46.7 mt -93.38 -49.62 0.28 Allowed Pre-proline 0 N--CA 1.509 2.48 0 CA-C-O 116.673 -1.632 . . . . 0.0 109.492 -176.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 537' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -63.16 -36.42 58.13 Favored 'Trans proline' 0 C--N 1.397 3.11 0 N-CA-C 106.539 -2.139 . . . . 0.0 106.539 171.272 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.28 -49.8 74.93 Favored 'General case' 0 N--CA 1.531 3.594 0 C-N-CA 124.21 1.004 . . . . 0.0 109.19 174.767 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 13.2 mt -66.17 -21.54 66.33 Favored 'General case' 1 N--CA 1.54 4.04 0 CA-C-O 118.086 -0.959 . . . . 0.0 112.599 -178.797 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 21.9 t30 -70.77 -12.31 61.47 Favored 'General case' 0 N--CA 1.534 3.752 0 CA-C-N 119.297 0.953 . . . . 0.0 111.514 178.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 541' ' ' LEU . . . . . 0.67 HD11 HG11 ' A' ' 58' ' ' VAL . 0.0 OUTLIER -117.29 -37.4 3.53 Favored 'General case' 0 N--CA 1.52 3.059 0 CA-C-N 119.212 0.914 . . . . 0.0 110.344 -178.662 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 542' ' ' MET . . . . . 0.659 ' N ' HD13 ' B' ' 541' ' ' LEU . 6.7 ptt? -96.95 9.77 41.02 Favored 'General case' 1 N--CA 1.544 4.234 0 CA-C-N 119.618 1.099 . . . . 0.0 112.796 -179.001 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 543' ' ' LEU . . . . . 0.473 ' O ' HG23 ' B' ' 544' ' ' THR . 1.5 tp -132.05 -93.42 0.37 Allowed 'General case' 0 N--CA 1.53 3.547 0 CA-C-N 119.898 1.226 . . . . 0.0 111.995 178.69 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 544' ' ' THR . . . . . 0.473 HG23 ' O ' ' B' ' 543' ' ' LEU . 1.2 p 147.3 135.7 0.0 OUTLIER Pre-proline 1 N--CA 1.566 5.352 0 C-N-CA 127.101 2.161 . . . . 0.0 107.511 -178.875 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -60.15 -33.98 94.61 Favored 'Trans proline' 0 N--CA 1.519 3.01 0 C-N-CA 122.734 2.289 . . . . 0.0 112.137 178.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -64.47 -34.73 78.89 Favored 'General case' 0 N--CA 1.536 3.864 0 CA-C-O 118.856 -0.592 . . . . 0.0 111.651 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -75.5 -29.78 59.62 Favored 'General case' 0 N--CA 1.524 3.259 0 CA-C-O 117.46 -1.257 . . . . 0.0 111.133 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 548' ' ' ARG . . . . . 0.476 ' HB2' ' HB2' ' A' ' 19' ' ' TRP . 32.9 ptt180 -76.3 -24.44 54.37 Favored 'General case' 0 N--CA 1.532 3.627 0 CA-C-N 120.238 1.381 . . . . 0.0 109.152 175.302 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -64.29 -43.25 95.35 Favored 'General case' 0 N--CA 1.536 3.855 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 173.397 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -73.02 -21.66 60.78 Favored 'General case' 0 N--CA 1.517 2.904 0 CA-C-O 117.104 -1.427 . . . . 0.0 110.649 176.447 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 551' ' ' LEU . . . . . 0.681 HD22 ' CZ3' ' A' ' 19' ' ' TRP . 10.9 tp -75.29 -23.39 57.38 Favored 'General case' 0 N--CA 1.521 3.095 0 CA-C-N 120.287 1.403 . . . . 0.0 107.909 174.711 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -73.71 -59.57 4.02 Favored Glycine 0 N--CA 1.499 2.889 0 N-CA-C 108.67 -1.772 . . . . 0.0 108.67 178.381 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 1.7 t -65.17 -26.13 68.03 Favored 'General case' 0 N--CA 1.535 3.813 0 CA-C-N 117.95 0.875 . . . . 0.0 111.363 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 45.7 mtt180 -62.2 -52.99 61.56 Favored 'General case' 1 N--CA 1.543 4.195 0 N-CA-C 107.063 -1.458 . . . . 0.0 107.063 176.227 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 555' ' ' VAL . . . . . 0.488 HG21 ' HB2' ' A' ' 22' ' ' PHE . 18.0 t -71.96 -14.91 17.78 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.547 0 CA-C-O 118.15 -0.929 . . . . 0.0 110.553 178.787 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 76.1 mtt-85 -77.56 -46.76 21.29 Favored 'General case' 0 N--CA 1.527 3.382 0 CA-C-N 119.88 1.218 . . . . 0.0 110.725 178.432 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 557' ' ' ILE . . . . . 0.561 ' O ' HD13 ' B' ' 561' ' ' LEU . 0.0 OUTLIER -72.15 -23.98 22.1 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.669 0 CA-C-N 119.622 1.101 . . . . 0.0 110.524 -177.712 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 558' ' ' VAL . . . . . 0.469 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -87.1 -53.21 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.871 0 CA-C-N 119.943 1.247 . . . . 0.0 107.698 179.941 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -58.56 -24.64 61.21 Favored 'General case' 0 N--CA 1.533 3.675 0 CA-C-O 118.516 -0.754 . . . . 0.0 110.969 178.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -91.25 -27.34 18.51 Favored 'General case' 0 N--CA 1.525 3.282 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.385 178.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 561' ' ' LEU . . . . . 0.561 HD13 ' O ' ' B' ' 557' ' ' ILE . 1.9 mp -69.57 -43.93 71.87 Favored 'General case' 1 N--CA 1.541 4.108 0 CA-C-N 119.409 1.004 . . . . 0.0 109.156 178.775 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 42.7 mt -58.29 -21.62 49.6 Favored 'General case' 0 N--CA 1.537 3.897 0 C-N-CA 123.762 0.825 . . . . 0.0 112.226 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 12.3 mmm180 -80.23 -47.94 13.85 Favored 'General case' 0 N--CA 1.53 3.567 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 67.08 38.57 92.53 Favored Glycine 1 N--CA 1.525 4.613 0 CA-C-O 118.783 -1.009 . . . . 0.0 113.647 177.315 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -97.76 -57.36 2.25 Favored 'General case' 0 N--CA 1.517 2.908 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 178.165 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 16.3 ptt? -170.52 79.52 0.09 Allowed 'General case' 0 N--CA 1.536 3.839 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 178.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 75.7 m -137.4 3.67 2.59 Favored 'General case' 0 N--CA 1.516 2.826 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -176.367 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -88.88 -76.51 0.4 Allowed 'General case' 0 N--CA 1.524 3.247 0 CA-C-N 119.981 1.264 . . . . 0.0 111.583 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.97 -33.85 17.08 Favored 'General case' 0 N--CA 1.532 3.675 0 CA-C-N 118.995 0.816 . . . . 0.0 112.879 -177.536 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -83.49 -3.5 57.67 Favored 'General case' 0 N--CA 1.522 3.138 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -178.204 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 571' ' ' LEU . . . . . 0.684 HD23 HD11 ' B' ' 582' ' ' ILE . 24.2 tp -82.5 -45.47 14.66 Favored 'General case' 0 N--CA 1.53 3.532 0 CA-C-N 119.744 1.156 . . . . 0.0 111.507 -178.761 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -41.43 -32.4 0.32 Allowed 'General case' 1 N--CA 1.55 4.536 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -177.796 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -73.51 -40.34 64.14 Favored 'General case' 0 N--CA 1.532 3.647 0 CA-C-N 118.454 0.57 . . . . 0.0 111.393 -177.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -51.69 -61.56 2.18 Favored 'General case' 0 N--CA 1.53 3.53 0 C-N-CA 123.989 0.916 . . . . 0.0 113.191 -178.269 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -114.77 -50.98 2.76 Favored 'General case' 0 N--CA 1.536 3.827 0 CA-C-N 118.718 0.69 . . . . 0.0 110.934 -179.098 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 130.91 80.3 0.21 Allowed Glycine 1 N--CA 1.518 4.154 0 N-CA-C 109.988 -1.245 . . . . 0.0 109.988 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -136.6 99.77 4.16 Favored 'General case' 0 N--CA 1.52 3.041 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 178.846 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -41.32 168.24 0.01 OUTLIER Glycine 1 N--CA 1.541 5.653 0 C-N-CA 124.952 1.263 . . . . 0.0 115.319 -176.778 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 579' ' ' ILE . . . . . 0.636 HD13 ' CG2' ' B' ' 582' ' ' ILE . 0.6 OUTLIER -80.51 -22.37 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.108 0 CA-C-N 118.273 1.036 . . . . 0.0 108.453 178.625 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -67.08 -39.86 86.87 Favored 'General case' 0 N--CA 1.53 3.561 0 CA-C-N 119.619 1.099 . . . . 0.0 110.139 177.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.33 -39.14 33.51 Favored 'General case' 1 N--CA 1.544 4.248 0 CA-C-N 118.759 0.709 . . . . 0.0 112.027 -179.832 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 582' ' ' ILE . . . . . 0.684 HD11 HD23 ' B' ' 571' ' ' LEU . 2.0 tt -65.53 -36.99 78.95 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.502 0 C-N-CA 123.502 0.721 . . . . 0.0 111.597 -176.2 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 69.9 p -96.92 -31.75 12.4 Favored 'General case' 0 N--CA 1.512 2.672 0 CA-C-O 118.175 -0.917 . . . . 0.0 111.132 -178.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 20.9 ptt180 -70.17 -21.39 63.06 Favored 'General case' 0 N--CA 1.535 3.789 0 CA-C-N 119.613 1.097 . . . . 0.0 109.424 175.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -68.1 -35.36 83.41 Favored Glycine 1 N--CA 1.519 4.21 0 N-CA-C 108.046 -2.022 . . . . 0.0 108.046 174.714 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 5.5 t -61.77 -41.27 97.48 Favored 'General case' 1 N--CA 1.54 4.028 0 CA-C-N 117.701 0.75 . . . . 0.0 110.226 177.094 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -59.65 -23.2 62.84 Favored 'General case' 1 N--CA 1.541 4.099 0 C-N-CA 123.528 0.731 . . . . 0.0 112.157 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 75.3 m -62.12 -46.68 87.96 Favored 'General case' 0 N--CA 1.535 3.797 0 C-N-CA 123.535 0.734 . . . . 0.0 110.828 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 52.3 mt -59.96 -49.41 77.77 Favored 'General case' 0 N--CA 1.524 3.256 0 C-N-CA 124.206 1.002 . . . . 0.0 111.505 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -54.63 -26.31 32.18 Favored 'General case' 1 N--CA 1.547 4.397 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -178.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -86.76 -43.44 12.54 Favored 'General case' 0 N--CA 1.515 2.823 0 CA-C-N 118.395 0.543 . . . . 0.0 110.328 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -57.72 161.8 5.86 Favored Pre-proline 1 N--CA 1.54 4.066 0 CA-C-O 118.247 -0.882 . . . . 0.0 112.545 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -80.08 162.38 23.23 Favored 'Trans proline' 0 C--N 1.378 2.13 0 C-N-CA 121.918 1.745 . . . . 0.0 110.779 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -83.72 -25.87 7.6 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.894 0 CA-C-O 117.471 -1.252 . . . . 0.0 112.077 -178.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -63.6 -41.2 98.35 Favored 'General case' 0 N--CA 1.519 2.993 0 CA-C-N 120.428 1.467 . . . . 0.0 110.398 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 596' ' ' LEU . . . . . 0.483 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.8 mp -98.83 -14.82 19.49 Favored 'General case' 0 N--CA 1.514 2.745 0 C-N-CA 123.557 0.743 . . . . 0.0 111.636 178.454 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -32.42 74.06 Favored 'General case' 1 N--CA 1.542 4.171 0 N-CA-C 102.807 -3.034 . . . . 0.0 102.807 166.8 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -57.12 -36.34 70.54 Favored 'General case' 0 N--CA 1.517 2.875 0 C-N-CA 124.885 1.274 . . . . 0.0 110.796 175.004 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 599' ' ' TRP . . . . . 0.601 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 44.2 t90 -61.13 -36.12 78.9 Favored 'General case' 0 N--CA 1.536 3.872 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 177.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 10.3 mp -56.58 -38.94 72.67 Favored 'General case' 1 N--CA 1.544 4.255 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 176.537 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -68.39 -29.88 68.68 Favored 'General case' 0 N--CA 1.537 3.885 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 175.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 602' ' ' GLU . . . . . 0.419 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.6 OUTLIER -69.14 -26.63 64.98 Favored 'General case' 1 N--CA 1.542 4.142 0 C-N-CA 124.411 1.084 . . . . 0.0 110.595 176.622 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' B' B ' 603' ' ' VAL . . . . . 0.546 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.0 OUTLIER -103.87 -14.33 8.56 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.639 0 CA-C-O 117.85 -1.071 . . . . 0.0 112.262 -175.962 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 7.0 mp -92.13 -57.53 2.68 Favored 'General case' 0 N--CA 1.522 3.156 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 173.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 6.1 mp . . . . . 0 N--CA 1.521 3.105 0 CA-C-O 117.693 -1.146 . . . . 0.0 108.159 177.632 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 . . . . . 0 N--CA 1.527 3.408 0 CA-C-O 118.909 -0.567 . . . . 0.0 112.289 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.535 ' CZ3' HD22 ' B' ' 551' ' ' LEU . 73.0 t-105 -51.18 -43.97 61.43 Favored 'General case' 1 N--CA 1.54 4.074 0 CA-C-N 119.193 0.906 . . . . 0.0 111.215 -178.548 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.473 ' N ' HD22 ' A' ' 20' ' ' LEU . 3.0 mm? -83.77 -23.29 31.58 Favored 'General case' 0 N--CA 1.517 2.893 0 CA-C-O 117.542 -1.218 . . . . 0.0 111.695 -176.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -58.4 -28.74 65.49 Favored 'General case' 0 N--CA 1.536 3.868 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 173.327 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.583 ' CG ' HD21 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -85.5 -36.14 20.73 Favored 'General case' 0 N--CA 1.504 2.232 0 CA-C-O 115.766 -2.064 . . . . 0.0 109.347 174.068 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 48.6 t -71.24 -27.47 29.42 Favored 'Isoleucine or valine' 1 N--CA 1.576 5.833 0 CA-C-N 121.762 2.074 . . . . 0.0 112.754 -175.276 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -77.39 -50.1 13.48 Favored 'General case' 0 N--CA 1.533 3.718 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 179.066 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.416 HD11 ' HB ' ' B' ' 603' ' ' VAL . 0.6 OUTLIER -62.65 -25.45 68.13 Favored 'General case' 0 N--CA 1.539 3.996 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 174.996 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.428 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -70.06 -38.66 75.84 Favored 'General case' 0 N--CA 1.517 2.885 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 178.093 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.1 tttt -64.36 -22.57 67.0 Favored 'General case' 0 N--CA 1.527 3.388 0 CA-C-O 118.452 -0.785 . . . . 0.0 111.049 177.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -72.27 -39.66 68.19 Favored 'General case' 0 N--CA 1.53 3.564 0 CA-C-N 119.003 0.82 . . . . 0.0 108.868 176.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.633 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -91.05 -6.33 54.02 Favored 'General case' 0 N--CA 1.506 2.332 0 CA-C-O 118.573 -0.727 . . . . 0.0 110.793 177.928 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.04 -33.86 26.38 Favored 'General case' 0 N--CA 1.533 3.69 0 CA-C-N 120.41 1.459 . . . . 0.0 109.005 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -65.11 -42.66 93.77 Favored 'General case' 0 N--CA 1.531 3.604 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 176.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 63.3 m-80 -86.87 -89.35 0.12 Allowed 'General case' 0 N--CA 1.516 2.864 0 N-CA-C 106.563 -1.643 . . . . 0.0 106.563 176.397 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 150.54 52.47 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.909 0 C-N-CA 128.013 2.525 . . . . 0.0 107.959 177.4 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.467 HD22 ' CD2' ' B' ' 596' ' ' LEU . 6.9 mt -114.62 11.88 17.07 Favored 'General case' 0 N--CA 1.527 3.384 0 C-N-CA 124.698 1.199 . . . . 0.0 110.245 -178.702 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.52 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 46.8 p-80 -80.61 0.85 32.28 Favored 'General case' 0 N--CA 1.51 2.556 0 C-N-CA 123.505 0.722 . . . . 0.0 109.225 175.634 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.765 ' HA ' HD23 ' A' ' 39' ' ' LEU . 22.4 mt -93.06 -50.82 0.27 Allowed Pre-proline 0 N--CA 1.511 2.592 0 CA-C-O 116.971 -1.49 . . . . 0.0 109.207 -175.785 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.456 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 7.6 Cg_exo -61.34 -35.16 85.46 Favored 'Trans proline' 0 C--N 1.396 3.068 0 N-CA-C 106.425 -2.183 . . . . 0.0 106.425 170.519 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.432 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 2.1 tm? -64.76 -39.21 93.24 Favored 'General case' 0 N--CA 1.512 2.645 0 C-N-CA 124.057 0.943 . . . . 0.0 109.974 176.523 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.765 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -72.08 -22.53 61.35 Favored 'General case' 1 N--CA 1.546 4.372 0 CA-C-N 119.533 1.06 . . . . 0.0 111.791 -179.862 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -96.31 21.82 8.56 Favored 'General case' 1 N--CA 1.539 4.003 0 CA-C-N 119.926 1.239 . . . . 0.0 110.049 176.454 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.614 HD13 ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -127.08 -45.63 1.55 Allowed 'General case' 0 N--CA 1.519 2.993 0 CA-C-O 118.056 -0.973 . . . . 0.0 109.361 179.763 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.614 ' N ' HD13 ' A' ' 41' ' ' LEU . 9.9 ptt? -116.86 11.01 14.32 Favored 'General case' 1 N--CA 1.551 4.618 0 CA-C-N 119.711 1.142 . . . . 0.0 112.32 179.521 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.7 mp -122.86 -94.05 0.5 Allowed 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 177.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 157.31 169.28 0.02 OUTLIER Pre-proline 1 N--CA 1.566 5.358 0 C-N-CA 125.476 1.511 . . . . 0.0 110.041 178.894 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -69.0 -37.73 10.56 Favored 'Trans proline' 0 C--N 1.39 2.735 0 C-N-CA 122.066 1.844 . . . . 0.0 107.586 172.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -66.19 -18.57 65.43 Favored 'General case' 0 N--CA 1.527 3.395 0 CA-C-O 117.942 -1.027 . . . . 0.0 110.895 176.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -71.09 -37.57 72.41 Favored 'General case' 0 N--CA 1.529 3.478 0 CA-C-N 119.613 1.097 . . . . 0.0 108.613 178.112 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -84.91 -15.89 42.96 Favored 'General case' 0 N--CA 1.531 3.582 0 CA-C-O 118.117 -0.944 . . . . 0.0 109.826 175.009 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -73.07 -29.43 62.95 Favored 'General case' 0 N--CA 1.525 3.291 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 173.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.561 ' HB1' ' NH1' ' A' ' 54' ' ' ARG . . . -88.01 -36.28 17.1 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-O 117.918 -1.039 . . . . 0.0 109.725 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.46 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 23.1 tp -69.75 -22.8 63.33 Favored 'General case' 0 N--CA 1.537 3.879 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 173.859 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.439 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -67.47 -73.36 0.67 Allowed Glycine 0 N--CA 1.496 2.7 0 C-N-CA 125.294 1.426 . . . . 0.0 111.277 177.479 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.9 m -72.06 -24.56 61.54 Favored 'General case' 0 N--CA 1.536 3.86 0 CA-C-O 118.144 -0.932 . . . . 0.0 112.785 -177.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.561 ' NH1' ' HB1' ' A' ' 50' ' ' ALA . 76.9 mtm-85 -68.15 -50.27 55.63 Favored 'General case' 0 N--CA 1.531 3.593 0 CA-C-N 120.074 1.306 . . . . 0.0 107.628 177.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 51' ' ' LEU . 11.5 t -65.98 -17.9 23.06 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.823 0 CA-C-O 118.217 -0.897 . . . . 0.0 109.88 177.022 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.7 mtt-85 -69.08 -56.92 6.24 Favored 'General case' 0 N--CA 1.529 3.515 0 CA-C-N 119.741 1.155 . . . . 0.0 111.444 177.456 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.421 HG22 HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -68.9 -25.63 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.757 0 CA-C-N 119.825 1.193 . . . . 0.0 112.087 -177.076 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -83.71 -53.54 11.02 Favored 'Isoleucine or valine' 1 N--CA 1.549 4.517 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 -179.653 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -61.6 -18.73 60.58 Favored 'General case' 0 N--CA 1.527 3.392 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.063 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -96.56 -23.26 16.61 Favored 'General case' 0 N--CA 1.526 3.344 0 CA-C-O 118.174 -0.917 . . . . 0.0 110.305 176.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.6 mt -75.76 -51.74 11.99 Favored 'General case' 0 N--CA 1.534 3.758 0 CA-C-N 119.535 1.062 . . . . 0.0 108.979 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 36.1 mt -54.32 -26.4 29.4 Favored 'General case' 0 N--CA 1.538 3.953 0 C-N-CA 124.163 0.985 . . . . 0.0 113.293 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 30.1 mmm180 -77.86 -45.68 23.58 Favored 'General case' 0 N--CA 1.531 3.584 0 CA-C-N 118.755 0.707 . . . . 0.0 111.278 -178.083 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.15 56.51 2.41 Favored Glycine 0 N--CA 1.515 3.96 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -98.71 -40.27 8.24 Favored 'General case' 0 N--CA 1.526 3.364 0 CA-C-O 118.713 -0.66 . . . . 0.0 110.074 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 76.8 mtp 121.18 69.0 0.0 OUTLIER 'General case' 1 N--CA 1.544 4.264 0 C-N-CA 128.075 2.55 . . . . 0.0 104.997 -178.669 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.419 ' HB3' HD22 ' A' ' 71' ' ' LEU . 23.4 m -117.8 38.48 3.62 Favored 'General case' 0 N--CA 1.52 3.03 0 CA-C-N 115.109 -0.951 . . . . 0.0 110.771 -177.306 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -113.16 -46.38 3.09 Favored 'General case' 0 N--CA 1.521 3.107 0 C-N-CA 123.751 0.82 . . . . 0.0 110.194 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -104.49 -56.59 2.16 Favored 'General case' 0 N--CA 1.528 3.429 0 C-N-CA 123.547 0.739 . . . . 0.0 110.968 -178.144 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -75.28 -0.18 18.73 Favored 'General case' 0 N--CA 1.519 2.983 0 N-CA-C 114.063 1.135 . . . . 0.0 114.063 -176.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.582 HD23 HG21 ' A' ' 82' ' ' ILE . 24.6 tp -85.35 -47.06 10.38 Favored 'General case' 0 N--CA 1.527 3.392 0 CA-C-N 119.906 1.23 . . . . 0.0 112.458 -178.745 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -42.65 -30.58 0.38 Allowed 'General case' 1 N--CA 1.552 4.635 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 -176.739 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -71.86 -41.13 68.44 Favored 'General case' 0 N--CA 1.535 3.793 0 CA-C-N 118.829 0.74 . . . . 0.0 111.234 -178.487 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -47.57 -53.35 14.83 Favored 'General case' 0 N--CA 1.533 3.702 0 C-N-CA 125.078 1.351 . . . . 0.0 113.438 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.1 pp -125.06 -39.67 2.22 Favored 'General case' 0 N--CA 1.536 3.85 0 CA-C-O 118.717 -0.659 . . . . 0.0 111.938 -178.816 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 112.72 64.78 0.47 Allowed Glycine 1 N--CA 1.523 4.487 0 CA-C-N 118.976 0.807 . . . . 0.0 111.621 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -127.48 108.95 11.26 Favored 'General case' 0 N--CA 1.523 3.211 0 N-CA-C 106.047 -1.835 . . . . 0.0 106.047 176.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -34.65 165.37 0.01 OUTLIER Glycine 1 N--CA 1.536 5.356 0 C-N-CA 125.863 1.696 . . . . 0.0 116.658 -176.171 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -78.64 -23.67 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.903 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 177.89 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.85 -34.37 75.85 Favored 'General case' 0 N--CA 1.521 3.076 0 CA-C-O 117.689 -1.148 . . . . 0.0 109.835 177.345 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 17.8 p -74.89 -56.62 4.57 Favored 'General case' 0 N--CA 1.53 3.568 0 CA-C-N 119.342 0.974 . . . . 0.0 111.965 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.582 HG21 HD23 ' A' ' 71' ' ' LEU . 0.5 OUTLIER -62.06 -24.54 34.88 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.173 0 CA-C-O 118.174 -0.917 . . . . 0.0 113.469 -176.829 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 71.9 p -101.07 -26.27 13.76 Favored 'General case' 0 N--CA 1.51 2.567 0 CA-C-O 117.955 -1.021 . . . . 0.0 110.913 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 26.2 ptt180 -75.77 -22.83 56.07 Favored 'General case' 0 N--CA 1.535 3.806 0 CA-C-N 119.82 1.191 . . . . 0.0 108.545 174.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -68.15 -32.22 76.09 Favored Glycine 0 N--CA 1.516 3.979 0 N-CA-C 109.043 -1.623 . . . . 0.0 109.043 175.154 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 6.6 t -63.68 -31.5 72.69 Favored 'General case' 0 N--CA 1.536 3.869 0 CA-C-N 118.18 0.99 . . . . 0.0 110.117 177.063 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -59.65 -33.41 71.5 Favored 'General case' 1 N--CA 1.545 4.291 0 C-N-CA 123.604 0.762 . . . . 0.0 110.311 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.15 -31.98 73.44 Favored 'General case' 0 N--CA 1.538 3.932 0 C-N-CA 123.791 0.837 . . . . 0.0 111.3 179.564 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 38.8 mt -57.26 -44.21 83.7 Favored 'General case' 0 N--CA 1.531 3.619 0 C-N-CA 123.759 0.824 . . . . 0.0 111.232 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -65.99 -20.29 66.14 Favored 'General case' 0 N--CA 1.537 3.921 0 CA-C-O 118.193 -0.908 . . . . 0.0 112.901 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.57 -32.06 18.32 Favored 'General case' 0 N--CA 1.523 3.183 0 CA-C-N 119.323 0.965 . . . . 0.0 113.133 -178.197 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.87 153.23 88.84 Favored Pre-proline 1 N--CA 1.54 4.07 0 CA-C-O 118.087 -0.959 . . . . 0.0 113.527 -178.218 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -87.41 171.59 6.29 Favored 'Trans proline' 0 C--N 1.387 2.576 0 C-N-CA 122.695 2.263 . . . . 0.0 111.084 177.736 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.4 t -87.76 -27.22 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.306 0 CA-C-O 117.803 -1.094 . . . . 0.0 111.216 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -62.14 -41.4 98.23 Favored 'General case' 0 N--CA 1.518 2.942 0 CA-C-N 120.187 1.358 . . . . 0.0 109.598 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.508 ' CD2' HD22 ' B' ' 534' ' ' LEU . 6.8 mp -98.84 -9.96 23.59 Favored 'General case' 0 N--CA 1.507 2.417 0 C-N-CA 123.569 0.748 . . . . 0.0 111.666 178.357 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -35.99 82.75 Favored 'General case' 1 N--CA 1.545 4.298 0 N-CA-C 102.528 -3.138 . . . . 0.0 102.528 166.894 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -52.6 -35.25 53.95 Favored 'General case' 0 N--CA 1.52 3.036 0 C-N-CA 124.316 1.047 . . . . 0.0 111.499 175.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.614 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 43.1 t90 -67.68 -39.26 84.49 Favored 'General case' 0 N--CA 1.53 3.563 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 177.13 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.403 ' O ' HD13 ' A' ' 104' ' ' LEU . 10.4 mp -55.61 -30.13 60.35 Favored 'General case' 0 N--CA 1.536 3.853 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 176.858 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -74.3 -37.79 63.55 Favored 'General case' 0 N--CA 1.532 3.652 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 175.148 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.59 -21.4 65.59 Favored 'General case' 0 N--CA 1.535 3.797 0 CA-C-O 118.325 -0.845 . . . . 0.0 111.581 177.338 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.5 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -119.73 -8.14 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.838 0 CA-C-O 117.884 -1.055 . . . . 0.0 113.247 -176.131 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.403 HD13 ' O ' ' A' ' 100' ' ' LEU . 8.2 mp -105.68 -51.31 3.02 Favored 'General case' 0 N--CA 1.531 3.602 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 176.192 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.0 tt . . . . . 0 N--CA 1.536 3.855 0 C-N-CA 124.141 0.976 . . . . 0.0 110.381 179.678 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 . . . . . 0 N--CA 1.524 3.259 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 519' ' ' TRP . . . . . 0.66 ' CE2' HD22 ' A' ' 39' ' ' LEU . 71.0 t-105 -42.81 -28.33 0.24 Allowed 'General case' 1 N--CA 1.552 4.639 0 C-N-CA 124.388 1.075 . . . . 0.0 113.685 -179.694 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 520' ' ' LEU . . . . . 0.573 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.2 mm? -96.09 -29.92 13.83 Favored 'General case' 0 N--CA 1.527 3.392 0 CA-C-O 117.895 -1.05 . . . . 0.0 113.449 -172.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 23.3 mtp180 -62.23 -26.17 68.23 Favored 'General case' 1 N--CA 1.54 4.055 0 N-CA-C 105.485 -2.043 . . . . 0.0 105.485 171.651 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 522' ' ' PHE . . . . . 0.521 ' O ' HD23 ' B' ' 526' ' ' LEU . 1.8 m-85 -78.11 -39.77 40.33 Favored 'General case' 0 N--CA 1.515 2.8 0 N-CA-C 107.397 -1.334 . . . . 0.0 107.397 174.253 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 37.1 t -66.55 -23.36 31.29 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.259 0 CA-C-N 119.96 1.254 . . . . 0.0 112.493 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -78.01 -52.01 9.45 Favored 'General case' 0 N--CA 1.532 3.654 0 CA-C-N 120.345 1.429 . . . . 0.0 108.19 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 1.2 tp -68.16 -23.04 64.83 Favored 'General case' 0 N--CA 1.53 3.528 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 176.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 526' ' ' LEU . . . . . 0.521 HD23 ' O ' ' B' ' 522' ' ' PHE . 1.7 mm? -71.23 -36.16 71.72 Favored 'General case' 0 N--CA 1.522 3.157 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 176.446 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 527' ' ' LYS . . . . . 0.462 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 27.3 ttmt -66.21 -21.69 66.32 Favored 'General case' 0 N--CA 1.516 2.872 0 CA-C-O 118.383 -0.818 . . . . 0.0 111.003 177.029 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -72.43 -39.41 67.87 Favored 'General case' 0 N--CA 1.53 3.566 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.211 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 529' ' ' ALA . . . . . 0.614 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -91.63 -7.83 48.94 Favored 'General case' 0 N--CA 1.506 2.362 0 CA-C-O 118.317 -0.849 . . . . 0.0 110.802 177.671 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 530' ' ' TYR . . . . . 0.462 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.6 OUTLIER -81.69 -33.06 31.41 Favored 'General case' 0 N--CA 1.531 3.596 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 177.513 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -54.61 -49.31 70.76 Favored 'General case' 0 N--CA 1.536 3.833 0 C-N-CA 124.557 1.143 . . . . 0.0 108.255 176.512 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -93.38 -85.12 0.28 Allowed 'General case' 0 N--CA 1.515 2.816 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 177.642 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.9 p30 153.53 45.83 0.0 OUTLIER 'General case' 1 N--CA 1.559 4.989 0 C-N-CA 127.707 2.403 . . . . 0.0 108.44 177.537 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 534' ' ' LEU . . . . . 0.508 HD22 ' CD2' ' A' ' 96' ' ' LEU . 6.3 mt -103.26 13.31 34.16 Favored 'General case' 0 N--CA 1.518 2.953 0 C-N-CA 124.854 1.262 . . . . 0.0 110.068 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 535' ' ' HIS . . . . . 0.579 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 37.1 p-80 -84.37 4.15 32.63 Favored 'General case' 0 N--CA 1.512 2.657 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 174.763 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 536' ' ' LEU . . . . . 0.455 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 26.9 mt -94.83 -50.79 0.25 Allowed Pre-proline 0 N--CA 1.502 2.128 0 CA-C-O 116.302 -1.809 . . . . 0.0 108.296 -176.205 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 537' ' ' PRO . . . . . 0.455 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 5.7 Cg_exo -67.18 -32.32 34.04 Favored 'Trans proline' 0 C--N 1.4 3.244 0 C-N-CA 122.109 1.873 . . . . 0.0 107.485 170.571 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 538' ' ' LEU . . . . . 0.466 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 0.3 OUTLIER -65.86 -40.21 91.47 Favored 'General case' 0 N--CA 1.528 3.448 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 174.812 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 7.7 mt -67.76 -23.14 65.2 Favored 'General case' 1 N--CA 1.54 4.067 0 CA-C-O 118.289 -0.863 . . . . 0.0 109.965 176.08 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -76.71 -29.03 56.09 Favored 'General case' 0 N--CA 1.523 3.202 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 177.191 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 5.5 tp -70.84 -43.99 67.36 Favored 'General case' 0 N--CA 1.532 3.63 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 177.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -96.96 47.95 1.05 Allowed 'General case' 0 CA--C 1.61 3.251 0 N-CA-C 101.44 -3.541 . . . . 0.0 101.44 171.183 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -29.34 -91.08 0.0 OUTLIER 'General case' 0 N--CA 1.534 3.766 0 C-N-CA 127.698 2.399 . . . . 0.0 116.246 -171.656 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 38.0 p 44.08 85.56 0.16 Allowed Pre-proline 0 N--CA 1.531 3.602 0 C-N-CA 124.988 1.315 . . . . 0.0 112.783 -178.181 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -67.43 -27.89 39.49 Favored 'Trans proline' 0 C--N 1.395 2.994 0 C-N-CA 122.417 2.078 . . . . 0.0 110.032 177.07 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -58.68 -17.45 22.68 Favored 'General case' 0 N--CA 1.538 3.939 0 CA-C-O 118.491 -0.766 . . . . 0.0 111.169 176.744 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -66.55 -49.69 65.62 Favored 'General case' 0 N--CA 1.527 3.423 0 CA-C-N 119.25 0.932 . . . . 0.0 108.819 178.273 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 24.4 ptt-85 -80.55 -11.62 59.63 Favored 'General case' 0 N--CA 1.522 3.165 0 CA-C-O 118.097 -0.954 . . . . 0.0 112.295 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -72.15 -53.58 12.3 Favored 'General case' 0 N--CA 1.534 3.729 0 N-CA-C 106.533 -1.655 . . . . 0.0 106.533 174.671 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -82.91 -12.33 57.45 Favored 'General case' 0 N--CA 1.508 2.459 0 CA-C-O 117.301 -1.333 . . . . 0.0 111.926 178.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 551' ' ' LEU . . . . . 0.583 HD21 ' CG ' ' A' ' 22' ' ' PHE . 18.8 tp -82.2 -31.6 30.28 Favored 'General case' 0 N--CA 1.528 3.443 0 CA-C-N 121.088 1.767 . . . . 0.0 107.69 175.173 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -72.3 -53.66 8.69 Favored Glycine 0 N--CA 1.496 2.69 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 178.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 5.3 m -71.03 -28.41 64.37 Favored 'General case' 0 N--CA 1.534 3.741 0 CA-C-O 117.96 -1.019 . . . . 0.0 111.973 -178.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -68.33 -55.24 12.76 Favored 'General case' 1 N--CA 1.543 4.205 0 N-CA-C 106.546 -1.65 . . . . 0.0 106.546 176.2 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 38.3 t -59.07 -18.61 14.02 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.999 0 CA-C-O 117.937 -1.03 . . . . 0.0 110.428 176.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 5.2 mmm180 -79.81 -44.11 21.18 Favored 'General case' 0 N--CA 1.526 3.356 0 CA-C-O 117.436 -1.269 . . . . 0.0 111.862 178.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 557' ' ' ILE . . . . . 0.456 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -72.72 -20.63 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.569 0 CA-C-N 121.365 1.893 . . . . 0.0 110.715 -179.941 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 558' ' ' VAL . . . . . 0.456 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -88.92 -51.04 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.871 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 -179.584 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -60.0 -23.58 63.77 Favored 'General case' 0 N--CA 1.53 3.569 0 CA-C-O 118.892 -0.575 . . . . 0.0 110.483 177.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -95.93 -23.15 17.0 Favored 'General case' 0 N--CA 1.523 3.191 0 CA-C-O 117.875 -1.059 . . . . 0.0 111.151 178.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 6.1 tp -80.84 -60.04 2.45 Favored 'General case' 0 N--CA 1.529 3.496 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 178.509 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 38.8 mt -39.11 -37.44 0.39 Allowed 'General case' 1 N--CA 1.549 4.482 0 C-N-CA 126.051 1.74 . . . . 0.0 112.415 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 29.6 mmm180 -83.47 -53.41 5.72 Favored 'General case' 0 N--CA 1.519 3.002 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 79.3 54.02 4.2 Favored Glycine 0 N--CA 1.509 3.537 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 178.002 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -83.15 -63.02 1.44 Allowed 'General case' 0 N--CA 1.518 2.954 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 178.235 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 19.0 ttm 176.75 85.29 0.01 OUTLIER 'General case' 1 N--CA 1.539 4.011 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 177.442 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 58.8 m -141.54 36.24 1.65 Allowed 'General case' 0 N--CA 1.518 2.944 0 C-N-CA 122.706 0.403 . . . . 0.0 111.463 -177.164 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -100.4 -47.75 4.8 Favored 'General case' 0 N--CA 1.522 3.157 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 177.858 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 1.9 mmt-85 -107.91 -31.79 7.85 Favored 'General case' 0 N--CA 1.522 3.159 0 C-N-CA 123.787 0.835 . . . . 0.0 112.059 -178.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -92.77 -13.23 29.53 Favored 'General case' 0 N--CA 1.519 2.994 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 -176.47 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 571' ' ' LEU . . . . . 0.784 HD23 HD11 ' B' ' 582' ' ' ILE . 14.5 tp -75.1 -45.7 39.45 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-N 120.644 1.566 . . . . 0.0 111.348 -177.523 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.79 -33.49 16.69 Favored 'General case' 1 N--CA 1.547 4.421 0 CA-C-N 119.71 1.141 . . . . 0.0 113.208 -179.913 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -64.97 -36.06 83.19 Favored 'General case' 1 N--CA 1.541 4.082 0 C-N-CA 122.93 0.492 . . . . 0.0 111.566 -178.707 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -49.2 -57.55 6.54 Favored 'General case' 0 N--CA 1.53 3.546 0 C-N-CA 124.573 1.149 . . . . 0.0 113.141 -178.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -132.96 -38.91 0.97 Allowed 'General case' 0 N--CA 1.534 3.726 0 CA-C-O 118.526 -0.75 . . . . 0.0 111.848 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 130.7 63.67 0.1 OUTLIER Glycine 1 N--CA 1.52 4.271 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 179.484 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -114.81 98.55 6.91 Favored 'General case' 0 N--CA 1.518 2.934 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -42.16 168.82 0.01 OUTLIER Glycine 1 N--CA 1.541 5.645 0 C-N-CA 125.012 1.292 . . . . 0.0 115.493 -176.496 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 579' ' ' ILE . . . . . 0.437 ' HA ' HG22 ' B' ' 582' ' ' ILE . 1.9 mt -83.66 -14.19 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.335 0 CA-C-O 117.61 -1.186 . . . . 0.0 109.002 178.341 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -69.86 -36.63 75.67 Favored 'General case' 0 N--CA 1.525 3.313 0 CA-C-N 120.091 1.314 . . . . 0.0 108.973 175.418 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.1 p -79.49 -36.54 38.51 Favored 'General case' 1 N--CA 1.541 4.109 0 CA-C-N 118.924 0.784 . . . . 0.0 111.825 178.608 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 582' ' ' ILE . . . . . 0.784 HD11 HD23 ' B' ' 571' ' ' LEU . 0.8 OUTLIER -69.66 -36.54 71.0 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.414 0 C-N-CA 123.379 0.672 . . . . 0.0 111.736 -175.643 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 81.4 p -99.57 -28.1 13.38 Favored 'General case' 0 N--CA 1.515 2.777 0 CA-C-O 117.974 -1.012 . . . . 0.0 111.396 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 11.1 ptt180 -75.94 -19.41 58.79 Favored 'General case' 0 N--CA 1.531 3.579 0 CA-C-N 120.081 1.309 . . . . 0.0 108.217 174.089 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -62.03 -36.42 92.87 Favored Glycine 1 N--CA 1.517 4.052 0 N-CA-C 108.645 -1.782 . . . . 0.0 108.645 175.515 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 84.3 p -63.3 -36.84 85.0 Favored 'General case' 0 N--CA 1.537 3.89 0 CA-C-N 117.976 0.888 . . . . 0.0 109.792 176.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -56.75 -32.47 65.62 Favored 'General case' 1 N--CA 1.546 4.361 0 C-N-CA 123.638 0.775 . . . . 0.0 111.535 179.094 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 8.7 m -61.39 -41.11 96.59 Favored 'General case' 1 N--CA 1.542 4.174 0 C-N-CA 123.39 0.676 . . . . 0.0 110.527 179.723 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 51.4 mt -58.93 -45.32 90.66 Favored 'General case' 0 N--CA 1.525 3.286 0 C-N-CA 123.907 0.883 . . . . 0.0 111.11 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? -62.0 -24.49 67.07 Favored 'General case' 1 N--CA 1.539 4.005 0 CA-C-O 118.549 -0.739 . . . . 0.0 112.038 179.501 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -78.16 -40.38 38.06 Favored 'General case' 0 N--CA 1.516 2.84 0 CA-C-N 118.729 0.695 . . . . 0.0 110.755 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -65.28 159.24 67.66 Favored Pre-proline 0 N--CA 1.537 3.918 0 CA-C-O 118.535 -0.745 . . . . 0.0 112.673 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -79.42 179.76 6.1 Favored 'Trans proline' 0 C--N 1.381 2.257 0 C-N-CA 122.105 1.87 . . . . 0.0 110.834 178.187 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.2 t -97.25 -27.03 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.083 0 CA-C-O 117.676 -1.154 . . . . 0.0 111.683 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -63.22 -40.52 97.69 Favored 'General case' 0 N--CA 1.515 2.804 0 CA-C-N 120.045 1.293 . . . . 0.0 110.559 -178.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 596' ' ' LEU . . . . . 0.467 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.9 mp -98.76 -15.84 19.17 Favored 'General case' 0 N--CA 1.51 2.56 0 C-N-CA 123.388 0.675 . . . . 0.0 111.76 178.461 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -29.98 69.44 Favored 'General case' 1 N--CA 1.54 4.058 0 N-CA-C 103.328 -2.841 . . . . 0.0 103.328 168.05 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -54.62 -38.24 66.58 Favored 'General case' 0 N--CA 1.52 3.043 0 C-N-CA 124.099 0.96 . . . . 0.0 110.039 174.111 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 599' ' ' TRP . . . . . 0.633 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 45.1 t90 -63.46 -38.11 89.88 Favored 'General case' 0 N--CA 1.534 3.729 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 176.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.6 -34.87 52.88 Favored 'General case' 1 N--CA 1.541 4.077 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 177.019 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -71.69 -38.32 70.6 Favored 'General case' 1 N--CA 1.54 4.073 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 175.287 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -60.11 -23.21 63.67 Favored 'General case' 1 N--CA 1.542 4.137 0 C-N-CA 123.857 0.863 . . . . 0.0 110.815 176.106 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 603' ' ' VAL . . . . . 0.534 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.1 OUTLIER -115.81 7.11 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.466 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -176.751 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 73.0 mt -118.88 -61.19 1.68 Allowed 'General case' 0 N--CA 1.529 3.519 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.538 3.934 0 C-N-CA 124.691 1.197 . . . . 0.0 111.681 -178.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 . . . . . 0 N--CA 1.528 3.452 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.5 ' HE1' HD22 ' B' ' 536' ' ' LEU . 29.7 t-105 -46.91 -40.55 14.35 Favored 'General case' 0 N--CA 1.533 3.681 0 C-N-CA 125.081 1.353 . . . . 0.0 110.888 176.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -88.41 -26.6 22.06 Favored 'General case' 0 N--CA 1.531 3.582 0 CA-C-O 118.154 -0.927 . . . . 0.0 111.251 -179.058 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.2 mtt-85 -56.17 -20.78 19.27 Favored 'General case' 0 N--CA 1.537 3.89 0 CA-C-N 119.618 1.099 . . . . 0.0 108.138 173.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.519 ' CZ ' HD21 ' A' ' 26' ' ' LEU . 57.4 t80 -96.3 -34.42 11.6 Favored 'General case' 0 N--CA 1.509 2.518 0 CA-C-O 116.799 -1.572 . . . . 0.0 109.2 171.8 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 64.5 t -70.69 -63.26 1.01 Allowed 'Isoleucine or valine' 1 N--CA 1.569 5.515 0 CA-C-N 121.713 2.052 . . . . 0.0 110.81 -177.832 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -55.6 -39.5 70.82 Favored 'General case' 1 N--CA 1.547 4.383 0 CA-C-N 119.006 0.821 . . . . 0.0 110.537 -179.493 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.84 -31.79 72.64 Favored 'General case' 1 N--CA 1.543 4.188 0 C-N-CA 123.081 0.552 . . . . 0.0 109.558 177.17 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.519 HD21 ' CZ ' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -65.97 -34.8 78.93 Favored 'General case' 0 N--CA 1.53 3.545 0 CA-C-O 118.747 -0.644 . . . . 0.0 109.741 177.421 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 54.0 tttt -67.83 -24.67 65.3 Favored 'General case' 0 N--CA 1.526 3.334 0 CA-C-O 118.589 -0.719 . . . . 0.0 111.132 177.099 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -69.61 -43.38 72.86 Favored 'General case' 1 N--CA 1.541 4.083 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 176.396 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.623 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -81.67 -9.6 59.61 Favored 'General case' 0 N--CA 1.501 2.115 0 CA-C-O 118.407 -0.806 . . . . 0.0 110.424 177.834 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.43 ' CE1' HD12 ' A' ' 26' ' ' LEU . 6.4 m-30 -78.74 -34.72 45.58 Favored 'General case' 0 N--CA 1.525 3.281 0 CA-C-N 120.234 1.379 . . . . 0.0 109.448 179.117 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 -62.42 -41.27 98.58 Favored 'General case' 0 N--CA 1.537 3.903 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -92.31 -86.95 0.23 Allowed 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 106.927 -1.509 . . . . 0.0 106.927 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.8 p30 148.59 51.98 0.0 OUTLIER 'General case' 1 N--CA 1.561 5.124 0 C-N-CA 128.387 2.675 . . . . 0.0 107.24 177.559 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.415 HD22 ' CD2' ' B' ' 596' ' ' LEU . 5.4 mt -111.14 11.7 21.9 Favored 'General case' 0 N--CA 1.526 3.371 0 C-N-CA 124.649 1.179 . . . . 0.0 110.858 -177.43 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.542 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 54.6 p-80 -84.09 3.84 32.95 Favored 'General case' 0 N--CA 1.507 2.398 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.765 ' HA ' HD23 ' A' ' 39' ' ' LEU . 20.0 mt -92.16 -50.75 0.29 Allowed Pre-proline 0 N--CA 1.505 2.276 0 CA-C-O 116.868 -1.539 . . . . 0.0 108.348 -176.108 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.459 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 7.3 Cg_exo -62.49 -36.24 66.72 Favored 'Trans proline' 0 C--N 1.395 2.979 0 N-CA-C 106.438 -2.178 . . . . 0.0 106.438 170.3 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.4 -44.02 79.89 Favored 'General case' 0 N--CA 1.528 3.428 0 C-N-CA 123.881 0.872 . . . . 0.0 110.439 175.363 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.765 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -75.68 -28.32 58.63 Favored 'General case' 1 N--CA 1.542 4.126 0 N-CA-C 113.96 1.096 . . . . 0.0 113.96 -176.176 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 30.1 p30 -88.39 6.1 39.02 Favored 'General case' 0 N--CA 1.536 3.853 0 CA-C-N 119.845 1.202 . . . . 0.0 112.36 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.493 ' O ' HD12 ' A' ' 41' ' ' LEU . 0.3 OUTLIER -119.85 -43.74 2.55 Favored 'General case' 0 N--CA 1.519 2.999 0 CA-C-N 118.942 0.792 . . . . 0.0 110.003 -179.511 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -35.76 74.59 Favored 'General case' 0 N--CA 1.534 3.726 0 CA-C-N 119.006 0.821 . . . . 0.0 111.924 -176.746 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.465 ' O ' HG23 ' A' ' 44' ' ' THR . 3.4 tt -135.3 -77.58 0.44 Allowed 'General case' 0 N--CA 1.504 2.271 0 CA-C-O 118.54 -0.743 . . . . 0.0 110.972 179.033 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.465 HG23 ' O ' ' A' ' 43' ' ' LEU . 6.1 p -167.24 172.91 3.3 Favored Pre-proline 1 N--CA 1.55 4.559 0 C-N-CA 124.012 0.925 . . . . 0.0 111.284 -177.707 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -68.68 -18.69 42.33 Favored 'Trans proline' 0 CA--C 1.588 3.207 0 C-N-CA 121.999 1.799 . . . . 0.0 108.761 172.049 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -63.09 -15.39 56.51 Favored 'General case' 0 N--CA 1.529 3.493 0 CA-C-O 118.303 -0.856 . . . . 0.0 111.196 176.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -67.02 -38.62 86.27 Favored 'General case' 0 N--CA 1.53 3.572 0 CA-C-N 119.344 0.975 . . . . 0.0 108.917 177.365 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 19.0 ptt180 -86.26 -14.29 44.24 Favored 'General case' 0 N--CA 1.533 3.696 0 CA-C-O 118.229 -0.891 . . . . 0.0 109.775 174.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -73.38 -27.59 61.56 Favored 'General case' 0 N--CA 1.533 3.679 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 173.157 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.22 -46.59 8.33 Favored 'General case' 0 N--CA 1.509 2.486 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.491 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 18.9 tp -64.01 -23.65 67.41 Favored 'General case' 1 N--CA 1.54 4.054 0 CA-C-N 120.0 1.273 . . . . 0.0 107.714 174.069 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.45 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -67.46 -77.53 0.32 Allowed Glycine 0 N--CA 1.504 3.231 0 C-N-CA 125.449 1.499 . . . . 0.0 111.845 176.669 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.8 m -69.82 -26.66 64.35 Favored 'General case' 0 N--CA 1.538 3.964 0 CA-C-O 118.328 -0.844 . . . . 0.0 113.005 -176.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -70.73 -47.77 58.0 Favored 'General case' 0 N--CA 1.533 3.71 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 178.637 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 22.7 t -65.8 -18.73 24.45 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.168 0 CA-C-N 120.008 1.277 . . . . 0.0 109.373 174.508 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.9 mtp180 -72.58 -46.83 52.38 Favored 'General case' 0 N--CA 1.529 3.515 0 CA-C-O 117.555 -1.212 . . . . 0.0 111.826 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.41 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -74.41 -24.39 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.609 0 CA-C-N 121.147 1.794 . . . . 0.0 111.359 -178.896 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.712 HG11 HD21 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -86.26 -52.46 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.999 0 CA-C-N 120.144 1.338 . . . . 0.0 107.984 -178.382 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -60.2 -30.53 69.43 Favored 'General case' 0 N--CA 1.529 3.522 0 C-N-CA 123.387 0.675 . . . . 0.0 109.796 178.237 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -76.6 -33.53 58.42 Favored 'General case' 0 N--CA 1.529 3.501 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 176.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.7 mp -75.8 -24.84 55.96 Favored 'General case' 0 N--CA 1.529 3.514 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 176.37 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 22.7 mt -76.99 -26.5 53.96 Favored 'General case' 0 N--CA 1.52 3.068 0 C-N-CA 123.774 0.83 . . . . 0.0 109.482 177.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? -77.38 -44.9 27.71 Favored 'General case' 0 N--CA 1.522 3.132 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 179.355 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.67 52.07 6.76 Favored Glycine 1 N--CA 1.516 4.029 0 CA-C-O 119.239 -0.756 . . . . 0.0 111.607 177.762 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -95.19 -42.04 8.77 Favored 'General case' 0 N--CA 1.523 3.223 0 CA-C-N 117.888 0.844 . . . . 0.0 109.519 178.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 5.0 ttt 119.95 82.14 0.0 OUTLIER 'General case' 1 N--CA 1.545 4.288 0 C-N-CA 127.61 2.364 . . . . 0.0 105.309 -179.319 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 19.8 m -139.39 49.13 1.83 Allowed 'General case' 0 N--CA 1.514 2.751 0 CA-C-O 122.036 0.922 . . . . 0.0 110.135 -177.126 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -110.83 -49.13 3.06 Favored 'General case' 0 N--CA 1.52 3.057 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 178.419 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -91.35 -46.63 7.92 Favored 'General case' 0 N--CA 1.522 3.147 0 C-N-CA 123.776 0.83 . . . . 0.0 109.076 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -76.46 -10.47 59.42 Favored 'General case' 0 N--CA 1.518 2.941 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -179.063 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 43.0 tp -83.72 -50.94 7.67 Favored 'General case' 0 N--CA 1.531 3.587 0 CA-C-O 117.591 -1.195 . . . . 0.0 113.325 -177.087 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -37.9 -36.6 0.2 Allowed 'General case' 1 N--CA 1.549 4.506 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 -176.354 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -66.02 -38.32 88.14 Favored 'General case' 1 N--CA 1.542 4.139 0 CA-C-N 118.569 0.622 . . . . 0.0 111.847 -177.752 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -50.65 -34.09 24.97 Favored 'General case' 0 N--CA 1.532 3.66 0 C-N-CA 124.427 1.091 . . . . 0.0 113.675 -178.474 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 pp -151.01 -44.52 0.12 Allowed 'General case' 0 N--CA 1.53 3.558 0 CA-C-N 119.045 0.839 . . . . 0.0 112.108 -179.476 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 114.47 81.68 1.01 Allowed Glycine 1 N--CA 1.517 4.053 0 N-CA-C 110.895 -0.882 . . . . 0.0 110.895 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -106.14 -50.65 3.12 Favored 'General case' 0 N--CA 1.522 3.165 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 177.553 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 119.2 158.58 10.73 Favored Glycine 1 N--CA 1.516 4.001 0 N-CA-C 110.112 -1.195 . . . . 0.0 110.112 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -81.01 -18.53 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.984 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 177.501 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.78 -36.05 77.83 Favored 'General case' 0 N--CA 1.518 2.928 0 CA-C-O 117.658 -1.163 . . . . 0.0 110.111 177.146 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 10.5 p -76.77 -50.82 12.64 Favored 'General case' 0 N--CA 1.534 3.739 0 CA-C-N 119.604 1.093 . . . . 0.0 111.895 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.41 HG22 ' HB ' ' A' ' 57' ' ' ILE . 0.1 OUTLIER -64.7 -28.54 45.05 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.038 0 CA-C-O 118.102 -0.951 . . . . 0.0 113.087 -176.833 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 44.4 p -99.77 -29.13 12.8 Favored 'General case' 0 N--CA 1.515 2.81 0 CA-C-N 119.456 1.025 . . . . 0.0 111.294 -178.441 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.3 ptt180 -73.85 -24.73 59.8 Favored 'General case' 0 N--CA 1.535 3.815 0 CA-C-N 119.651 1.114 . . . . 0.0 108.892 175.181 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.62 -32.32 82.82 Favored Glycine 1 N--CA 1.519 4.196 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 175.662 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 6.4 t -65.77 -42.37 90.92 Favored 'General case' 1 N--CA 1.54 4.028 0 CA-C-N 117.899 0.85 . . . . 0.0 110.126 177.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -64.14 -30.29 71.36 Favored 'General case' 0 N--CA 1.537 3.913 0 C-N-CA 123.395 0.678 . . . . 0.0 111.115 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.2 m -67.57 -38.3 83.89 Favored 'General case' 0 N--CA 1.532 3.654 0 C-N-CA 123.355 0.662 . . . . 0.0 110.576 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 21.5 mt -55.73 -44.89 77.97 Favored 'General case' 0 N--CA 1.53 3.564 0 C-N-CA 124.151 0.981 . . . . 0.0 111.387 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -28.29 69.25 Favored 'General case' 1 N--CA 1.542 4.139 0 CA-C-O 118.786 -0.626 . . . . 0.0 111.442 179.868 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -69.91 -39.95 75.86 Favored 'General case' 0 N--CA 1.52 3.033 0 CA-C-N 118.426 0.557 . . . . 0.0 110.849 179.267 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.44 161.11 6.14 Favored Pre-proline 1 N--CA 1.542 4.127 0 CA-C-O 118.428 -0.796 . . . . 0.0 112.712 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -79.68 156.67 24.55 Favored 'Trans proline' 0 C--N 1.377 2.059 0 C-N-CA 122.077 1.851 . . . . 0.0 110.931 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.6 t -88.8 -27.79 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.096 0 CA-C-O 117.734 -1.127 . . . . 0.0 111.947 -178.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -64.06 -34.93 79.14 Favored 'General case' 0 N--CA 1.516 2.857 0 CA-C-N 120.262 1.392 . . . . 0.0 109.987 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.412 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.1 mp -96.94 -19.61 18.68 Favored 'General case' 0 N--CA 1.51 2.538 0 C-N-CA 123.85 0.86 . . . . 0.0 110.776 177.276 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.29 -33.58 74.93 Favored 'General case' 1 N--CA 1.547 4.387 0 N-CA-C 104.521 -2.399 . . . . 0.0 104.521 169.721 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -51.17 -42.8 61.06 Favored 'General case' 0 N--CA 1.522 3.164 0 C-N-CA 124.535 1.134 . . . . 0.0 110.803 175.652 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.632 ' CZ3' HD21 ' B' ' 538' ' ' LEU . 38.3 t90 -63.18 -36.04 82.3 Favored 'General case' 0 N--CA 1.532 3.662 0 N-CA-C 107.637 -1.246 . . . . 0.0 107.637 177.584 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.43 ' O ' ' HB2' ' A' ' 104' ' ' LEU . 1.5 tt -50.77 -40.9 56.23 Favored 'General case' 0 N--CA 1.537 3.905 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 175.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -69.17 -37.21 78.07 Favored 'General case' 1 N--CA 1.545 4.313 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 176.028 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.501 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 1.3 mm-40 -58.02 -23.23 53.34 Favored 'General case' 1 N--CA 1.545 4.276 0 C-N-CA 123.662 0.785 . . . . 0.0 110.55 175.814 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.564 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.4 OUTLIER -122.39 -0.64 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.314 0 CA-C-O 118.28 -0.867 . . . . 0.0 113.007 -176.924 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 100' ' ' LEU . 0.1 OUTLIER -112.31 -59.04 2.06 Favored 'General case' 0 N--CA 1.517 2.919 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 176.813 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 1 N--CA 1.544 4.225 0 C-N-CA 124.776 1.23 . . . . 0.0 111.714 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 . . . . . 0 N--CA 1.524 3.256 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 519' ' ' TRP . . . . . 0.729 ' CE2' HD22 ' A' ' 39' ' ' LEU . 64.5 t-105 -47.02 -26.67 1.09 Allowed 'General case' 1 N--CA 1.542 4.137 0 C-N-CA 124.261 1.024 . . . . 0.0 112.588 177.056 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 520' ' ' LEU . . . . . 0.599 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.1 mm? -96.13 -28.23 14.68 Favored 'General case' 0 N--CA 1.529 3.494 0 CA-C-O 117.558 -1.21 . . . . 0.0 113.105 -173.276 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 55.4 ttt180 -61.71 -25.45 67.43 Favored 'General case' 1 N--CA 1.542 4.174 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 170.581 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 522' ' ' PHE . . . . . 0.57 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.6 m-85 -77.93 -41.97 34.57 Favored 'General case' 0 N--CA 1.51 2.557 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 174.088 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 86.0 t -65.17 -18.22 23.39 Favored 'Isoleucine or valine' 1 N--CA 1.574 5.775 0 CA-C-N 120.116 1.325 . . . . 0.0 111.918 178.339 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -78.13 -57.06 3.99 Favored 'General case' 0 N--CA 1.534 3.726 0 CA-C-N 120.406 1.457 . . . . 0.0 107.338 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.1 -24.68 67.28 Favored 'General case' 0 N--CA 1.537 3.881 0 O-C-N 123.248 0.343 . . . . 0.0 110.287 175.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 526' ' ' LEU . . . . . 0.492 HD23 ' O ' ' B' ' 522' ' ' PHE . 2.0 mm? -73.06 -36.77 66.94 Favored 'General case' 0 N--CA 1.516 2.868 0 CA-C-O 118.171 -0.918 . . . . 0.0 109.452 178.402 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 3.5 tttt -68.42 -22.89 64.59 Favored 'General case' 0 N--CA 1.528 3.455 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.037 178.304 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -71.91 -44.07 64.3 Favored 'General case' 0 N--CA 1.532 3.647 0 CA-C-N 119.282 0.946 . . . . 0.0 108.809 177.159 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 529' ' ' ALA . . . . . 0.573 ' HB1' ' N ' ' B' ' 535' ' ' HIS . . . -82.13 -13.51 57.12 Favored 'General case' 0 N--CA 1.511 2.575 0 CA-C-O 119.028 -0.51 . . . . 0.0 110.934 178.086 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -78.51 -30.89 47.38 Favored 'General case' 0 N--CA 1.534 3.742 0 CA-C-N 119.566 1.076 . . . . 0.0 109.65 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -66.1 -44.44 84.34 Favored 'General case' 0 N--CA 1.535 3.793 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 177.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -87.76 -90.31 0.12 Allowed 'General case' 0 N--CA 1.515 2.781 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 176.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.1 p30 156.46 50.08 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.831 0 C-N-CA 127.041 2.136 . . . . 0.0 108.667 176.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 534' ' ' LEU . . . . . 0.702 ' O ' HD13 ' B' ' 538' ' ' LEU . 7.8 mt -107.46 5.19 26.99 Favored 'General case' 0 N--CA 1.518 2.961 0 C-N-CA 124.901 1.28 . . . . 0.0 110.569 -178.786 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 535' ' ' HIS . . . . . 0.587 ' HA ' HD22 ' B' ' 538' ' ' LEU . 50.5 p-80 -77.84 3.73 13.62 Favored 'General case' 0 N--CA 1.522 3.132 0 O-C-N 121.824 -0.548 . . . . 0.0 109.6 174.587 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 536' ' ' LEU . . . . . 0.5 HD22 ' HE1' ' A' ' 19' ' ' TRP . 24.5 mt -93.21 -52.57 0.26 Allowed Pre-proline 0 N--CA 1.504 2.264 0 CA-C-O 116.783 -1.58 . . . . 0.0 108.42 -176.055 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 537' ' ' PRO . . . . . 0.476 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 4.8 Cg_exo -60.75 -33.32 93.2 Favored 'Trans proline' 0 C--N 1.397 3.124 0 C-N-CA 122.152 1.901 . . . . 0.0 107.942 171.312 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 538' ' ' LEU . . . . . 0.702 HD13 ' O ' ' B' ' 534' ' ' LEU . 7.5 mp -62.01 -49.06 77.54 Favored 'General case' 0 N--CA 1.536 3.865 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 174.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 29.4 mt -70.74 -11.5 60.98 Favored 'General case' 0 N--CA 1.534 3.757 0 CA-C-O 118.311 -0.852 . . . . 0.0 112.374 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -81.3 -15.74 54.54 Favored 'General case' 0 N--CA 1.52 3.072 0 CA-C-O 118.108 -0.949 . . . . 0.0 110.996 177.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 541' ' ' LEU . . . . . 0.712 HD21 HG11 ' A' ' 58' ' ' VAL . 0.0 OUTLIER -117.68 -30.3 5.5 Favored 'General case' 0 N--CA 1.525 3.325 0 CA-C-N 119.774 1.17 . . . . 0.0 112.497 -177.302 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 542' ' ' MET . . . . . 0.631 ' N ' HD13 ' B' ' 541' ' ' LEU . 4.6 ptt? -101.64 10.87 39.76 Favored 'General case' 1 N--CA 1.544 4.254 0 CA-C-N 120.286 1.403 . . . . 0.0 112.726 -179.233 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 543' ' ' LEU . . . . . 0.414 ' O ' HG23 ' B' ' 544' ' ' THR . 1.3 tt -128.72 -95.77 0.41 Allowed 'General case' 0 N--CA 1.528 3.459 0 CA-C-O 117.477 -1.249 . . . . 0.0 112.372 178.583 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 544' ' ' THR . . . . . 0.414 HG23 ' O ' ' B' ' 543' ' ' LEU . 0.3 OUTLIER 162.75 177.77 0.03 OUTLIER Pre-proline 1 N--CA 1.585 6.319 0 CA-C-N 120.916 1.689 . . . . 0.0 109.549 -176.698 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -57.09 -21.45 42.49 Favored 'Trans proline' 1 N--CA 1.538 4.104 0 C-N-CA 122.31 2.007 . . . . 0.0 111.225 173.377 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -64.46 -0.37 1.31 Allowed 'General case' 0 N--CA 1.532 3.632 0 C-N-CA 123.613 0.765 . . . . 0.0 111.47 175.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -55.45 -79.8 0.02 OUTLIER 'General case' 0 N--CA 1.521 3.112 0 CA-C-O 116.608 -1.663 . . . . 0.0 108.632 178.484 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 25.4 ptt180 -88.07 -8.95 54.76 Favored 'General case' 0 N--CA 1.523 3.198 0 CA-C-N 121.878 2.126 . . . . 0.0 111.976 177.149 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -68.94 -54.88 12.99 Favored 'General case' 0 N--CA 1.534 3.753 0 CA-C-N 120.569 1.532 . . . . 0.0 107.676 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -85.33 -30.24 23.85 Favored 'General case' 0 N--CA 1.513 2.713 0 CA-C-O 117.843 -1.075 . . . . 0.0 111.809 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 551' ' ' LEU . . . . . 0.413 HD23 ' CE3' ' A' ' 19' ' ' TRP . 14.0 tp -67.88 -36.38 80.16 Favored 'General case' 1 N--CA 1.542 4.171 0 CA-C-N 121.136 1.789 . . . . 0.0 109.787 178.385 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -74.38 -55.71 5.47 Favored Glycine 0 N--CA 1.496 2.693 0 CA-C-O 118.642 -1.088 . . . . 0.0 112.563 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.6 m -76.74 -22.59 53.62 Favored 'General case' 1 N--CA 1.543 4.22 0 CA-C-N 118.953 1.377 . . . . 0.0 113.588 -176.034 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -81.14 -41.9 21.74 Favored 'General case' 0 N--CA 1.538 3.941 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 176.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 555' ' ' VAL . . . . . 0.48 HG21 ' HB2' ' A' ' 22' ' ' PHE . 93.1 t -64.49 -18.54 23.36 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.958 0 O-C-N 121.182 -0.949 . . . . 0.0 108.684 173.292 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -76.47 -43.45 39.77 Favored 'General case' 0 N--CA 1.522 3.137 0 CA-C-O 116.958 -1.496 . . . . 0.0 111.657 176.808 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 557' ' ' ILE . . . . . 0.546 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -72.96 -24.01 20.74 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.526 0 CA-C-N 121.938 2.153 . . . . 0.0 110.555 -179.3 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 558' ' ' VAL . . . . . 0.546 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.0 OUTLIER -82.31 -44.24 19.52 Favored 'Isoleucine or valine' 1 N--CA 1.546 4.336 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 -179.806 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -64.02 -28.78 70.04 Favored 'General case' 0 N--CA 1.528 3.463 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -89.51 -19.34 25.16 Favored 'General case' 0 N--CA 1.525 3.291 0 CA-C-O 118.467 -0.778 . . . . 0.0 110.421 177.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 32.5 tp -76.12 -47.17 25.43 Favored 'General case' 0 N--CA 1.532 3.673 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.254 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 1.5 tt -46.98 -33.87 5.07 Favored 'General case' 1 N--CA 1.547 4.385 0 C-N-CA 125.09 1.356 . . . . 0.0 110.972 178.484 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 19.6 mmm180 -81.4 -58.85 2.85 Favored 'General case' 0 N--CA 1.518 2.973 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 178.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 51.67 37.83 43.05 Favored Glycine 1 N--CA 1.535 5.238 0 C-N-CA 124.322 0.963 . . . . 0.0 112.909 178.478 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -99.48 -51.8 3.67 Favored 'General case' 0 N--CA 1.519 2.996 0 CA-C-N 117.777 0.789 . . . . 0.0 109.148 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 8.2 ptt? -157.35 44.48 0.36 Allowed 'General case' 0 N--CA 1.53 3.531 0 CA-C-O 121.659 0.742 . . . . 0.0 109.795 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 28.1 m -135.36 37.72 2.93 Favored 'General case' 0 N--CA 1.517 2.922 0 C-N-CA 123.554 0.742 . . . . 0.0 109.793 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -109.84 -54.85 2.51 Favored 'General case' 0 N--CA 1.514 2.741 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 569' ' ' ARG . . . . . 0.455 ' HA ' HD11 ' B' ' 579' ' ' ILE . 0.1 OUTLIER -97.37 -43.61 7.23 Favored 'General case' 0 N--CA 1.524 3.272 0 C-N-CA 122.957 0.503 . . . . 0.0 110.998 -179.196 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -79.21 -12.59 59.97 Favored 'General case' 0 N--CA 1.523 3.203 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -177.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 571' ' ' LEU . . . . . 0.835 HD23 HD11 ' B' ' 582' ' ' ILE . 17.9 tp -70.81 -44.11 67.25 Favored 'General case' 0 N--CA 1.532 3.669 0 CA-C-N 119.749 1.159 . . . . 0.0 111.493 -178.27 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -40.66 -29.6 0.1 Allowed 'General case' 1 N--CA 1.558 4.939 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -179.64 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -69.68 -48.7 58.79 Favored 'General case' 0 N--CA 1.538 3.958 0 CA-C-N 119.04 0.836 . . . . 0.0 109.336 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -55.3 -39.23 69.67 Favored 'General case' 0 N--CA 1.53 3.537 0 C-N-CA 124.908 1.283 . . . . 0.0 112.609 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 42.0 mt -114.34 -60.32 1.9 Allowed 'General case' 0 N--CA 1.53 3.555 0 C-N-CA 122.88 0.472 . . . . 0.0 111.457 -177.236 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 114.41 28.51 3.0 Favored Glycine 1 N--CA 1.522 4.412 0 CA-C-O 118.495 -1.17 . . . . 0.0 111.307 -178.406 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -101.28 115.94 31.66 Favored 'General case' 0 N--CA 1.517 2.882 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 178.204 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -38.5 166.26 0.01 OUTLIER Glycine 1 N--CA 1.536 5.358 0 C-N-CA 125.303 1.43 . . . . 0.0 115.414 -177.917 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 579' ' ' ILE . . . . . 0.575 ' HA ' HG22 ' B' ' 582' ' ' ILE . 0.6 OUTLIER -79.78 -17.7 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.963 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 177.239 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -65.62 -20.08 66.17 Favored 'General case' 0 N--CA 1.519 3.018 0 CA-C-O 116.996 -1.478 . . . . 0.0 111.192 176.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.2 p -101.59 -35.82 8.99 Favored 'General case' 1 N--CA 1.542 4.152 0 CA-C-N 120.811 1.642 . . . . 0.0 111.208 178.122 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 582' ' ' ILE . . . . . 0.835 HD11 HD23 ' B' ' 571' ' ' LEU . 2.9 tt -66.51 -39.06 83.03 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.565 0 C-N-CA 123.32 0.648 . . . . 0.0 110.575 -177.857 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 583' ' ' THR . . . . . 0.445 HG23 HG23 ' B' ' 582' ' ' ILE . 77.8 p -96.08 -19.58 19.32 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 118.301 -0.857 . . . . 0.0 110.437 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 10.5 ttp180 -64.69 -31.3 72.47 Favored 'General case' 1 N--CA 1.549 4.503 0 N-CA-C 106.688 -1.597 . . . . 0.0 106.688 172.023 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -66.46 -36.96 92.27 Favored Glycine 0 N--CA 1.514 3.835 0 N-CA-C 110.215 -1.154 . . . . 0.0 110.215 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 59.7 p -61.85 -30.14 70.65 Favored 'General case' 1 N--CA 1.55 4.537 0 CA-C-N 118.614 1.207 . . . . 0.0 112.407 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -66.93 -28.8 68.59 Favored 'General case' 0 N--CA 1.539 3.977 0 CA-C-N 118.681 0.673 . . . . 0.0 110.624 178.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 14.9 m -64.04 -34.98 79.25 Favored 'General case' 0 N--CA 1.533 3.721 0 C-N-CA 123.512 0.725 . . . . 0.0 111.692 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 13.4 mt -56.36 -41.73 76.63 Favored 'General case' 0 N--CA 1.536 3.831 0 C-N-CA 123.947 0.899 . . . . 0.0 111.776 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.96 -19.57 65.24 Favored 'General case' 1 N--CA 1.543 4.205 0 CA-C-O 118.359 -0.829 . . . . 0.0 112.787 -179.23 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -108.27 -21.92 12.56 Favored 'General case' 0 N--CA 1.521 3.098 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 -178.298 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -66.36 160.99 62.06 Favored Pre-proline 0 N--CA 1.538 3.972 0 CA-C-N 119.598 1.09 . . . . 0.0 112.424 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -83.82 148.47 12.31 Favored 'Trans proline' 0 C--N 1.379 2.162 0 C-N-CA 122.272 1.981 . . . . 0.0 108.935 178.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -82.91 -28.03 8.12 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.948 0 CA-C-O 117.858 -1.068 . . . . 0.0 112.045 -178.511 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -61.88 -37.8 85.91 Favored 'General case' 0 N--CA 1.519 3.013 0 CA-C-N 120.183 1.356 . . . . 0.0 110.513 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 596' ' ' LEU . . . . . 0.416 ' N ' HD12 ' B' ' 596' ' ' LEU . 6.9 mp -99.84 -17.86 17.43 Favored 'General case' 0 N--CA 1.513 2.679 0 C-N-CA 123.887 0.875 . . . . 0.0 111.269 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.12 -36.65 82.41 Favored 'General case' 1 N--CA 1.545 4.301 0 N-CA-C 103.823 -2.658 . . . . 0.0 103.823 170.022 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -56.92 -39.3 74.21 Favored 'General case' 0 N--CA 1.513 2.714 0 C-N-CA 124.405 1.082 . . . . 0.0 111.79 175.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 599' ' ' TRP . . . . . 0.623 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 63.6 t90 -63.31 -32.76 74.26 Favored 'General case' 0 N--CA 1.531 3.604 0 CA-C-O 117.832 -1.08 . . . . 0.0 108.331 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 46.5 mt -55.3 -37.94 68.0 Favored 'General case' 1 N--CA 1.541 4.077 0 CA-C-N 119.162 0.892 . . . . 0.0 109.167 176.099 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -73.05 -30.31 63.63 Favored 'General case' 0 N--CA 1.529 3.48 0 O-C-N 123.935 0.772 . . . . 0.0 109.532 176.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 602' ' ' GLU . . . . . 0.459 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.6 OUTLIER -65.17 -27.4 68.68 Favored 'General case' 1 N--CA 1.542 4.137 0 C-N-CA 123.928 0.891 . . . . 0.0 110.076 175.495 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' B' B ' 603' ' ' VAL . . . . . 0.511 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.0 OUTLIER -111.21 -4.44 11.01 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.245 0 CA-C-O 118.08 -0.962 . . . . 0.0 112.365 -177.081 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -94.39 -59.68 1.89 Allowed 'General case' 0 N--CA 1.512 2.632 0 N-CA-C 104.349 -2.464 . . . . 0.0 104.349 175.263 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.526 3.367 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 176.4 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 N--CA 1.532 3.664 0 CA-C-O 118.598 -0.715 . . . . 0.0 111.95 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.921 ' CE3' HD22 ' B' ' 551' ' ' LEU . 64.8 t-105 -49.07 -42.53 39.02 Favored 'General case' 0 N--CA 1.527 3.415 0 CA-C-N 119.629 1.104 . . . . 0.0 112.919 -177.801 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.428 ' N ' HD22 ' A' ' 20' ' ' LEU . 2.3 mm? -81.2 -24.7 37.29 Favored 'General case' 0 N--CA 1.528 3.451 0 CA-C-O 117.595 -1.193 . . . . 0.0 112.859 -175.007 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -61.38 -29.53 69.97 Favored 'General case' 0 N--CA 1.532 3.675 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 173.404 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.681 ' CD1' HD21 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -85.24 -29.76 24.39 Favored 'General case' 0 N--CA 1.519 3.004 0 CA-C-O 116.203 -1.856 . . . . 0.0 109.723 174.913 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 86.1 t -72.79 -31.01 34.84 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.239 0 CA-C-N 121.908 2.14 . . . . 0.0 111.315 -177.289 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -73.82 -49.68 24.04 Favored 'General case' 0 N--CA 1.532 3.633 0 CA-C-N 119.335 0.97 . . . . 0.0 108.5 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.0 mp -70.15 -18.56 63.22 Favored 'General case' 0 N--CA 1.531 3.611 0 CA-C-O 119.515 -0.279 . . . . 0.0 110.323 176.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.403 HD22 ' HA ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -73.09 -33.65 65.72 Favored 'General case' 0 N--CA 1.526 3.33 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 175.256 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -64.51 -22.49 66.98 Favored 'General case' 0 N--CA 1.521 3.084 0 CA-C-O 118.502 -0.761 . . . . 0.0 110.849 175.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -72.51 -46.03 56.56 Favored 'General case' 0 N--CA 1.534 3.757 0 CA-C-N 119.114 0.87 . . . . 0.0 108.864 177.271 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.636 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -80.93 -10.09 59.76 Favored 'General case' 0 N--CA 1.51 2.537 0 CA-C-O 118.645 -0.693 . . . . 0.0 110.988 178.554 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -81.01 -34.83 32.6 Favored 'General case' 0 N--CA 1.53 3.565 0 CA-C-N 119.995 1.27 . . . . 0.0 109.061 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -61.4 -40.81 95.74 Favored 'General case' 0 N--CA 1.534 3.757 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 177.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -94.38 -88.66 0.24 Allowed 'General case' 0 N--CA 1.512 2.66 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 177.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.7 p30 151.63 53.32 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.871 0 C-N-CA 127.737 2.415 . . . . 0.0 107.795 177.072 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.498 HD22 ' CD2' ' B' ' 596' ' ' LEU . 4.5 mt -112.91 9.86 18.91 Favored 'General case' 0 N--CA 1.529 3.518 0 C-N-CA 124.176 0.99 . . . . 0.0 111.246 -178.274 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.565 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 53.7 p-80 -82.4 4.57 23.56 Favored 'General case' 0 N--CA 1.516 2.827 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 174.263 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.799 ' HA ' HD23 ' A' ' 39' ' ' LEU . 19.7 mt -93.75 -52.13 0.25 Allowed Pre-proline 0 N--CA 1.511 2.577 0 CA-C-O 116.892 -1.527 . . . . 0.0 108.689 -176.133 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.526 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 3.5 Cg_exo -65.38 -31.07 52.86 Favored 'Trans proline' 0 C--N 1.392 2.839 0 N-CA-C 106.615 -2.11 . . . . 0.0 106.615 170.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.496 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.1 OUTLIER -65.67 -37.95 87.93 Favored 'General case' 0 N--CA 1.522 3.141 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 175.823 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.799 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -73.46 -19.44 60.95 Favored 'General case' 1 N--CA 1.545 4.295 0 CA-C-N 119.826 1.194 . . . . 0.0 111.083 176.708 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 53.1 m-80 -88.56 9.14 24.97 Favored 'General case' 0 N--CA 1.528 3.445 0 CA-C-N 119.099 0.863 . . . . 0.0 110.785 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.655 HD13 ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -127.33 -49.35 1.42 Allowed 'General case' 0 N--CA 1.522 3.14 0 CA-C-N 119.494 1.043 . . . . 0.0 111.188 -178.165 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.655 ' N ' HD13 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -89.53 -18.25 27.01 Favored 'General case' 1 N--CA 1.541 4.118 0 CA-C-N 120.113 1.324 . . . . 0.0 112.182 -178.275 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.513 HD11 HD12 ' B' ' 551' ' ' LEU . 2.2 mp -111.86 -87.69 0.54 Allowed 'General case' 0 N--CA 1.501 2.102 0 CA-C-O 117.833 -1.079 . . . . 0.0 108.294 -179.277 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.506 HG23 ' O ' ' A' ' 43' ' ' LEU . 0.7 OUTLIER 160.33 166.62 0.04 OUTLIER Pre-proline 1 N--CA 1.557 4.883 0 C-N-CA 125.148 1.379 . . . . 0.0 109.452 -179.193 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -68.62 -36.64 14.16 Favored 'Trans proline' 0 N--CA 1.512 2.575 0 C-N-CA 122.322 2.015 . . . . 0.0 107.723 173.53 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -62.52 -23.15 66.81 Favored 'General case' 0 N--CA 1.53 3.561 0 C-N-CA 123.953 0.901 . . . . 0.0 110.533 176.181 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -71.88 -35.54 69.81 Favored 'General case' 0 N--CA 1.521 3.096 0 CA-C-O 117.539 -1.22 . . . . 0.0 109.772 178.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.8 ptt180 -81.04 -19.2 44.37 Favored 'General case' 1 N--CA 1.539 4.001 0 CA-C-N 119.905 1.23 . . . . 0.0 108.519 174.067 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -68.91 -30.95 69.54 Favored 'General case' 0 N--CA 1.528 3.431 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 173.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -88.57 -29.53 19.95 Favored 'General case' 0 N--CA 1.514 2.735 0 CA-C-O 117.739 -1.124 . . . . 0.0 110.74 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 26.7 tp -73.72 -21.26 60.28 Favored 'General case' 1 N--CA 1.539 4.013 0 CA-C-N 120.875 1.67 . . . . 0.0 106.69 173.4 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.43 -67.3 1.9 Allowed Glycine 0 N--CA 1.501 3.021 0 C-N-CA 125.26 1.41 . . . . 0.0 110.768 177.629 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.0 m -67.96 -27.46 66.61 Favored 'General case' 0 N--CA 1.532 3.669 0 CA-C-O 118.102 -0.952 . . . . 0.0 112.366 -178.283 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 17.1 mtm180 -70.52 -48.01 57.63 Favored 'General case' 0 N--CA 1.531 3.581 0 CA-C-N 119.594 1.088 . . . . 0.0 108.526 178.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.405 HG11 ' CD1' ' B' ' 522' ' ' PHE . 34.3 t -67.97 -15.71 20.06 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.074 0 O-C-N 120.742 -1.224 . . . . 0.0 109.618 174.969 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 66.4 mtt-85 -78.25 -42.94 29.64 Favored 'General case' 0 N--CA 1.53 3.557 0 CA-C-N 120.213 1.369 . . . . 0.0 111.565 178.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.403 ' CG2' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -72.17 -24.32 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.6 0 CA-C-N 121.533 1.969 . . . . 0.0 110.379 -179.908 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.499 HG11 HD11 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -86.94 -51.21 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.928 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 -179.549 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -58.86 -25.14 63.01 Favored 'General case' 0 N--CA 1.536 3.851 0 CA-C-O 118.96 -0.543 . . . . 0.0 110.2 177.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -96.62 -20.94 17.94 Favored 'General case' 0 N--CA 1.525 3.32 0 CA-C-O 118.1 -0.953 . . . . 0.0 111.073 178.134 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 5.3 mt -73.56 -55.4 6.35 Favored 'General case' 0 N--CA 1.539 3.978 0 CA-C-N 119.799 1.181 . . . . 0.0 108.232 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 42.4 mt -50.58 -30.92 14.41 Favored 'General case' 1 N--CA 1.543 4.2 0 C-N-CA 124.099 0.96 . . . . 0.0 112.434 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 28.6 mmm180 -82.97 -45.52 14.0 Favored 'General case' 0 N--CA 1.525 3.32 0 CA-C-N 118.213 0.46 . . . . 0.0 110.169 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.68 59.34 5.26 Favored Glycine 1 N--CA 1.522 4.383 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -116.36 -52.64 2.57 Favored 'General case' 0 N--CA 1.521 3.104 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 14.0 ptm -162.92 79.86 0.48 Allowed 'General case' 0 N--CA 1.529 3.516 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 96.1 p -133.87 1.62 3.32 Favored 'General case' 0 N--CA 1.518 2.956 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 -176.035 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -113.93 -63.99 1.37 Allowed 'General case' 0 N--CA 1.532 3.64 0 CA-C-N 120.212 1.369 . . . . 0.0 111.323 -178.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 15.5 mtt180 -103.99 -41.48 5.84 Favored 'General case' 0 N--CA 1.533 3.698 0 CA-C-N 118.525 0.602 . . . . 0.0 110.639 -178.732 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -74.65 -5.79 45.03 Favored 'General case' 0 N--CA 1.515 2.791 0 CA-C-O 118.389 -0.815 . . . . 0.0 112.82 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.533 HD23 HG21 ' A' ' 82' ' ' ILE . 35.2 tp -93.89 -49.5 5.78 Favored 'General case' 0 N--CA 1.527 3.398 0 CA-C-N 120.064 1.302 . . . . 0.0 113.094 -177.505 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -44.94 -29.46 0.83 Allowed 'General case' 1 N--CA 1.546 4.351 0 CA-C-N 120.026 1.284 . . . . 0.0 114.003 -177.54 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 15.9 t30 -80.48 -38.31 30.14 Favored 'General case' 0 N--CA 1.531 3.621 0 CA-C-O 119.02 -0.514 . . . . 0.0 112.022 -178.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -53.37 -58.83 5.71 Favored 'General case' 0 N--CA 1.532 3.655 0 N-CA-C 114.077 1.139 . . . . 0.0 114.077 -177.345 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.95 -39.31 2.73 Favored 'General case' 0 N--CA 1.538 3.948 0 CA-C-N 118.993 0.815 . . . . 0.0 111.808 -178.853 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 125.11 86.05 0.64 Allowed Glycine 1 N--CA 1.523 4.477 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -149.97 104.82 3.33 Favored 'General case' 0 N--CA 1.522 3.146 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 178.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -45.31 169.07 0.03 OUTLIER Glycine 1 N--CA 1.54 5.617 0 C-N-CA 124.268 0.937 . . . . 0.0 114.389 -177.34 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.8 mt -80.35 -13.72 12.98 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.759 0 CA-C-N 119.055 1.427 . . . . 0.0 109.613 179.119 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.38 -37.26 74.51 Favored 'General case' 0 N--CA 1.524 3.249 0 CA-C-N 120.025 1.284 . . . . 0.0 110.491 177.329 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 3.2 p -78.97 -44.88 21.49 Favored 'General case' 0 N--CA 1.535 3.809 0 CA-C-N 119.296 0.953 . . . . 0.0 111.563 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.533 HG21 HD23 ' A' ' 71' ' ' LEU . 8.5 pt -70.41 -14.72 18.41 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.873 0 CA-C-O 117.658 -1.163 . . . . 0.0 114.09 -176.853 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 66.7 p -111.68 -35.78 5.66 Favored 'General case' 0 N--CA 1.517 2.925 0 CA-C-N 120.132 1.333 . . . . 0.0 110.134 178.083 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -70.17 -23.92 63.06 Favored 'General case' 0 N--CA 1.529 3.515 0 CA-C-N 119.04 0.837 . . . . 0.0 109.357 176.153 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.26 -32.66 84.51 Favored Glycine 1 N--CA 1.522 4.38 0 N-CA-C 109.336 -1.505 . . . . 0.0 109.336 175.58 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.7 t -70.46 -34.19 72.14 Favored 'General case' 0 N--CA 1.532 3.65 0 CA-C-N 118.146 0.973 . . . . 0.0 110.467 177.417 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -65.83 -22.78 66.57 Favored 'General case' 0 N--CA 1.535 3.806 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.66 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.1 m -67.38 -37.18 82.76 Favored 'General case' 0 N--CA 1.531 3.624 0 CA-C-N 118.611 0.641 . . . . 0.0 110.539 179.268 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.0 mt -55.12 -51.79 65.32 Favored 'General case' 0 N--CA 1.525 3.31 0 C-N-CA 124.292 1.037 . . . . 0.0 112.362 -179.406 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 6.7 ptpt -68.46 -9.28 47.68 Favored 'General case' 0 N--CA 1.536 3.84 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 -178.495 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.23 -44.81 10.59 Favored 'General case' 0 N--CA 1.521 3.089 0 CA-C-N 119.675 1.125 . . . . 0.0 110.262 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.423 ' HB1' ' HD2' ' A' ' 93' ' ' PRO . . . -56.69 167.03 1.11 Allowed Pre-proline 1 N--CA 1.546 4.374 0 CA-C-O 117.861 -1.066 . . . . 0.0 112.088 179.457 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.423 ' HD2' ' HB1' ' A' ' 92' ' ' ALA . 30.3 Cg_endo -74.31 -179.93 5.23 Favored 'Trans proline' 0 C--N 1.384 2.446 0 C-N-CA 121.055 1.17 . . . . 0.0 110.951 178.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.7 t -102.23 -30.07 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.91 0 CA-C-O 117.506 -1.235 . . . . 0.0 111.683 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -63.02 -40.92 99.21 Favored 'General case' 0 N--CA 1.517 2.907 0 CA-C-N 119.952 1.251 . . . . 0.0 110.839 -177.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.403 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.0 mp -97.84 -20.08 17.73 Favored 'General case' 0 N--CA 1.512 2.649 0 C-N-CA 123.417 0.687 . . . . 0.0 111.445 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.59 -28.63 67.92 Favored 'General case' 0 N--CA 1.536 3.866 0 N-CA-C 103.798 -2.668 . . . . 0.0 103.798 169.562 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -56.76 -39.84 74.76 Favored 'General case' 0 N--CA 1.515 2.822 0 C-N-CA 124.179 0.991 . . . . 0.0 110.046 173.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.634 ' CH2' ' HB2' ' B' ' 529' ' ' ALA . 54.5 t90 -64.66 -34.69 78.89 Favored 'General case' 0 N--CA 1.524 3.267 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.844 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.15 -37.57 47.05 Favored 'General case' 1 N--CA 1.542 4.174 0 CA-C-N 119.279 0.945 . . . . 0.0 108.514 175.589 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -69.11 -40.34 78.41 Favored 'General case' 1 N--CA 1.539 4.021 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 175.727 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.44 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 2.9 mt-10 -58.78 -22.86 59.2 Favored 'General case' 1 N--CA 1.549 4.5 0 C-N-CA 123.499 0.72 . . . . 0.0 111.031 175.893 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.543 ' HB ' HD23 ' B' ' 525' ' ' LEU . 0.0 OUTLIER -116.44 -2.65 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.508 0 CA-C-O 118.193 -0.908 . . . . 0.0 112.056 -176.87 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.31 -57.36 2.28 Favored 'General case' 0 N--CA 1.515 2.814 0 N-CA-C 104.176 -2.527 . . . . 0.0 104.176 174.645 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 47.2 mt . . . . . 0 N--CA 1.535 3.804 0 C-N-CA 124.935 1.294 . . . . 0.0 109.411 175.839 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 . . . . . 0 N--CA 1.527 3.422 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 519' ' ' TRP . . . . . 0.761 ' CE2' HD22 ' A' ' 39' ' ' LEU . 60.7 t-105 -44.33 -26.32 0.32 Allowed 'General case' 1 N--CA 1.551 4.603 0 C-N-CA 124.188 0.995 . . . . 0.0 113.236 178.216 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 520' ' ' LEU . . . . . 0.539 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.4 mm? -95.39 -32.18 13.05 Favored 'General case' 0 N--CA 1.523 3.212 0 CA-C-O 117.655 -1.164 . . . . 0.0 113.815 -172.257 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 521' ' ' ARG . . . . . 0.449 ' HG2' HH11 ' B' ' 521' ' ' ARG . 10.7 tpt180 -63.83 -23.28 67.29 Favored 'General case' 0 N--CA 1.529 3.495 0 N-CA-C 106.047 -1.834 . . . . 0.0 106.047 172.403 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 522' ' ' PHE . . . . . 0.505 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.7 m-85 -77.93 -42.06 34.33 Favored 'General case' 0 N--CA 1.505 2.302 0 N-CA-C 106.555 -1.646 . . . . 0.0 106.555 174.082 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 523' ' ' VAL . . . . . 0.486 HG23 ' O ' ' B' ' 519' ' ' TRP . 79.0 t -67.34 -20.27 26.41 Favored 'Isoleucine or valine' 1 N--CA 1.563 5.194 0 CA-C-O 117.665 -1.159 . . . . 0.0 112.374 179.008 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -77.15 -54.39 6.58 Favored 'General case' 0 N--CA 1.533 3.713 0 CA-C-N 120.37 1.441 . . . . 0.0 108.43 -178.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 525' ' ' LEU . . . . . 0.543 HD23 ' HB ' ' A' ' 103' ' ' VAL . 5.1 mp -70.96 -17.42 62.66 Favored 'General case' 0 N--CA 1.527 3.416 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 175.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 526' ' ' LEU . . . . . 0.464 ' HB2' ' HA ' ' B' ' 523' ' ' VAL . 0.6 OUTLIER -69.08 -38.32 78.95 Favored 'General case' 0 N--CA 1.516 2.828 0 N-CA-C 107.162 -1.421 . . . . 0.0 107.162 175.153 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 527' ' ' LYS . . . . . 0.712 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 8.4 tptm -68.85 -19.9 64.27 Favored 'General case' 0 N--CA 1.516 2.87 0 CA-C-O 118.029 -0.986 . . . . 0.0 111.473 176.944 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -66.95 -38.56 86.36 Favored 'General case' 1 N--CA 1.541 4.122 0 CA-C-N 119.798 1.181 . . . . 0.0 108.325 174.828 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 529' ' ' ALA . . . . . 0.634 ' HB2' ' CH2' ' A' ' 99' ' ' TRP . . . -89.37 -14.35 35.77 Favored 'General case' 0 N--CA 1.504 2.272 0 CA-C-O 118.52 -0.752 . . . . 0.0 111.012 177.723 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 530' ' ' TYR . . . . . 0.712 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.7 OUTLIER -75.9 -32.02 59.46 Favored 'General case' 0 N--CA 1.538 3.974 0 CA-C-N 120.098 1.317 . . . . 0.0 109.683 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -65.09 -44.24 89.5 Favored 'General case' 0 N--CA 1.534 3.755 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 177.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -90.63 -87.47 0.19 Allowed 'General case' 0 N--CA 1.518 2.928 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 177.319 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.8 p30 152.71 52.88 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.827 0 C-N-CA 127.406 2.282 . . . . 0.0 108.025 177.222 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 534' ' ' LEU . . . . . 0.403 HD22 ' CD2' ' A' ' 96' ' ' LEU . 5.6 mt -111.45 9.38 21.37 Favored 'General case' 0 N--CA 1.529 3.485 0 C-N-CA 124.718 1.207 . . . . 0.0 110.858 -178.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 535' ' ' HIS . . . . . 0.593 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 47.9 p-80 -83.82 1.66 41.98 Favored 'General case' 0 N--CA 1.517 2.879 0 C-N-CA 123.501 0.72 . . . . 0.0 109.499 175.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 536' ' ' LEU . . . . . 0.461 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 42.8 mt -95.17 -51.01 0.24 Allowed Pre-proline 0 N--CA 1.497 1.878 0 CA-C-O 116.507 -1.711 . . . . 0.0 108.488 -176.349 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 537' ' ' PRO . . . . . 0.461 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 4.5 Cg_exo -66.94 -33.73 31.91 Favored 'Trans proline' 0 C--N 1.394 2.943 0 N-CA-C 107.51 -1.765 . . . . 0.0 107.51 172.096 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.16 -44.14 93.04 Favored 'General case' 0 N--CA 1.522 3.165 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 175.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 43.3 mt -76.5 -11.38 59.87 Favored 'General case' 0 N--CA 1.535 3.804 0 CA-C-O 118.183 -0.913 . . . . 0.0 112.41 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -83.96 -0.66 52.41 Favored 'General case' 0 N--CA 1.526 3.343 0 CA-C-N 119.56 1.073 . . . . 0.0 109.428 174.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 541' ' ' LEU . . . . . 0.617 HD13 ' N ' ' B' ' 542' ' ' MET . 0.0 OUTLIER -114.46 -50.09 2.81 Favored 'General case' 0 N--CA 1.51 2.536 0 C-N-CA 124.979 1.312 . . . . 0.0 108.416 -179.312 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 542' ' ' MET . . . . . 0.617 ' N ' HD13 ' B' ' 541' ' ' LEU . 4.7 ptm -95.85 7.55 46.02 Favored 'General case' 0 N--CA 1.534 3.738 0 CA-C-O 118.266 -0.874 . . . . 0.0 112.89 -178.746 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 543' ' ' LEU . . . . . 0.43 ' O ' HG23 ' B' ' 544' ' ' THR . 0.2 OUTLIER -130.39 -102.14 0.3 Allowed 'General case' 0 N--CA 1.531 3.612 0 CA-C-N 120.274 1.397 . . . . 0.0 113.187 -179.576 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 544' ' ' THR . . . . . 0.43 HG23 ' O ' ' B' ' 543' ' ' LEU . 0.3 OUTLIER 165.04 156.38 0.08 OUTLIER Pre-proline 1 N--CA 1.571 5.621 0 CA-C-N 121.425 1.921 . . . . 0.0 110.562 -178.118 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -74.11 -45.7 0.35 Allowed 'Trans proline' 0 C--N 1.388 2.615 0 C-N-CA 123.194 2.596 . . . . 0.0 110.076 177.183 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -56.33 -28.22 58.3 Favored 'General case' 1 N--CA 1.54 4.037 0 CA-C-O 118.759 -0.639 . . . . 0.0 112.025 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -75.61 -34.66 60.6 Favored 'General case' 0 N--CA 1.524 3.228 0 CA-C-O 117.766 -1.111 . . . . 0.0 110.927 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 9.5 ptt-85 -71.95 -28.55 63.53 Favored 'General case' 0 N--CA 1.534 3.768 0 CA-C-N 119.902 1.228 . . . . 0.0 109.909 177.279 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -64.29 -48.61 75.02 Favored 'General case' 1 N--CA 1.54 4.048 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 175.367 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -76.83 -8.91 58.22 Favored 'General case' 0 N--CA 1.52 3.064 0 CA-C-O 118.155 -0.926 . . . . 0.0 111.398 177.48 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 551' ' ' LEU . . . . . 0.921 HD22 ' CE3' ' A' ' 19' ' ' TRP . 4.2 tp -78.88 -40.38 32.54 Favored 'General case' 0 N--CA 1.519 3.02 0 CA-C-N 120.141 1.337 . . . . 0.0 108.143 176.664 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -73.85 -42.47 38.18 Favored Glycine 0 N--CA 1.513 3.797 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 3.3 m -71.38 -35.45 71.09 Favored 'General case' 0 N--CA 1.532 3.633 0 CA-C-N 117.612 0.706 . . . . 0.0 110.878 -178.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -67.54 -45.68 74.98 Favored 'General case' 0 N--CA 1.537 3.883 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 177.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 555' ' ' VAL . . . . . 0.471 HG23 ' O ' ' B' ' 551' ' ' LEU . 44.0 t -66.55 -17.87 23.22 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.059 0 CA-C-O 117.703 -1.141 . . . . 0.0 109.622 175.897 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -81.83 -40.08 23.03 Favored 'General case' 0 N--CA 1.519 2.985 0 CA-C-O 116.943 -1.503 . . . . 0.0 111.703 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 557' ' ' ILE . . . . . 0.448 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -73.02 -23.82 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.31 0 CA-C-N 122.277 2.308 . . . . 0.0 109.955 179.057 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 558' ' ' VAL . . . . . 0.554 HG11 HD11 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -85.56 -48.0 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.981 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 179.626 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -61.93 -22.46 65.63 Favored 'General case' 0 N--CA 1.532 3.626 0 CA-C-O 118.801 -0.619 . . . . 0.0 109.856 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -87.79 -29.98 20.59 Favored 'General case' 0 N--CA 1.522 3.159 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.644 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 13.5 mt -66.4 -46.58 76.1 Favored 'General case' 1 N--CA 1.542 4.144 0 CA-C-N 118.9 0.773 . . . . 0.0 109.305 178.653 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 33.1 mt -54.41 -27.02 33.95 Favored 'General case' 0 N--CA 1.537 3.906 0 C-N-CA 123.685 0.794 . . . . 0.0 111.762 178.651 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 1.9 mmm-85 -79.78 -52.07 8.39 Favored 'General case' 0 N--CA 1.526 3.348 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 59.62 72.07 0.67 Allowed Glycine 1 N--CA 1.527 4.728 0 CA-C-O 119.341 -0.699 . . . . 0.0 112.833 178.001 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -145.76 -56.31 0.3 Allowed 'General case' 0 N--CA 1.525 3.305 0 N-CA-C 108.558 -0.905 . . . . 0.0 108.558 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 46.2 mtt -144.59 61.41 1.33 Allowed 'General case' 0 N--CA 1.526 3.363 0 N-CA-C 106.174 -1.787 . . . . 0.0 106.174 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 65.0 m -131.12 4.26 4.41 Favored 'General case' 0 N--CA 1.52 3.027 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -175.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -96.03 -80.15 0.43 Allowed 'General case' 0 N--CA 1.524 3.241 0 CA-C-N 119.81 1.186 . . . . 0.0 110.28 -179.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.62 -34.3 11.0 Favored 'General case' 0 N--CA 1.539 3.996 0 CA-C-N 119.578 1.081 . . . . 0.0 111.515 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -70.45 -10.1 58.25 Favored 'General case' 0 N--CA 1.518 2.971 0 CA-C-O 118.358 -0.83 . . . . 0.0 112.793 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 571' ' ' LEU . . . . . 0.768 HD23 HD11 ' B' ' 582' ' ' ILE . 14.8 tp -89.6 -43.67 10.61 Favored 'General case' 0 N--CA 1.527 3.395 0 CA-C-N 119.767 1.167 . . . . 0.0 111.106 -178.528 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -38.48 -32.31 0.07 Allowed 'General case' 1 N--CA 1.558 4.939 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 -178.96 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -74.27 -46.95 38.08 Favored 'General case' 0 N--CA 1.529 3.507 0 CA-C-N 118.183 0.447 . . . . 0.0 110.278 -179.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -46.81 -45.8 20.31 Favored 'General case' 0 N--CA 1.534 3.769 0 C-N-CA 124.94 1.296 . . . . 0.0 113.891 -178.5 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 1.8 pp -132.39 -44.04 0.93 Allowed 'General case' 0 N--CA 1.535 3.813 0 CA-C-N 118.68 0.673 . . . . 0.0 112.067 -178.389 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 109.69 81.65 1.28 Allowed Glycine 1 N--CA 1.525 4.603 0 N-CA-C 110.975 -0.85 . . . . 0.0 110.975 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -111.06 -50.99 2.9 Favored 'General case' 0 N--CA 1.522 3.161 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 114.16 163.36 14.74 Favored Glycine 1 N--CA 1.528 4.787 0 N-CA-C 110.219 -1.152 . . . . 0.0 110.219 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 579' ' ' ILE . . . . . 0.432 HD13 ' CG2' ' B' ' 582' ' ' ILE . 0.6 OUTLIER -82.9 -21.02 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.377 0 CA-C-N 119.54 1.67 . . . . 0.0 108.229 177.828 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -68.88 -54.58 14.78 Favored 'General case' 0 N--CA 1.519 2.979 0 CA-C-N 119.578 1.081 . . . . 0.0 109.57 177.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -69.26 -36.75 77.43 Favored 'General case' 1 N--CA 1.539 4.018 0 CA-C-N 118.662 0.665 . . . . 0.0 112.699 -179.026 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 582' ' ' ILE . . . . . 0.768 HD11 HD23 ' B' ' 571' ' ' LEU . 2.1 tt -64.3 -38.18 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.874 0 CA-C-N 118.543 0.61 . . . . 0.0 110.682 -177.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 80.6 p -98.98 -8.75 24.97 Favored 'General case' 0 N--CA 1.509 2.499 0 CA-C-O 118.604 -0.712 . . . . 0.0 111.023 178.004 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 10.3 ttp180 -72.95 -36.95 67.26 Favored 'General case' 0 N--CA 1.538 3.934 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 174.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -63.32 -38.44 96.44 Favored Glycine 1 N--CA 1.52 4.288 0 N-CA-C 109.075 -1.61 . . . . 0.0 109.075 176.606 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 19.6 m -58.75 -41.23 86.03 Favored 'General case' 1 N--CA 1.543 4.186 0 C-N-CA 123.217 0.607 . . . . 0.0 111.196 178.336 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -63.39 -32.47 73.9 Favored 'General case' 1 N--CA 1.539 4.009 0 C-N-CA 123.268 0.627 . . . . 0.0 111.026 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 15.7 m -68.2 -42.05 80.46 Favored 'General case' 0 N--CA 1.534 3.735 0 C-N-CA 123.059 0.544 . . . . 0.0 109.833 178.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 22.1 mt -58.9 -41.06 86.32 Favored 'General case' 0 N--CA 1.53 3.535 0 C-N-CA 124.387 1.075 . . . . 0.0 111.601 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -65.62 -27.08 68.13 Favored 'General case' 0 N--CA 1.539 3.979 0 CA-C-O 118.575 -0.726 . . . . 0.0 112.427 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -95.49 -25.0 16.4 Favored 'General case' 0 N--CA 1.523 3.195 0 CA-C-O 118.524 -0.751 . . . . 0.0 112.606 -179.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -61.59 164.31 9.78 Favored Pre-proline 0 N--CA 1.537 3.903 0 CA-C-N 119.132 0.878 . . . . 0.0 111.758 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -77.48 146.91 24.88 Favored 'Trans proline' 0 C--N 1.381 2.26 0 C-N-CA 121.751 1.634 . . . . 0.0 108.84 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 594' ' ' VAL . . . . . 0.511 ' HA ' ' HB3' ' B' ' 597' ' ' ARG . 2.8 t -80.95 -25.55 10.78 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.826 0 CA-C-O 117.514 -1.232 . . . . 0.0 112.64 -177.166 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -63.74 -38.42 91.02 Favored 'General case' 0 N--CA 1.519 3.003 0 CA-C-N 120.386 1.448 . . . . 0.0 110.783 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 596' ' ' LEU . . . . . 0.498 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.8 mp -99.68 -18.01 17.49 Favored 'General case' 0 N--CA 1.513 2.689 0 C-N-CA 123.958 0.903 . . . . 0.0 111.064 179.016 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 597' ' ' ARG . . . . . 0.511 ' HB3' ' HA ' ' B' ' 594' ' ' VAL . 0.0 OUTLIER -63.66 -32.49 73.99 Favored 'General case' 1 N--CA 1.547 4.376 0 N-CA-C 103.635 -2.728 . . . . 0.0 103.635 168.69 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -59.19 -38.77 80.65 Favored 'General case' 0 N--CA 1.521 3.116 0 C-N-CA 125.081 1.352 . . . . 0.0 110.835 174.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 599' ' ' TRP . . . . . 0.636 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 48.0 t90 -59.4 -34.48 72.5 Favored 'General case' 0 N--CA 1.535 3.776 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.464 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 75.6 mt -52.91 -39.86 63.1 Favored 'General case' 0 N--CA 1.539 3.998 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 177.036 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -70.73 -33.31 70.71 Favored 'General case' 0 N--CA 1.529 3.478 0 O-C-N 123.927 0.767 . . . . 0.0 109.399 176.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -61.71 -23.68 66.28 Favored 'General case' 1 N--CA 1.546 4.374 0 C-N-CA 123.473 0.709 . . . . 0.0 109.858 174.357 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 603' ' ' VAL . . . . . 0.508 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.1 OUTLIER -117.7 10.47 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.708 0 C-N-CA 123.766 0.826 . . . . 0.0 112.352 -177.97 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -115.36 -57.82 2.2 Favored 'General case' 0 N--CA 1.512 2.634 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 177.334 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 4.9 tt . . . . . 0 N--CA 1.539 3.996 0 C-N-CA 125.281 1.432 . . . . 0.0 111.689 179.991 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 . . . . . 0 N--CA 1.519 2.988 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.688 ' O ' HG23 ' A' ' 23' ' ' VAL . 71.2 t-105 -52.31 -25.19 8.93 Favored 'General case' 0 N--CA 1.538 3.931 0 CA-C-O 118.083 -0.961 . . . . 0.0 111.794 177.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.52 ' N ' HD22 ' A' ' 20' ' ' LEU . 2.6 mm? -90.2 -30.76 17.38 Favored 'General case' 0 N--CA 1.53 3.573 0 CA-C-O 118.253 -0.88 . . . . 0.0 112.153 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.06 -27.47 68.92 Favored 'General case' 0 N--CA 1.534 3.735 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 173.452 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -88.28 -28.5 21.04 Favored 'General case' 0 N--CA 1.511 2.62 0 CA-C-O 116.359 -1.782 . . . . 0.0 108.245 174.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.688 HG23 ' O ' ' A' ' 19' ' ' TRP . 69.5 t -72.15 -22.89 21.26 Favored 'Isoleucine or valine' 1 N--CA 1.567 5.393 0 CA-C-N 122.241 2.291 . . . . 0.0 111.045 179.286 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -77.93 -51.46 10.37 Favored 'General case' 0 N--CA 1.53 3.536 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 178.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.61 -27.79 69.48 Favored 'General case' 0 N--CA 1.536 3.83 0 O-C-N 123.267 0.354 . . . . 0.0 110.609 176.555 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.95 -33.25 63.84 Favored 'General case' 0 N--CA 1.524 3.274 0 CA-C-O 118.214 -0.898 . . . . 0.0 109.033 177.628 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.421 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 13.4 mttt -68.98 -24.09 64.19 Favored 'General case' 0 N--CA 1.524 3.261 0 CA-C-O 118.378 -0.82 . . . . 0.0 110.74 177.597 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -73.44 -43.32 60.61 Favored 'General case' 0 N--CA 1.533 3.722 0 CA-C-N 119.166 0.894 . . . . 0.0 108.893 177.21 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.639 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -85.85 -8.64 57.94 Favored 'General case' 0 N--CA 1.508 2.463 0 CA-C-O 118.314 -0.85 . . . . 0.0 110.71 178.089 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.421 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 1.4 m-85 -80.16 -27.45 39.0 Favored 'General case' 0 N--CA 1.53 3.55 0 CA-C-N 120.032 1.287 . . . . 0.0 107.672 177.526 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -62.53 -48.84 77.76 Favored 'General case' 0 N--CA 1.531 3.602 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 176.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -91.82 -89.92 0.18 Allowed 'General case' 0 N--CA 1.514 2.738 0 N-CA-C 106.29 -1.744 . . . . 0.0 106.29 177.284 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 p30 156.18 50.16 0.0 OUTLIER 'General case' 1 N--CA 1.555 4.805 0 C-N-CA 127.489 2.316 . . . . 0.0 107.809 177.493 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.433 HD22 ' CD2' ' B' ' 596' ' ' LEU . 8.7 mt -107.05 10.36 30.29 Favored 'General case' 0 N--CA 1.53 3.525 0 C-N-CA 124.644 1.178 . . . . 0.0 110.606 -178.614 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.543 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 42.2 p-80 -85.06 5.14 30.8 Favored 'General case' 0 N--CA 1.507 2.38 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 175.3 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.803 ' HA ' HD23 ' A' ' 39' ' ' LEU . 26.5 mt -93.95 -51.47 0.26 Allowed Pre-proline 0 N--CA 1.506 2.361 0 CA-C-O 116.8 -1.572 . . . . 0.0 108.773 -176.13 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.487 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 4.0 Cg_exo -65.57 -34.5 41.96 Favored 'Trans proline' 0 C--N 1.397 3.13 0 N-CA-C 106.1 -2.308 . . . . 0.0 106.1 170.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.543 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.3 OUTLIER -63.27 -37.7 88.26 Favored 'General case' 0 N--CA 1.518 2.938 0 C-N-CA 124.078 0.951 . . . . 0.0 109.337 176.363 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.803 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -71.43 -25.89 62.51 Favored 'General case' 1 N--CA 1.551 4.579 0 CA-C-N 120.06 1.3 . . . . 0.0 110.186 176.945 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -72.36 -19.28 61.65 Favored 'General case' 0 N--CA 1.526 3.354 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.366 177.705 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.5 pp -101.48 -46.32 5.02 Favored 'General case' 0 N--CA 1.53 3.527 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 -177.185 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 6.2 ptp -105.23 -2.29 24.28 Favored 'General case' 1 N--CA 1.54 4.05 0 CA-C-O 117.994 -1.003 . . . . 0.0 112.332 -176.259 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.43 -87.01 0.53 Allowed 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 117.843 -1.075 . . . . 0.0 109.065 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 154.55 163.4 0.0 OUTLIER Pre-proline 1 N--CA 1.564 5.256 0 C-N-CA 125.71 1.604 . . . . 0.0 109.888 179.672 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -71.84 -36.59 6.02 Favored 'Trans proline' 0 C--N 1.383 2.36 0 C-N-CA 122.827 2.351 . . . . 0.0 108.033 173.402 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -70.43 -16.61 62.96 Favored 'General case' 0 N--CA 1.525 3.288 0 CA-C-O 117.928 -1.034 . . . . 0.0 110.536 176.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -71.57 -35.25 70.52 Favored 'General case' 0 N--CA 1.527 3.415 0 CA-C-N 119.629 1.104 . . . . 0.0 108.364 176.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 10.1 ptt180 -85.5 -19.23 31.51 Favored 'General case' 0 N--CA 1.527 3.405 0 CA-C-O 118.477 -0.773 . . . . 0.0 109.549 175.286 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -70.01 -33.0 71.45 Favored 'General case' 0 N--CA 1.534 3.727 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 174.189 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.444 ' HB1' ' CZ ' ' A' ' 54' ' ' ARG . . . -88.7 -31.56 18.41 Favored 'General case' 0 N--CA 1.506 2.359 0 CA-C-O 117.719 -1.134 . . . . 0.0 110.094 179.413 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.531 HD23 ' CE3' ' B' ' 519' ' ' TRP . 12.3 tp -70.58 -23.28 62.56 Favored 'General case' 0 N--CA 1.535 3.818 0 CA-C-N 120.856 1.662 . . . . 0.0 107.588 175.099 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.425 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -72.97 -69.97 1.31 Allowed Glycine 0 N--CA 1.502 3.089 0 C-N-CA 124.802 1.191 . . . . 0.0 111.181 176.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.9 m -67.09 -24.7 65.97 Favored 'General case' 1 N--CA 1.542 4.145 0 CA-C-N 117.897 0.848 . . . . 0.0 112.505 -177.618 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.444 ' CZ ' ' HB1' ' A' ' 50' ' ' ALA . 84.0 mtt180 -70.0 -50.51 40.87 Favored 'General case' 0 N--CA 1.527 3.401 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 176.433 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 23.1 t -63.53 -17.77 20.73 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.103 0 CA-C-O 118.073 -0.965 . . . . 0.0 110.209 175.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 57.4 mtt-85 -70.8 -56.36 6.5 Favored 'General case' 0 N--CA 1.528 3.427 0 CA-C-N 119.635 1.107 . . . . 0.0 111.09 177.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.432 ' CG2' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -68.76 -24.48 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.91 0 CA-C-N 119.871 1.214 . . . . 0.0 112.202 -177.194 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -83.26 -48.91 17.17 Favored 'Isoleucine or valine' 1 N--CA 1.55 4.531 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 -179.803 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -63.13 -21.78 66.42 Favored 'General case' 0 N--CA 1.528 3.458 0 CA-C-O 118.693 -0.67 . . . . 0.0 110.418 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -90.65 -23.76 20.68 Favored 'General case' 0 N--CA 1.529 3.505 0 CA-C-O 118.137 -0.935 . . . . 0.0 110.27 177.487 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 14.5 tp -81.57 -53.09 6.55 Favored 'General case' 0 N--CA 1.522 3.132 0 CA-C-N 119.515 1.052 . . . . 0.0 109.12 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 28.9 mt -48.12 -29.58 3.76 Favored 'General case' 1 N--CA 1.541 4.117 0 C-N-CA 124.99 1.316 . . . . 0.0 112.96 -178.827 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 19.5 mmm-85 -89.98 -42.24 11.28 Favored 'General case' 0 N--CA 1.528 3.447 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.07 85.37 0.76 Allowed Glycine 0 N--CA 1.513 3.783 0 N-CA-C 110.071 -1.211 . . . . 0.0 110.071 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -156.7 -57.56 0.09 Allowed 'General case' 0 N--CA 1.521 3.103 0 CA-C-N 117.398 0.599 . . . . 0.0 110.546 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 36.1 mtt -139.49 80.65 1.79 Allowed 'General case' 0 N--CA 1.513 2.675 0 CA-C-O 121.976 0.893 . . . . 0.0 108.939 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.3 t -135.53 2.92 3.0 Favored 'General case' 0 N--CA 1.525 3.299 0 CA-C-N 115.582 -0.735 . . . . 0.0 112.747 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -120.41 -77.88 0.59 Allowed 'General case' 0 N--CA 1.525 3.322 0 CA-C-N 119.912 1.233 . . . . 0.0 113.147 -178.602 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -103.53 -44.21 5.18 Favored 'General case' 0 N--CA 1.53 3.556 0 CA-C-N 119.336 0.971 . . . . 0.0 112.019 -176.687 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -71.81 -9.8 58.83 Favored 'General case' 0 N--CA 1.513 2.703 0 CA-C-O 117.761 -1.114 . . . . 0.0 112.553 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.597 HD23 HG21 ' A' ' 82' ' ' ILE . 24.4 tp -80.79 -52.24 7.74 Favored 'General case' 0 N--CA 1.523 3.223 0 CA-C-N 120.185 1.357 . . . . 0.0 112.273 -178.738 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -43.81 -30.87 0.72 Allowed 'General case' 1 N--CA 1.547 4.414 0 CA-C-N 119.353 0.979 . . . . 0.0 113.358 -177.809 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -82.28 -38.66 24.07 Favored 'General case' 0 N--CA 1.527 3.377 0 CA-C-O 118.795 -0.621 . . . . 0.0 111.551 -178.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -47.34 -56.77 6.21 Favored 'General case' 1 N--CA 1.539 4.004 0 C-N-CA 124.365 1.066 . . . . 0.0 113.155 -178.212 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -124.03 -43.35 2.1 Favored 'General case' 0 N--CA 1.534 3.747 0 CA-C-O 118.777 -0.63 . . . . 0.0 111.088 -179.751 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 128.9 76.8 0.19 Allowed Glycine 1 N--CA 1.521 4.31 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -140.12 114.22 9.02 Favored 'General case' 0 N--CA 1.52 3.072 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 178.424 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -47.06 171.43 0.03 OUTLIER Glycine 1 N--CA 1.542 5.748 0 C-N-CA 124.202 0.906 . . . . 0.0 113.781 -178.51 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -81.7 -18.77 11.27 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.684 0 CA-C-N 118.871 1.336 . . . . 0.0 108.404 178.473 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.39 -45.78 78.85 Favored 'General case' 0 N--CA 1.52 3.036 0 CA-C-N 119.972 1.26 . . . . 0.0 110.774 177.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -72.57 -39.31 67.53 Favored 'General case' 0 N--CA 1.536 3.83 0 CA-C-N 119.335 0.97 . . . . 0.0 112.524 -178.462 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.597 HG21 HD23 ' A' ' 71' ' ' LEU . 10.1 pt -71.33 -26.03 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.968 0 CA-C-N 119.255 0.934 . . . . 0.0 111.541 -179.204 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 73.1 p -102.2 -4.69 25.38 Favored 'General case' 0 N--CA 1.517 2.895 0 CA-C-N 119.125 0.875 . . . . 0.0 110.228 174.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -80.13 -33.02 38.95 Favored 'General case' 0 N--CA 1.533 3.689 0 N-CA-C 105.506 -2.035 . . . . 0.0 105.506 172.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -66.57 -28.59 73.83 Favored Glycine 1 N--CA 1.524 4.543 0 CA-C-O 118.407 -1.219 . . . . 0.0 110.634 176.325 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 90.7 p -64.21 -21.03 66.42 Favored 'General case' 1 N--CA 1.542 4.174 0 CA-C-N 119.015 1.407 . . . . 0.0 111.339 177.692 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -55.33 -23.42 23.69 Favored 'General case' 1 N--CA 1.544 4.244 0 CA-C-N 118.659 0.663 . . . . 0.0 110.549 176.055 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.406 ' HB3' ' HG ' ' B' ' 541' ' ' LEU . 78.5 p -45.33 -48.79 13.19 Favored 'General case' 1 N--CA 1.546 4.358 0 C-N-CA 125.709 1.603 . . . . 0.0 111.743 178.213 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.9 mt -67.69 -39.67 84.41 Favored 'General case' 0 N--CA 1.522 3.169 0 C-N-CA 124.195 0.998 . . . . 0.0 110.703 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.15 0.25 55.59 Favored 'General case' 0 N--CA 1.53 3.566 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -178.285 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -125.04 -61.88 1.26 Allowed 'General case' 0 N--CA 1.523 3.215 0 CA-C-N 120.218 1.372 . . . . 0.0 110.449 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.1 161.6 6.89 Favored Pre-proline 1 N--CA 1.54 4.066 0 C-N-CA 123.755 0.822 . . . . 0.0 113.146 -179.467 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.444 ' O ' ' HB2' ' A' ' 97' ' ' ARG . 41.3 Cg_endo -80.73 -179.14 4.92 Favored 'Trans proline' 0 C--N 1.38 2.214 0 C-N-CA 121.886 1.724 . . . . 0.0 110.437 178.325 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.1 t -99.67 -27.23 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.283 0 CA-C-O 117.864 -1.065 . . . . 0.0 111.65 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -61.73 -39.81 92.86 Favored 'General case' 0 N--CA 1.522 3.144 0 CA-C-N 119.989 1.268 . . . . 0.0 111.035 -178.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.469 ' CD2' HD22 ' B' ' 534' ' ' LEU . 6.6 mp -97.77 -18.11 18.98 Favored 'General case' 0 N--CA 1.511 2.624 0 C-N-CA 123.882 0.873 . . . . 0.0 110.817 179.425 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -62.37 -37.66 86.58 Favored 'General case' 1 N--CA 1.544 4.256 0 N-CA-C 103.826 -2.657 . . . . 0.0 103.826 168.725 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -53.83 -39.66 65.74 Favored 'General case' 0 N--CA 1.516 2.828 0 C-N-CA 125.102 1.361 . . . . 0.0 111.289 174.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.59 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 45.7 t90 -59.54 -36.59 76.43 Favored 'General case' 0 N--CA 1.533 3.703 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 179.171 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 44.3 mt -53.11 -40.2 63.98 Favored 'General case' 1 N--CA 1.546 4.35 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 176.502 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -68.85 -34.4 75.42 Favored 'General case' 0 N--CA 1.526 3.332 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 176.654 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.402 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 2.0 mt-10 -61.45 -25.42 67.22 Favored 'General case' 1 N--CA 1.548 4.433 0 C-N-CA 123.655 0.782 . . . . 0.0 110.051 174.604 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -116.79 6.14 7.2 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.34 0 C-N-CA 124.147 0.979 . . . . 0.0 112.093 -177.197 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 29.2 mt -112.68 -61.56 1.71 Allowed 'General case' 0 N--CA 1.521 3.098 0 N-CA-C 106.091 -1.818 . . . . 0.0 106.091 176.484 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.4 tp . . . . . 0 N--CA 1.535 3.794 0 C-N-CA 125.138 1.375 . . . . 0.0 111.787 178.811 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 . . . . . 0 N--CA 1.52 3.043 0 CA-C-O 119.145 -0.455 . . . . 0.0 110.976 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 519' ' ' TRP . . . . . 0.662 ' NE1' HD22 ' A' ' 39' ' ' LEU . 69.0 t-105 -36.37 -55.28 0.82 Allowed 'General case' 1 N--CA 1.55 4.552 0 C-N-CA 124.951 1.3 . . . . 0.0 114.033 -176.551 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 520' ' ' LEU . . . . . 0.628 ' H ' HD13 ' B' ' 520' ' ' LEU . 0.0 OUTLIER -73.85 -24.76 59.81 Favored 'General case' 0 N--CA 1.533 3.709 0 CA-C-O 117.275 -1.345 . . . . 0.0 114.518 -175.347 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.65 -25.71 64.96 Favored 'General case' 0 N--CA 1.534 3.752 0 N-CA-C 105.626 -1.99 . . . . 0.0 105.626 172.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 522' ' ' PHE . . . . . 0.511 ' CD2' ' HG ' ' A' ' 51' ' ' LEU . 3.2 m-85 -76.46 -35.25 58.56 Favored 'General case' 0 N--CA 1.515 2.814 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 172.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 80.1 t -69.09 -19.24 23.58 Favored 'Isoleucine or valine' 1 N--CA 1.55 4.526 0 CA-C-O 117.599 -1.191 . . . . 0.0 111.025 176.589 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -73.23 -52.53 13.7 Favored 'General case' 0 N--CA 1.535 3.81 0 CA-C-N 120.614 1.552 . . . . 0.0 107.985 -179.117 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 5.4 mp -67.98 -23.88 65.08 Favored 'General case' 0 N--CA 1.531 3.619 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 175.04 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.1 -34.17 77.04 Favored 'General case' 0 N--CA 1.522 3.138 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 175.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 527' ' ' LYS . . . . . 0.424 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 0.9 OUTLIER -69.31 -26.84 64.93 Favored 'General case' 0 N--CA 1.518 2.958 0 CA-C-O 118.297 -0.858 . . . . 0.0 110.385 176.993 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -67.98 -37.16 81.17 Favored 'General case' 0 N--CA 1.534 3.758 0 CA-C-N 119.125 0.875 . . . . 0.0 109.16 176.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 529' ' ' ALA . . . . . 0.59 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -91.62 -8.74 46.4 Favored 'General case' 0 CA--C 1.582 2.187 0 CA-C-O 118.369 -0.825 . . . . 0.0 110.476 178.048 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 530' ' ' TYR . . . . . 0.424 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.1 OUTLIER -81.11 -33.62 33.16 Favored 'General case' 0 N--CA 1.533 3.716 0 CA-C-N 120.468 1.486 . . . . 0.0 108.977 179.635 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -62.14 -44.43 96.65 Favored 'General case' 0 N--CA 1.535 3.808 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 177.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 -89.74 -86.72 0.19 Allowed 'General case' 0 N--CA 1.522 3.148 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 177.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.9 p30 151.7 48.79 0.0 OUTLIER 'General case' 1 N--CA 1.559 5.023 0 C-N-CA 127.426 2.291 . . . . 0.0 108.688 177.219 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 534' ' ' LEU . . . . . 0.469 HD22 ' CD2' ' A' ' 96' ' ' LEU . 6.5 mt -108.45 12.54 26.13 Favored 'General case' 0 N--CA 1.524 3.273 0 C-N-CA 124.665 1.186 . . . . 0.0 110.276 -179.303 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 535' ' ' HIS . . . . . 0.55 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 46.9 p-80 -83.93 4.38 29.88 Favored 'General case' 0 N--CA 1.516 2.829 0 C-N-CA 123.595 0.758 . . . . 0.0 109.076 175.362 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 536' ' ' LEU . . . . . 0.464 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 35.5 mt -97.12 -49.61 0.23 Allowed Pre-proline 0 N--CA 1.506 2.365 0 CA-C-O 116.526 -1.702 . . . . 0.0 109.125 -175.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 537' ' ' PRO . . . . . 0.464 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 2.9 Cg_exo -67.69 -34.38 25.12 Favored 'Trans proline' 0 C--N 1.394 2.963 0 C-N-CA 122.386 2.057 . . . . 0.0 107.417 171.368 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.78 -47.12 79.3 Favored 'General case' 0 N--CA 1.523 3.185 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 176.434 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 76.4 mt -77.67 -6.59 54.39 Favored 'General case' 0 N--CA 1.533 3.71 0 CA-C-O 118.702 -0.666 . . . . 0.0 111.228 178.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -63.76 -30.65 71.73 Favored 'General case' 0 N--CA 1.532 3.648 0 CA-C-N 119.584 1.084 . . . . 0.0 109.52 176.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 541' ' ' LEU . . . . . 0.406 ' HG ' ' HB3' ' A' ' 88' ' ' SER . 3.4 tm? -104.31 -50.9 3.23 Favored 'General case' 0 N--CA 1.509 2.489 0 CA-C-O 118.63 -0.7 . . . . 0.0 109.942 179.07 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 9.9 ptp -82.51 17.91 1.64 Allowed 'General case' 0 N--CA 1.533 3.698 0 CA-C-N 118.938 0.79 . . . . 0.0 112.859 -177.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 7.6 tp -138.85 -73.71 0.39 Allowed 'General case' 0 N--CA 1.528 3.428 0 CA-C-N 119.674 1.124 . . . . 0.0 111.542 174.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 66.5 p 116.73 152.82 0.0 OUTLIER Pre-proline 1 N--CA 1.571 5.591 0 C-N-CA 127.947 2.499 . . . . 0.0 111.02 -179.178 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -69.57 -40.91 5.03 Favored 'Trans proline' 0 C--N 1.396 3.052 0 C-N-CA 123.027 2.485 . . . . 0.0 110.04 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -57.9 -29.47 65.11 Favored 'General case' 1 N--CA 1.543 4.195 0 C-N-CA 123.422 0.689 . . . . 0.0 110.773 178.361 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -75.05 -36.54 61.82 Favored 'General case' 0 N--CA 1.521 3.116 0 CA-C-O 118.279 -0.867 . . . . 0.0 108.744 177.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 548' ' ' ARG . . . . . 0.482 ' HA ' HD12 ' B' ' 551' ' ' LEU . 35.3 ptt180 -83.26 3.7 30.13 Favored 'General case' 0 N--CA 1.531 3.623 0 CA-C-N 118.993 0.815 . . . . 0.0 111.036 174.798 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -85.09 -48.96 8.67 Favored 'General case' 0 N--CA 1.519 2.99 0 N-CA-C 102.663 -3.088 . . . . 0.0 102.663 170.411 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -77.52 -11.91 59.91 Favored 'General case' 0 N--CA 1.504 2.253 0 CA-C-O 116.947 -1.501 . . . . 0.0 112.357 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 551' ' ' LEU . . . . . 0.679 HD11 ' N ' ' A' ' 19' ' ' TRP . 0.0 OUTLIER -75.32 -39.02 59.91 Favored 'General case' 1 N--CA 1.54 4.032 0 CA-C-N 121.559 1.982 . . . . 0.0 106.457 174.682 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' B' B ' 552' ' ' GLY . . . . . 0.667 ' N ' HD13 ' B' ' 551' ' ' LEU . . . -66.6 -56.23 14.16 Favored Glycine 0 N--CA 1.495 2.629 0 N-CA-C 109.021 -1.632 . . . . 0.0 109.021 -178.058 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.6 m -64.57 -30.52 71.55 Favored 'General case' 1 N--CA 1.542 4.141 0 CA-C-O 118.495 -0.764 . . . . 0.0 112.302 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -65.97 -52.93 45.17 Favored 'General case' 1 N--CA 1.545 4.306 0 N-CA-C 107.184 -1.413 . . . . 0.0 107.184 177.126 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 555' ' ' VAL . . . . . 0.502 HG23 ' O ' ' B' ' 551' ' ' LEU . 28.1 t -64.15 -18.51 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.738 0 CA-C-O 117.88 -1.057 . . . . 0.0 110.176 177.633 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -79.42 -43.6 23.04 Favored 'General case' 0 N--CA 1.529 3.498 0 CA-C-O 117.554 -1.213 . . . . 0.0 111.499 179.346 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 557' ' ' ILE . . . . . 0.467 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -73.46 -23.89 19.89 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.248 0 CA-C-N 121.017 1.735 . . . . 0.0 110.678 -179.701 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 558' ' ' VAL . . . . . 0.467 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -84.33 -50.62 14.87 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.809 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -179.444 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -61.34 -23.54 65.82 Favored 'General case' 0 N--CA 1.532 3.646 0 CA-C-O 118.797 -0.621 . . . . 0.0 110.049 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -96.89 -20.35 18.2 Favored 'General case' 0 N--CA 1.525 3.321 0 CA-C-O 117.541 -1.218 . . . . 0.0 111.757 179.035 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 3.3 pp -88.8 -33.39 17.44 Favored 'General case' 0 N--CA 1.538 3.961 0 CA-C-N 120.59 1.541 . . . . 0.0 110.102 179.395 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 1.1 tt -58.54 -36.57 74.07 Favored 'General case' 0 N--CA 1.537 3.906 0 C-N-CA 124.15 0.98 . . . . 0.0 110.301 178.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 11.8 mmm-85 -74.36 -52.25 12.72 Favored 'General case' 0 N--CA 1.532 3.644 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 70.76 89.09 0.1 OUTLIER Glycine 0 N--CA 1.513 3.81 0 CA-C-O 119.512 -0.604 . . . . 0.0 112.991 176.658 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -148.25 -54.23 0.2 Allowed 'General case' 0 N--CA 1.525 3.303 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 14.5 ptm -148.2 61.87 1.11 Allowed 'General case' 0 N--CA 1.525 3.297 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 6.8 t -123.84 1.47 8.72 Favored 'General case' 0 N--CA 1.522 3.153 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.23 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -88.17 -71.56 0.57 Allowed 'General case' 0 N--CA 1.522 3.131 0 CA-C-N 119.754 1.161 . . . . 0.0 110.67 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.53 -19.89 12.38 Favored 'General case' 0 N--CA 1.536 3.845 0 CA-C-O 118.338 -0.839 . . . . 0.0 112.36 -179.214 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -83.98 -7.7 59.34 Favored 'General case' 0 N--CA 1.518 2.957 0 CA-C-N 119.245 0.929 . . . . 0.0 113.251 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 571' ' ' LEU . . . . . 0.607 HD23 HD11 ' B' ' 582' ' ' ILE . 60.6 tp -89.69 -50.02 6.31 Favored 'General case' 0 N--CA 1.535 3.811 0 CA-C-N 120.313 1.415 . . . . 0.0 113.635 -177.505 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -36.18 -33.56 0.04 OUTLIER 'General case' 1 N--CA 1.548 4.475 0 N-CA-C 116.173 1.916 . . . . 0.0 116.173 -175.03 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -66.21 -44.63 83.32 Favored 'General case' 1 N--CA 1.543 4.186 0 CA-C-N 118.724 0.693 . . . . 0.0 109.816 -179.661 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -62.78 -43.46 98.75 Favored 'General case' 0 N--CA 1.523 3.192 0 C-N-CA 124.77 1.228 . . . . 0.0 112.282 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 51.0 mt -102.68 -64.45 1.07 Allowed 'General case' 0 N--CA 1.533 3.685 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -176.12 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 101.86 45.43 1.77 Allowed Glycine 0 N--CA 1.512 3.745 0 N-CA-C 108.494 -1.843 . . . . 0.0 108.494 -176.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -93.44 -37.08 12.15 Favored 'General case' 0 N--CA 1.527 3.41 0 CA-C-N 117.475 0.637 . . . . 0.0 110.329 179.233 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 109.48 164.56 20.01 Favored Glycine 1 N--CA 1.523 4.456 0 N-CA-C 110.0 -1.24 . . . . 0.0 110.0 -178.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 579' ' ' ILE . . . . . 0.445 ' HA ' HG22 ' B' ' 582' ' ' ILE . 1.9 mt -84.69 -16.88 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.719 0 CA-C-N 119.227 1.514 . . . . 0.0 108.36 177.71 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -69.66 -39.56 76.99 Favored 'General case' 0 N--CA 1.524 3.249 0 CA-C-N 119.874 1.215 . . . . 0.0 109.159 176.113 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 2.6 p -74.78 -40.55 61.1 Favored 'General case' 0 N--CA 1.537 3.879 0 CA-C-N 118.449 0.568 . . . . 0.0 111.527 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 582' ' ' ILE . . . . . 0.607 HD11 HD23 ' B' ' 571' ' ' LEU . 2.8 tt -66.12 -37.35 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.518 0 C-N-CA 123.243 0.617 . . . . 0.0 112.336 -175.544 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 80.5 p -95.92 -33.12 12.3 Favored 'General case' 0 N--CA 1.515 2.812 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.221 -178.134 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -71.31 -21.57 62.05 Favored 'General case' 0 N--CA 1.529 3.509 0 CA-C-N 119.188 0.904 . . . . 0.0 109.333 176.082 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -69.37 -33.31 72.67 Favored Glycine 1 N--CA 1.517 4.052 0 N-CA-C 108.784 -1.726 . . . . 0.0 108.784 174.741 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 37.5 m -63.5 -39.34 94.2 Favored 'General case' 1 N--CA 1.544 4.234 0 CA-C-N 118.376 1.088 . . . . 0.0 110.166 177.527 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -60.13 -27.88 67.42 Favored 'General case' 1 N--CA 1.543 4.217 0 C-N-CA 123.614 0.766 . . . . 0.0 111.314 178.724 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 73.7 m -58.88 -44.73 91.2 Favored 'General case' 0 N--CA 1.537 3.914 0 C-N-CA 123.771 0.828 . . . . 0.0 111.57 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 33.5 mt -57.44 -42.65 82.87 Favored 'General case' 0 N--CA 1.528 3.457 0 C-N-CA 123.862 0.865 . . . . 0.0 111.127 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.54 -26.38 68.54 Favored 'General case' 1 N--CA 1.541 4.084 0 CA-C-O 118.638 -0.696 . . . . 0.0 111.889 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -76.54 -42.84 41.56 Favored 'General case' 0 N--CA 1.518 2.949 0 CA-C-N 118.598 0.635 . . . . 0.0 110.522 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -62.64 159.54 42.38 Favored Pre-proline 0 N--CA 1.536 3.844 0 CA-C-O 118.386 -0.816 . . . . 0.0 111.863 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -78.83 -176.46 3.3 Favored 'Trans proline' 0 C--N 1.377 2.059 0 C-N-CA 121.63 1.554 . . . . 0.0 110.981 178.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.4 t -96.68 -29.86 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.95 0 CA-C-O 117.8 -1.095 . . . . 0.0 111.099 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -65.83 -38.25 88.39 Favored 'General case' 0 N--CA 1.515 2.808 0 CA-C-N 119.63 1.104 . . . . 0.0 110.03 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 596' ' ' LEU . . . . . 0.433 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.7 mp -98.51 -18.33 18.24 Favored 'General case' 0 N--CA 1.511 2.579 0 C-N-CA 123.776 0.831 . . . . 0.0 111.27 178.692 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.52 -30.14 69.73 Favored 'General case' 0 N--CA 1.535 3.783 0 N-CA-C 103.124 -2.917 . . . . 0.0 103.124 167.849 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -55.34 -38.87 69.31 Favored 'General case' 0 N--CA 1.518 2.942 0 C-N-CA 123.859 0.863 . . . . 0.0 110.174 173.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 599' ' ' TRP . . . . . 0.639 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 50.5 t90 -62.17 -37.39 85.04 Favored 'General case' 0 N--CA 1.527 3.388 0 CA-C-O 117.75 -1.119 . . . . 0.0 108.168 178.597 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 11.2 mp -54.19 -38.17 65.33 Favored 'General case' 1 N--CA 1.542 4.165 0 CA-C-N 119.226 0.921 . . . . 0.0 108.638 176.551 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -71.1 -32.53 69.15 Favored 'General case' 0 N--CA 1.531 3.624 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 176.163 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 602' ' ' GLU . . . . . 0.426 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 2.2 mm-40 -64.4 -22.17 66.87 Favored 'General case' 1 N--CA 1.544 4.265 0 C-N-CA 123.687 0.795 . . . . 0.0 110.133 174.899 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 603' ' ' VAL . . . . . 0.562 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.1 OUTLIER -121.05 3.45 6.51 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.495 0 C-N-CA 123.807 0.843 . . . . 0.0 112.295 -177.521 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -110.91 -56.95 2.3 Favored 'General case' 0 N--CA 1.514 2.761 0 N-CA-C 105.774 -1.936 . . . . 0.0 105.774 176.307 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 2.5 tt . . . . . 0 N--CA 1.532 3.659 0 C-N-CA 124.901 1.281 . . . . 0.0 111.486 -179.977 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 . . . . . 0 N--CA 1.528 3.426 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.587 ' CZ3' HD22 ' B' ' 551' ' ' LEU . 72.5 t-105 -52.99 -46.98 68.54 Favored 'General case' 0 N--CA 1.539 4.0 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 175.235 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.419 ' N ' HD22 ' A' ' 20' ' ' LEU . 3.6 mm? -74.15 -27.38 60.81 Favored 'General case' 0 N--CA 1.514 2.736 0 O-C-N 125.339 1.649 . . . . 0.0 112.087 -177.857 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.0 ttt180 -56.95 -29.51 63.22 Favored 'General case' 1 N--CA 1.544 4.242 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 173.356 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.48 ' O ' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -83.57 -38.71 21.31 Favored 'General case' 0 CA--C 1.586 2.338 0 CA-C-O 116.387 -1.768 . . . . 0.0 109.003 173.733 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.558 HG11 ' NE2' ' B' ' 535' ' ' HIS . 19.2 t -70.15 -27.53 32.64 Favored 'Isoleucine or valine' 1 N--CA 1.574 5.73 0 CA-C-N 121.042 1.746 . . . . 0.0 112.985 -175.185 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -73.91 -50.52 19.75 Favored 'General case' 0 N--CA 1.535 3.814 0 CA-C-N 119.994 1.27 . . . . 0.0 108.258 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.2 mp -72.51 -15.62 61.79 Favored 'General case' 0 N--CA 1.528 3.447 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 175.178 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -70.44 -35.2 73.22 Favored 'General case' 0 N--CA 1.518 2.951 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 174.611 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.449 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 29.6 ttmt -64.03 -24.19 67.62 Favored 'General case' 0 N--CA 1.525 3.302 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.485 176.052 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -69.55 -41.23 76.17 Favored 'General case' 0 N--CA 1.534 3.766 0 CA-C-N 119.282 0.946 . . . . 0.0 108.583 176.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.631 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -87.21 -7.99 57.34 Favored 'General case' 0 N--CA 1.504 2.263 0 CA-C-O 118.59 -0.719 . . . . 0.0 110.738 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.449 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -84.1 -31.83 25.06 Favored 'General case' 0 N--CA 1.534 3.743 0 CA-C-N 120.433 1.47 . . . . 0.0 109.059 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -64.5 -41.33 96.5 Favored 'General case' 0 N--CA 1.531 3.607 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 51.6 m-80 -92.75 -90.78 0.18 Allowed 'General case' 0 N--CA 1.514 2.766 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 177.214 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.0 p30 155.19 51.16 0.0 OUTLIER 'General case' 1 N--CA 1.555 4.782 0 C-N-CA 127.381 2.272 . . . . 0.0 108.222 177.19 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.529 HD22 ' CD2' ' B' ' 596' ' ' LEU . 7.2 mt -110.08 12.21 23.61 Favored 'General case' 0 N--CA 1.522 3.149 0 C-N-CA 124.209 1.003 . . . . 0.0 110.459 -179.366 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.53 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 50.0 p-80 -84.47 5.82 25.92 Favored 'General case' 0 N--CA 1.515 2.781 0 C-N-CA 123.723 0.809 . . . . 0.0 108.854 174.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.59 ' HA ' HD23 ' A' ' 39' ' ' LEU . 31.7 mt -96.09 -52.39 0.23 Allowed Pre-proline 0 N--CA 1.502 2.151 0 CA-C-O 117.058 -1.448 . . . . 0.0 108.746 -176.199 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.463 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 6.1 Cg_exo -66.41 -32.04 41.36 Favored 'Trans proline' 0 C--N 1.391 2.799 0 N-CA-C 107.106 -1.921 . . . . 0.0 107.106 170.788 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.53 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 1.0 OUTLIER -65.58 -41.64 92.66 Favored 'General case' 0 N--CA 1.52 3.034 0 CA-C-O 118.212 -0.899 . . . . 0.0 108.739 176.79 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.59 HD23 ' HA ' ' A' ' 36' ' ' LEU 0.274 0.1 OUTLIER -78.28 -8.58 58.56 Favored 'General case' 1 N--CA 1.552 4.653 0 CA-C-N 119.612 1.096 . . . . 0.0 111.448 177.272 . . . . . . . . 5 4 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -90.22 8.57 32.43 Favored 'General case' 0 N--CA 1.524 3.245 0 CA-C-N 118.727 0.694 . . . . 0.0 109.618 174.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.57 HD11 HG11 ' B' ' 558' ' ' VAL . 0.3 OUTLIER -125.47 -56.32 1.51 Allowed 'General case' 0 N--CA 1.513 2.723 0 C-N-CA 124.048 0.939 . . . . 0.0 109.629 -178.748 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.566 ' N ' HD13 ' A' ' 41' ' ' LEU . 15.7 ptp -98.06 7.72 45.88 Favored 'General case' 0 N--CA 1.538 3.943 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -176.776 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.47 ' O ' HG23 ' A' ' 44' ' ' THR . 1.8 mp -120.63 -71.36 0.74 Allowed 'General case' 0 N--CA 1.514 2.726 0 CA-C-O 117.333 -1.318 . . . . 0.0 110.229 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.47 HG23 ' O ' ' A' ' 43' ' ' LEU . 24.9 p 128.41 161.75 0.0 OUTLIER Pre-proline 1 N--CA 1.579 6.014 0 C-N-CA 127.533 2.333 . . . . 0.0 109.071 -179.194 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -68.16 -33.36 25.07 Favored 'Trans proline' 0 C--N 1.392 2.82 0 C-N-CA 121.934 1.756 . . . . 0.0 108.929 176.062 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -64.56 -22.78 67.06 Favored 'General case' 0 N--CA 1.532 3.644 0 CA-C-O 118.278 -0.867 . . . . 0.0 110.561 176.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -71.26 -37.11 71.93 Favored 'General case' 0 N--CA 1.524 3.245 0 CA-C-O 117.745 -1.121 . . . . 0.0 109.658 178.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.9 ptt180 -81.85 -20.31 39.21 Favored 'General case' 1 N--CA 1.541 4.113 0 CA-C-N 119.589 1.086 . . . . 0.0 108.896 174.982 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -71.99 -26.3 62.18 Favored 'General case' 0 N--CA 1.523 3.217 0 N-CA-C 107.559 -1.275 . . . . 0.0 107.559 174.237 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.02 -35.48 16.35 Favored 'General case' 0 N--CA 1.504 2.268 0 CA-C-O 117.365 -1.302 . . . . 0.0 110.114 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.492 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 29.5 tp -74.27 -19.98 60.31 Favored 'General case' 1 N--CA 1.541 4.1 0 CA-C-N 120.646 1.566 . . . . 0.0 106.94 173.689 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.41 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -69.01 -70.24 1.21 Allowed Glycine 0 N--CA 1.497 2.742 0 C-N-CA 125.346 1.45 . . . . 0.0 110.254 177.418 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.4 t -72.93 -22.14 60.77 Favored 'General case' 0 N--CA 1.526 3.368 0 CA-C-O 117.628 -1.177 . . . . 0.0 113.019 -179.062 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 12.2 mtt180 -70.57 -51.02 31.27 Favored 'General case' 0 N--CA 1.531 3.604 0 CA-C-N 120.073 1.306 . . . . 0.0 108.035 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 20.3 t -65.66 -18.75 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.978 0 CA-C-O 117.875 -1.059 . . . . 0.0 109.39 175.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.4 mmt180 -75.71 -45.19 38.13 Favored 'General case' 0 N--CA 1.525 3.325 0 CA-C-O 117.376 -1.297 . . . . 0.0 111.807 178.331 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.424 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -73.6 -25.62 21.05 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.261 0 CA-C-N 121.26 1.846 . . . . 0.0 111.137 -178.371 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.517 HG11 HD11 ' B' ' 541' ' ' LEU . 0.0 OUTLIER -85.23 -47.16 17.08 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.108 0 CA-C-N 120.128 1.331 . . . . 0.0 107.536 -179.946 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -62.03 -24.28 66.97 Favored 'General case' 0 N--CA 1.534 3.741 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 177.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -92.73 -21.23 20.09 Favored 'General case' 0 N--CA 1.518 2.929 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.373 177.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 12.6 tp -74.75 -56.47 4.76 Favored 'General case' 0 N--CA 1.526 3.337 0 CA-C-N 120.091 1.314 . . . . 0.0 109.395 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 57.2 mt -51.15 -27.99 9.94 Favored 'General case' 1 N--CA 1.544 4.233 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -178.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.72 -57.45 2.98 Favored 'General case' 0 N--CA 1.524 3.261 0 N-CA-C 106.91 -1.515 . . . . 0.0 106.91 178.802 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 66.76 64.92 3.03 Favored Glycine 1 N--CA 1.517 4.094 0 C-N-CA 124.0 0.809 . . . . 0.0 112.698 178.058 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -115.17 -54.93 2.52 Favored 'General case' 0 N--CA 1.524 3.257 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 11.8 ptm -147.01 65.72 1.16 Allowed 'General case' 0 N--CA 1.528 3.463 0 N-CA-C 106.39 -1.707 . . . . 0.0 106.39 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.415 ' HA ' ' HB2' ' A' ' 71' ' ' LEU . 14.8 m -124.03 6.49 8.6 Favored 'General case' 0 N--CA 1.524 3.233 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -174.248 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -114.91 -70.09 0.82 Allowed 'General case' 0 N--CA 1.527 3.418 0 CA-C-N 119.61 1.096 . . . . 0.0 111.502 -179.161 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 8.6 mtt180 -91.44 -43.6 9.62 Favored 'General case' 0 N--CA 1.533 3.706 0 CA-C-N 118.591 0.632 . . . . 0.0 111.536 -177.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -77.07 -13.59 59.93 Favored 'General case' 0 N--CA 1.519 3.011 0 CA-C-O 118.321 -0.847 . . . . 0.0 112.925 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.547 HD23 HG21 ' A' ' 82' ' ' ILE . 24.4 tp -81.41 -50.46 9.43 Favored 'General case' 0 N--CA 1.523 3.198 0 CA-C-N 119.767 1.167 . . . . 0.0 111.522 -178.204 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.92 -31.79 1.39 Allowed 'General case' 1 N--CA 1.545 4.289 0 CA-C-N 119.57 1.077 . . . . 0.0 113.666 -179.171 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -77.86 -38.9 44.99 Favored 'General case' 0 N--CA 1.527 3.423 0 CA-C-O 119.232 -0.413 . . . . 0.0 111.217 -178.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -51.09 -59.19 4.44 Favored 'General case' 0 N--CA 1.529 3.521 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -177.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -119.08 -36.86 3.31 Favored 'General case' 0 N--CA 1.537 3.893 0 CA-C-O 118.455 -0.783 . . . . 0.0 112.075 -178.305 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 119.95 77.71 0.52 Allowed Glycine 1 N--CA 1.525 4.593 0 N-CA-C 110.76 -0.936 . . . . 0.0 110.76 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -146.0 100.83 3.45 Favored 'General case' 0 N--CA 1.524 3.242 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 178.334 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -40.18 170.48 0.01 OUTLIER Glycine 1 N--CA 1.54 5.624 0 C-N-CA 125.351 1.453 . . . . 0.0 116.094 -176.346 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -77.14 -20.81 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.04 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 178.513 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.94 -50.26 62.93 Favored 'General case' 0 N--CA 1.516 2.839 0 CA-C-O 117.944 -1.027 . . . . 0.0 109.302 177.367 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.09 -41.6 94.86 Favored 'General case' 1 N--CA 1.541 4.082 0 CA-C-O 117.875 -1.059 . . . . 0.0 113.459 -178.494 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.547 HG21 HD23 ' A' ' 71' ' ' LEU . 0.1 OUTLIER -69.68 -32.16 51.34 Favored 'Isoleucine or valine' 1 N--CA 1.549 4.508 0 CA-C-N 120.392 1.451 . . . . 0.0 110.96 -179.616 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 71.3 p -98.9 -2.15 38.33 Favored 'General case' 0 N--CA 1.518 2.947 0 CA-C-N 119.101 0.864 . . . . 0.0 111.443 177.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -88.22 -32.87 18.34 Favored 'General case' 0 N--CA 1.529 3.478 0 N-CA-C 105.519 -2.03 . . . . 0.0 105.519 173.37 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.64 -29.64 72.54 Favored Glycine 1 N--CA 1.519 4.196 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 176.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 62.2 p -69.4 -35.89 76.19 Favored 'General case' 0 N--CA 1.538 3.942 0 CA-C-N 118.544 1.172 . . . . 0.0 110.259 177.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -63.16 -26.35 68.77 Favored 'General case' 0 N--CA 1.538 3.965 0 C-N-CA 123.146 0.578 . . . . 0.0 110.721 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.3 m -68.61 -38.68 80.8 Favored 'General case' 0 N--CA 1.534 3.757 0 C-N-CA 123.584 0.754 . . . . 0.0 110.375 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 13.5 mt -57.47 -37.96 73.73 Favored 'General case' 0 N--CA 1.533 3.682 0 C-N-CA 124.05 0.94 . . . . 0.0 111.468 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -68.43 -27.98 66.67 Favored 'General case' 0 N--CA 1.531 3.618 0 CA-C-O 118.563 -0.732 . . . . 0.0 111.757 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -76.42 -46.31 27.66 Favored 'General case' 0 N--CA 1.518 2.963 0 CA-C-N 118.782 0.719 . . . . 0.0 110.992 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.25 160.04 52.76 Favored Pre-proline 0 N--CA 1.538 3.955 0 CA-C-O 118.29 -0.862 . . . . 0.0 112.571 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -81.85 175.46 9.29 Favored 'Trans proline' 0 C--N 1.377 2.072 0 C-N-CA 121.737 1.625 . . . . 0.0 111.123 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 t -95.69 -25.19 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.192 0 CA-C-O 117.945 -1.026 . . . . 0.0 111.242 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -59.79 -44.94 93.69 Favored 'General case' 0 N--CA 1.516 2.85 0 CA-C-N 120.071 1.305 . . . . 0.0 109.966 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.597 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.9 mp -98.49 -9.98 24.24 Favored 'General case' 0 N--CA 1.505 2.282 0 CA-C-O 118.061 -0.971 . . . . 0.0 112.268 178.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.1 -33.93 76.9 Favored 'General case' 1 N--CA 1.549 4.52 0 N-CA-C 102.881 -3.007 . . . . 0.0 102.881 168.014 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -53.23 -41.26 65.22 Favored 'General case' 0 N--CA 1.519 3.007 0 C-N-CA 124.501 1.121 . . . . 0.0 110.159 174.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.671 ' CH2' ' HB2' ' B' ' 529' ' ' ALA . 51.1 t90 -64.46 -35.29 80.45 Favored 'General case' 0 N--CA 1.532 3.665 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 176.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.37 -38.56 59.14 Favored 'General case' 0 N--CA 1.537 3.901 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 176.212 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -69.97 -36.41 75.2 Favored 'General case' 0 N--CA 1.539 3.994 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 175.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.428 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 0.8 OUTLIER -59.12 -24.4 62.94 Favored 'General case' 1 N--CA 1.549 4.522 0 C-N-CA 123.419 0.688 . . . . 0.0 109.984 175.124 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.529 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -119.7 3.66 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.39 0 C-N-CA 123.615 0.766 . . . . 0.0 112.356 -177.345 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -98.68 -59.36 1.75 Allowed 'General case' 0 N--CA 1.517 2.909 0 N-CA-C 104.346 -2.464 . . . . 0.0 104.346 175.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 1.6 tp . . . . . 0 N--CA 1.528 3.464 0 C-N-CA 124.687 1.195 . . . . 0.0 109.602 176.826 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 . . . . . 0 N--CA 1.52 3.025 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 519' ' ' TRP . . . . . 0.524 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 67.9 t-105 -42.92 -28.15 0.24 Allowed 'General case' 1 N--CA 1.549 4.489 0 CA-C-N 119.641 1.11 . . . . 0.0 113.65 179.865 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 520' ' ' LEU . . . . . 0.58 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.2 mm? -95.03 -29.1 14.78 Favored 'General case' 0 N--CA 1.53 3.532 0 CA-C-O 117.84 -1.076 . . . . 0.0 113.827 -172.426 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -27.23 68.26 Favored 'General case' 1 N--CA 1.545 4.297 0 N-CA-C 105.426 -2.064 . . . . 0.0 105.426 171.02 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 522' ' ' PHE . . . . . 0.561 ' O ' HD23 ' B' ' 526' ' ' LEU . 0.9 OUTLIER -78.08 -40.37 38.67 Favored 'General case' 0 N--CA 1.507 2.402 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 174.77 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 37.0 t -63.02 -22.43 30.65 Favored 'Isoleucine or valine' 1 N--CA 1.569 5.48 0 CA-C-N 120.283 1.401 . . . . 0.0 111.965 178.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -76.89 -49.83 14.75 Favored 'General case' 0 N--CA 1.536 3.84 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 179.263 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 6.7 tt -63.45 -31.4 72.55 Favored 'General case' 0 N--CA 1.538 3.939 0 O-C-N 123.29 0.369 . . . . 0.0 110.115 176.286 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 526' ' ' LEU . . . . . 0.561 HD23 ' O ' ' B' ' 522' ' ' PHE . 3.7 mm? -68.65 -33.78 74.58 Favored 'General case' 0 N--CA 1.523 3.223 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 177.331 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 527' ' ' LYS . . . . . 0.433 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 31.4 ttmt -67.66 -26.57 66.28 Favored 'General case' 0 N--CA 1.518 2.971 0 CA-C-O 118.161 -0.923 . . . . 0.0 110.853 177.298 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -69.58 -37.43 76.95 Favored 'General case' 0 N--CA 1.536 3.854 0 CA-C-N 119.462 1.028 . . . . 0.0 108.896 176.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 529' ' ' ALA . . . . . 0.671 ' HB2' ' CH2' ' A' ' 99' ' ' TRP . . . -90.98 -9.46 45.92 Favored 'General case' 0 CA--C 1.579 2.084 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.967 178.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 530' ' ' TYR . . . . . 0.496 ' CZ ' HG13 ' A' ' 23' ' ' VAL . 1.2 m-85 -82.32 -32.11 29.59 Favored 'General case' 0 N--CA 1.531 3.6 0 CA-C-N 120.312 1.414 . . . . 0.0 109.328 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -65.85 -43.0 89.76 Favored 'General case' 0 N--CA 1.534 3.766 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 177.461 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 65.6 m-80 -90.82 -90.15 0.16 Allowed 'General case' 0 N--CA 1.514 2.754 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 154.86 50.74 0.0 OUTLIER 'General case' 1 N--CA 1.559 4.977 0 C-N-CA 127.574 2.35 . . . . 0.0 107.984 177.384 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 534' ' ' LEU . . . . . 0.597 HD22 ' CD2' ' A' ' 96' ' ' LEU . 6.9 mt -106.35 7.83 31.42 Favored 'General case' 0 N--CA 1.528 3.449 0 C-N-CA 124.297 1.039 . . . . 0.0 111.021 -178.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 535' ' ' HIS . . . . . 0.616 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 29.3 p-80 -80.57 0.01 35.77 Favored 'General case' 0 N--CA 1.514 2.732 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 175.29 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 536' ' ' LEU . . . . . 0.418 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 35.5 mt -94.23 -50.95 0.26 Allowed Pre-proline 0 N--CA 1.505 2.283 0 CA-C-O 116.486 -1.721 . . . . 0.0 109.263 -175.497 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 537' ' ' PRO . . . . . 0.418 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 5.2 Cg_exo -66.33 -35.37 31.8 Favored 'Trans proline' 0 C--N 1.394 2.966 0 N-CA-C 106.775 -2.048 . . . . 0.0 106.775 171.283 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 538' ' ' LEU . . . . . 0.441 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 1.0 OUTLIER -62.24 -41.7 98.66 Favored 'General case' 0 N--CA 1.524 3.251 0 C-N-CA 124.267 1.027 . . . . 0.0 108.334 175.979 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 11.5 mt -72.14 -21.76 61.42 Favored 'General case' 1 N--CA 1.54 4.057 0 CA-C-O 118.358 -0.83 . . . . 0.0 111.057 178.573 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -77.72 -6.18 53.11 Favored 'General case' 0 N--CA 1.524 3.234 0 CA-C-N 118.976 0.807 . . . . 0.0 110.44 177.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 541' ' ' LEU . . . . . 0.634 HD13 ' N ' ' B' ' 542' ' ' MET . 0.0 OUTLIER -109.88 -47.77 3.3 Favored 'General case' 0 N--CA 1.512 2.63 0 C-N-CA 124.053 0.941 . . . . 0.0 109.445 -179.092 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 542' ' ' MET . . . . . 0.634 ' N ' HD13 ' B' ' 541' ' ' LEU . 12.7 ptp -89.76 -10.54 45.21 Favored 'General case' 0 N--CA 1.536 3.852 0 CA-C-O 117.407 -1.282 . . . . 0.0 113.542 -177.836 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 543' ' ' LEU . . . . . 0.575 ' O ' HG23 ' B' ' 544' ' ' THR . 1.2 tt -128.2 -112.58 0.27 Allowed 'General case' 0 N--CA 1.53 3.563 0 CA-C-O 116.558 -1.687 . . . . 0.0 112.752 -178.053 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 544' ' ' THR . . . . . 0.575 HG23 ' O ' ' B' ' 543' ' ' LEU . 2.2 p -174.56 161.66 2.64 Favored Pre-proline 1 N--CA 1.561 5.087 0 CA-C-N 121.505 1.957 . . . . 0.0 111.245 -178.483 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -74.81 -42.49 0.55 Allowed 'Trans proline' 0 C--N 1.388 2.621 0 C-N-CA 123.021 2.481 . . . . 0.0 109.733 176.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -58.28 -31.9 67.91 Favored 'General case' 1 N--CA 1.543 4.192 0 C-N-CA 123.707 0.803 . . . . 0.0 111.63 179.729 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -71.96 -34.09 68.7 Favored 'General case' 0 N--CA 1.526 3.35 0 CA-C-O 117.843 -1.075 . . . . 0.0 110.664 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 32.1 ptt180 -79.09 -23.51 44.08 Favored 'General case' 0 N--CA 1.533 3.692 0 CA-C-N 119.597 1.09 . . . . 0.0 110.133 177.087 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -65.16 -41.48 94.66 Favored 'General case' 0 N--CA 1.536 3.828 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 173.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -78.14 -19.95 53.01 Favored 'General case' 0 N--CA 1.508 2.448 0 CA-C-O 116.992 -1.48 . . . . 0.0 111.185 177.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 551' ' ' LEU . . . . . 0.587 HD22 ' CZ3' ' A' ' 19' ' ' TRP . 18.0 tp -76.44 -28.19 56.5 Favored 'General case' 0 N--CA 1.529 3.497 0 CA-C-N 121.368 1.895 . . . . 0.0 108.52 175.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -72.23 -56.3 6.38 Favored Glycine 0 N--CA 1.501 2.993 0 N-CA-C 108.491 -1.844 . . . . 0.0 108.491 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.4 m -66.19 -28.18 68.56 Favored 'General case' 0 N--CA 1.537 3.913 0 CA-C-O 118.432 -0.794 . . . . 0.0 112.05 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 26.0 mtm-85 -69.22 -45.81 68.94 Favored 'General case' 1 N--CA 1.541 4.102 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 176.459 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 555' ' ' VAL . . . . . 0.483 HG23 ' O ' ' B' ' 551' ' ' LEU . 34.9 t -70.73 -15.47 18.93 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.66 0 CA-C-O 118.11 -0.947 . . . . 0.0 109.353 177.161 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -79.82 -44.35 20.72 Favored 'General case' 0 N--CA 1.523 3.222 0 CA-C-O 117.395 -1.288 . . . . 0.0 111.212 178.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 557' ' ' ILE . . . . . 0.483 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -72.3 -25.07 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.213 0 CA-C-N 121.428 1.922 . . . . 0.0 110.107 179.88 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 558' ' ' VAL . . . . . 0.57 HG11 HD11 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -84.32 -52.76 12.24 Favored 'Isoleucine or valine' 1 N--CA 1.547 4.397 0 CA-C-N 120.736 1.607 . . . . 0.0 107.541 -179.888 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -58.07 -25.69 61.59 Favored 'General case' 0 N--CA 1.529 3.507 0 CA-C-O 118.874 -0.584 . . . . 0.0 110.696 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -93.7 -24.58 17.8 Favored 'General case' 0 N--CA 1.523 3.225 0 CA-C-O 118.132 -0.937 . . . . 0.0 111.043 178.518 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.92 -38.71 66.76 Favored 'General case' 1 N--CA 1.541 4.092 0 CA-C-N 119.728 1.149 . . . . 0.0 108.561 177.776 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 34.7 mt -57.35 -22.32 41.63 Favored 'General case' 0 N--CA 1.536 3.857 0 C-N-CA 123.665 0.786 . . . . 0.0 111.545 177.24 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 24.5 mmm180 -77.77 -51.39 10.6 Favored 'General case' 0 N--CA 1.527 3.406 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 66.97 50.57 45.85 Favored Glycine 1 N--CA 1.522 4.386 0 CA-C-O 119.086 -0.841 . . . . 0.0 112.494 178.396 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -124.76 -54.21 1.65 Allowed 'General case' 0 N--CA 1.527 3.405 0 CA-C-N 118.362 1.081 . . . . 0.0 108.431 178.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 30.6 mtt -148.98 64.32 1.04 Allowed 'General case' 0 N--CA 1.522 3.168 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 567' ' ' SER . . . . . 0.405 ' HA ' ' HB2' ' B' ' 571' ' ' LEU . 80.0 p -130.87 -4.83 4.02 Favored 'General case' 0 N--CA 1.52 3.063 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -175.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -93.49 -78.43 0.43 Allowed 'General case' 0 N--CA 1.528 3.468 0 CA-C-N 120.164 1.347 . . . . 0.0 111.255 -179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.79 -34.86 13.02 Favored 'General case' 1 N--CA 1.541 4.086 0 CA-C-N 119.146 0.885 . . . . 0.0 112.043 -178.492 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -76.96 -11.08 59.76 Favored 'General case' 0 N--CA 1.52 3.028 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -178.04 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 571' ' ' LEU . . . . . 0.81 HD23 HD11 ' B' ' 582' ' ' ILE . 16.8 tp -83.17 -43.65 15.93 Favored 'General case' 0 N--CA 1.532 3.639 0 CA-C-N 119.749 1.158 . . . . 0.0 112.649 -177.572 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -44.63 -29.21 0.7 Allowed 'General case' 1 N--CA 1.556 4.856 0 CA-C-N 120.249 1.386 . . . . 0.0 113.474 -178.591 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -66.4 -46.35 76.88 Favored 'General case' 0 N--CA 1.538 3.96 0 CA-C-N 118.698 0.681 . . . . 0.0 109.414 179.32 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -57.53 -51.13 70.71 Favored 'General case' 0 N--CA 1.525 3.293 0 C-N-CA 124.662 1.185 . . . . 0.0 112.413 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 61.0 mt -108.77 -61.83 1.55 Allowed 'General case' 0 N--CA 1.53 3.534 0 C-N-CA 122.988 0.515 . . . . 0.0 111.828 -177.538 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 122.81 20.82 2.76 Favored Glycine 1 N--CA 1.529 4.898 0 CA-C-O 118.199 -1.334 . . . . 0.0 112.619 -178.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -86.27 119.31 26.41 Favored 'General case' 0 N--CA 1.522 3.135 0 CA-C-N 119.577 1.689 . . . . 0.0 107.021 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -42.26 167.97 0.01 OUTLIER Glycine 1 N--CA 1.538 5.444 0 C-N-CA 124.616 1.103 . . . . 0.0 115.209 -177.536 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 579' ' ' ILE . . . . . 0.466 ' HA ' HG22 ' B' ' 582' ' ' ILE . 0.7 OUTLIER -80.27 -19.05 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.743 0 CA-C-O 117.632 -1.175 . . . . 0.0 108.568 178.74 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -69.22 -37.21 77.91 Favored 'General case' 0 N--CA 1.527 3.424 0 CA-C-N 119.879 1.218 . . . . 0.0 109.501 176.361 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.4 -36.65 38.81 Favored 'General case' 0 N--CA 1.536 3.831 0 CA-C-N 118.978 0.808 . . . . 0.0 111.776 178.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 582' ' ' ILE . . . . . 0.81 HD11 HD23 ' B' ' 571' ' ' LEU . 3.1 tt -67.07 -38.41 81.2 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.216 0 CA-C-O 118.975 -0.535 . . . . 0.0 112.223 -175.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 583' ' ' THR . . . . . 0.445 HG23 HG23 ' B' ' 582' ' ' ILE . 69.8 p -99.11 -27.34 13.87 Favored 'General case' 0 N--CA 1.508 2.443 0 CA-C-O 117.812 -1.089 . . . . 0.0 111.837 -178.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 13.3 ptt180 -73.66 -24.87 60.04 Favored 'General case' 0 N--CA 1.531 3.584 0 CA-C-N 120.061 1.301 . . . . 0.0 109.762 176.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -68.88 -36.11 81.08 Favored Glycine 1 N--CA 1.517 4.081 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 177.149 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 35.2 p -78.68 -29.49 45.62 Favored 'General case' 0 N--CA 1.531 3.607 0 CA-C-N 118.05 0.925 . . . . 0.0 111.278 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -64.01 -30.89 71.93 Favored 'General case' 1 N--CA 1.544 4.233 0 CA-C-N 119.346 0.976 . . . . 0.0 110.683 179.032 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 3.8 m -59.02 -35.98 74.2 Favored 'General case' 1 N--CA 1.541 4.108 0 C-N-CA 123.276 0.63 . . . . 0.0 110.411 178.412 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 43.7 mt -52.56 -45.84 66.57 Favored 'General case' 0 N--CA 1.532 3.641 0 C-N-CA 124.582 1.153 . . . . 0.0 111.398 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.52 -34.85 69.54 Favored 'General case' 1 N--CA 1.543 4.222 0 C-N-CA 123.268 0.627 . . . . 0.0 111.815 -179.744 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -81.2 -34.01 32.58 Favored 'General case' 0 N--CA 1.519 2.992 0 CA-C-O 118.878 -0.582 . . . . 0.0 111.859 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 592' ' ' ALA . . . . . 0.55 ' HB1' ' HD2' ' B' ' 593' ' ' PRO . . . -61.94 171.99 1.3 Allowed Pre-proline 1 N--CA 1.54 4.061 0 CA-C-O 118.218 -0.896 . . . . 0.0 111.707 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 593' ' ' PRO . . . . . 0.55 ' HD2' ' HB1' ' B' ' 592' ' ' ALA . 61.4 Cg_endo -83.17 140.73 10.0 Favored 'Trans proline' 0 C--N 1.377 2.033 0 C-N-CA 121.775 1.65 . . . . 0.0 109.207 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.3 t -79.64 -20.82 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.019 0 CA-C-O 117.928 -1.034 . . . . 0.0 111.027 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -63.54 -41.91 98.44 Favored 'General case' 0 N--CA 1.516 2.856 0 CA-C-N 120.101 1.319 . . . . 0.0 109.786 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 596' ' ' LEU . . . . . 0.529 ' CD2' HD22 ' A' ' 34' ' ' LEU . 7.4 mp -97.64 -13.79 21.33 Favored 'General case' 0 N--CA 1.511 2.592 0 C-N-CA 123.683 0.793 . . . . 0.0 111.349 177.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.16 -32.18 73.1 Favored 'General case' 1 N--CA 1.541 4.081 0 N-CA-C 103.595 -2.743 . . . . 0.0 103.595 168.496 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -54.16 -38.26 65.33 Favored 'General case' 0 N--CA 1.519 3.003 0 C-N-CA 124.532 1.133 . . . . 0.0 109.693 174.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 599' ' ' TRP . . . . . 0.631 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 49.7 t90 -63.25 -37.16 86.15 Favored 'General case' 0 N--CA 1.528 3.432 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 176.868 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -51.34 -39.03 56.16 Favored 'General case' 1 N--CA 1.543 4.204 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 175.869 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -69.64 -37.15 76.67 Favored 'General case' 1 N--CA 1.543 4.177 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 175.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 602' ' ' GLU . . . . . 0.43 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 2.9 mt-10 -59.35 -23.25 62.37 Favored 'General case' 1 N--CA 1.547 4.41 0 C-N-CA 123.424 0.69 . . . . 0.0 110.141 175.101 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 603' ' ' VAL . . . . . 0.543 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.2 OUTLIER -120.77 3.49 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.323 0 C-N-CA 123.566 0.747 . . . . 0.0 112.468 -177.399 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -111.68 -61.49 1.7 Allowed 'General case' 0 N--CA 1.509 2.508 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 176.447 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.535 3.792 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 177.679 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 . . . . . 0 N--CA 1.528 3.445 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.663 ' CE3' HD22 ' B' ' 551' ' ' LEU . 61.6 t-105 -54.65 -38.26 66.67 Favored 'General case' 0 N--CA 1.531 3.598 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 173.334 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.478 ' N ' HD22 ' A' ' 20' ' ' LEU . 2.8 mm? -80.03 -27.27 39.5 Favored 'General case' 0 N--CA 1.517 2.881 0 CA-C-O 117.263 -1.351 . . . . 0.0 112.279 -175.671 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 mmt180 -57.9 -31.54 66.86 Favored 'General case' 1 N--CA 1.549 4.508 0 N-CA-C 105.335 -2.098 . . . . 0.0 105.335 172.138 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.501 ' O ' ' HB2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -76.59 -41.98 44.23 Favored 'General case' 0 N--CA 1.503 2.2 0 CA-C-O 116.718 -1.61 . . . . 0.0 109.382 173.628 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 26.8 t -69.91 -25.04 27.24 Favored 'Isoleucine or valine' 1 N--CA 1.566 5.349 0 CA-C-N 120.566 1.53 . . . . 0.0 113.981 -174.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -76.29 -51.56 11.74 Favored 'General case' 0 N--CA 1.535 3.815 0 CA-C-N 120.392 1.451 . . . . 0.0 108.276 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.5 mp -74.68 -12.33 60.4 Favored 'General case' 0 N--CA 1.52 3.059 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 175.538 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.501 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -70.76 -36.92 73.33 Favored 'General case' 0 N--CA 1.521 3.097 0 N-CA-C 106.495 -1.669 . . . . 0.0 106.495 173.22 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.441 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 17.5 tttt -62.79 -22.15 66.4 Favored 'General case' 0 N--CA 1.525 3.276 0 CA-C-O 118.495 -0.764 . . . . 0.0 111.006 176.346 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -70.36 -45.53 65.89 Favored 'General case' 0 N--CA 1.538 3.927 0 N-CA-C 108.307 -0.998 . . . . 0.0 108.307 176.604 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.661 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -81.67 -9.37 59.67 Favored 'General case' 0 N--CA 1.508 2.455 0 CA-C-O 118.695 -0.669 . . . . 0.0 110.841 177.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.441 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -81.4 -36.15 29.88 Favored 'General case' 0 N--CA 1.533 3.707 0 CA-C-N 120.251 1.387 . . . . 0.0 109.066 179.987 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -59.99 -42.43 94.18 Favored 'General case' 0 N--CA 1.536 3.863 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 177.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 61.3 m-80 -90.15 -85.59 0.21 Allowed 'General case' 0 N--CA 1.513 2.717 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 176.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 147.94 50.96 0.0 OUTLIER 'General case' 1 N--CA 1.555 4.792 0 C-N-CA 128.042 2.537 . . . . 0.0 108.422 177.61 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.447 HD22 ' CD2' ' B' ' 596' ' ' LEU . 3.7 mt -111.63 12.38 21.2 Favored 'General case' 0 N--CA 1.526 3.339 0 C-N-CA 124.822 1.249 . . . . 0.0 110.021 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.549 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 51.6 p-80 -83.91 6.66 20.88 Favored 'General case' 0 N--CA 1.507 2.41 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 175.364 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.834 ' HA ' HD23 ' A' ' 39' ' ' LEU . 18.6 mt -96.37 -52.04 0.23 Allowed Pre-proline 0 N--CA 1.509 2.505 0 CA-C-O 116.794 -1.574 . . . . 0.0 108.828 -175.556 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.477 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 5.7 Cg_exo -66.02 -32.27 44.59 Favored 'Trans proline' 0 C--N 1.396 3.04 0 N-CA-C 106.489 -2.158 . . . . 0.0 106.489 170.642 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.549 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.9 OUTLIER -64.14 -39.22 93.57 Favored 'General case' 0 N--CA 1.517 2.9 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 175.679 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.834 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -71.35 -21.5 62.03 Favored 'General case' 1 N--CA 1.543 4.196 0 CA-C-N 119.324 0.966 . . . . 0.0 109.978 176.547 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -85.73 -3.19 58.83 Favored 'General case' 0 N--CA 1.527 3.42 0 CA-C-N 119.106 0.866 . . . . 0.0 111.131 177.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.569 HD13 ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -112.96 -36.09 5.23 Favored 'General case' 0 N--CA 1.53 3.548 0 CA-C-N 119.698 1.135 . . . . 0.0 111.558 -178.26 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.569 ' N ' HD13 ' A' ' 41' ' ' LEU . 3.9 ptt? -126.81 27.18 6.07 Favored 'General case' 1 N--CA 1.554 4.725 0 CA-C-N 120.249 1.386 . . . . 0.0 111.674 -179.687 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.3 tp -134.1 -61.89 0.77 Allowed 'General case' 0 N--CA 1.516 2.867 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.041 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.9 p 118.5 158.8 0.0 OUTLIER Pre-proline 1 N--CA 1.566 5.345 0 C-N-CA 128.348 2.659 . . . . 0.0 109.495 -178.885 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -69.26 -31.26 23.1 Favored 'Trans proline' 0 C--N 1.392 2.864 0 C-N-CA 122.163 1.908 . . . . 0.0 109.058 175.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -67.17 -21.07 65.81 Favored 'General case' 0 N--CA 1.528 3.441 0 CA-C-O 118.131 -0.937 . . . . 0.0 110.243 176.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -75.46 -29.74 59.74 Favored 'General case' 0 N--CA 1.521 3.086 0 CA-C-O 117.599 -1.191 . . . . 0.0 109.853 178.21 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -87.18 -22.03 25.54 Favored 'General case' 0 N--CA 1.539 3.995 0 CA-C-N 119.933 1.242 . . . . 0.0 109.026 174.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -71.58 -27.94 63.49 Favored 'General case' 0 N--CA 1.527 3.423 0 N-CA-C 106.433 -1.692 . . . . 0.0 106.433 172.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.48 -27.24 20.48 Favored 'General case' 0 N--CA 1.503 2.177 0 CA-C-O 117.432 -1.27 . . . . 0.0 110.405 178.603 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 27.6 tp -75.55 -21.74 57.64 Favored 'General case' 0 N--CA 1.537 3.915 0 N-CA-C 106.249 -1.76 . . . . 0.0 106.249 173.007 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.459 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -67.85 -72.42 0.8 Allowed Glycine 0 C--N 1.376 2.802 0 N-CA-C 109.198 -1.561 . . . . 0.0 109.198 176.326 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.7 m -66.08 -22.38 66.41 Favored 'General case' 0 N--CA 1.535 3.82 0 CA-C-O 117.468 -1.253 . . . . 0.0 113.204 -179.091 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.3 mtm180 -71.27 -52.66 17.71 Favored 'General case' 0 N--CA 1.538 3.933 0 CA-C-N 120.498 1.499 . . . . 0.0 107.464 177.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.3 t -67.63 -16.2 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.903 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.84 176.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -76.09 -46.66 27.85 Favored 'General case' 0 N--CA 1.531 3.59 0 CA-C-N 120.052 1.296 . . . . 0.0 111.172 178.422 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.589 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -72.2 -23.04 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.376 0 CA-C-N 120.563 1.529 . . . . 0.0 111.573 -178.922 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.452 HG11 HD11 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -88.79 -53.31 9.75 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.765 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 -179.903 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -57.39 -22.61 44.03 Favored 'General case' 0 N--CA 1.531 3.609 0 CA-C-O 118.454 -0.784 . . . . 0.0 110.755 178.078 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -95.33 -29.01 14.69 Favored 'General case' 0 N--CA 1.522 3.132 0 CA-C-O 118.148 -0.929 . . . . 0.0 110.365 177.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 45.6 tp -67.6 -56.33 9.83 Favored 'General case' 1 N--CA 1.539 4.007 0 CA-C-N 119.598 1.09 . . . . 0.0 110.073 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 54.9 mt -54.02 -24.64 17.68 Favored 'General case' 1 N--CA 1.541 4.09 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 -179.26 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -79.22 -48.83 13.51 Favored 'General case' 0 N--CA 1.53 3.531 0 CA-C-N 118.669 0.668 . . . . 0.0 110.045 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 74.61 81.14 0.48 Allowed Glycine 1 N--CA 1.521 4.344 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 179.491 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -158.57 -57.17 0.07 Allowed 'General case' 0 N--CA 1.53 3.528 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 44.1 mtt -138.61 76.56 1.58 Allowed 'General case' 0 N--CA 1.522 3.156 0 N-CA-C 104.344 -2.465 . . . . 0.0 104.344 177.51 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.5 m -128.5 -33.17 2.12 Favored 'General case' 0 N--CA 1.525 3.324 0 N-CA-C 114.104 1.15 . . . . 0.0 114.104 -172.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -105.91 -65.65 1.05 Allowed 'General case' 0 N--CA 1.526 3.343 0 CA-C-N 118.727 0.694 . . . . 0.0 111.933 -176.57 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 10.7 mtt180 -97.24 -45.59 6.45 Favored 'General case' 0 N--CA 1.526 3.361 0 CA-C-N 118.485 0.584 . . . . 0.0 111.419 -177.45 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -71.81 -14.87 62.1 Favored 'General case' 0 N--CA 1.521 3.083 0 CA-C-O 118.439 -0.791 . . . . 0.0 112.297 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.605 HD23 HG21 ' A' ' 82' ' ' ILE . 24.1 tp -79.14 -54.9 5.53 Favored 'General case' 0 N--CA 1.525 3.298 0 CA-C-N 119.484 1.038 . . . . 0.0 111.62 -178.666 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -41.77 -36.55 1.03 Allowed 'General case' 1 N--CA 1.549 4.511 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -178.174 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 14.1 t30 -74.12 -39.97 62.99 Favored 'General case' 0 N--CA 1.532 3.642 0 CA-C-N 118.112 0.415 . . . . 0.0 111.035 -178.242 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -46.3 -54.38 9.04 Favored 'General case' 0 N--CA 1.537 3.886 0 C-N-CA 124.824 1.25 . . . . 0.0 113.409 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -133.23 -39.88 0.92 Allowed 'General case' 0 N--CA 1.533 3.683 0 CA-C-O 118.63 -0.7 . . . . 0.0 111.835 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 117.77 86.79 1.17 Allowed Glycine 1 N--CA 1.523 4.486 0 N-CA-C 110.51 -1.036 . . . . 0.0 110.51 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -115.92 -47.1 2.8 Favored 'General case' 0 N--CA 1.522 3.152 0 C-N-CA 123.613 0.765 . . . . 0.0 109.397 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.99 161.67 22.84 Favored Glycine 1 N--CA 1.525 4.629 0 N-CA-C 109.771 -1.331 . . . . 0.0 109.771 -179.039 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -83.11 -14.98 11.76 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.858 0 CA-C-N 119.439 1.619 . . . . 0.0 108.133 177.781 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.94 -30.72 67.11 Favored 'General case' 0 N--CA 1.518 2.949 0 CA-C-O 117.463 -1.256 . . . . 0.0 111.239 177.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.9 p -93.4 -36.38 12.52 Favored 'General case' 1 N--CA 1.545 4.316 0 CA-C-N 120.45 1.477 . . . . 0.0 112.133 -179.222 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.605 HG21 HD23 ' A' ' 71' ' ' LEU . 1.0 OUTLIER -73.93 -25.38 20.24 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.056 0 CA-C-O 118.101 -0.952 . . . . 0.0 111.898 -179.122 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.5 p -103.95 -29.67 10.79 Favored 'General case' 0 N--CA 1.513 2.697 0 CA-C-O 117.954 -1.022 . . . . 0.0 110.554 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.0 ptt180 -73.28 -25.59 60.74 Favored 'General case' 1 N--CA 1.545 4.287 0 CA-C-N 120.042 1.292 . . . . 0.0 108.154 173.84 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -64.71 -27.58 72.18 Favored Glycine 1 N--CA 1.524 4.543 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 174.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 20.1 m -70.33 -35.47 73.63 Favored 'General case' 0 N--CA 1.535 3.795 0 CA-C-N 117.973 0.886 . . . . 0.0 108.753 176.28 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -60.92 -30.69 70.35 Favored 'General case' 1 N--CA 1.542 4.143 0 C-N-CA 123.457 0.703 . . . . 0.0 110.096 177.379 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.481 ' HB3' ' HA ' ' B' ' 541' ' ' LEU . 1.6 m -64.76 -38.14 89.98 Favored 'General case' 0 N--CA 1.533 3.711 0 C-N-CA 123.509 0.723 . . . . 0.0 110.716 179.33 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.8 mt -53.39 -37.91 62.9 Favored 'General case' 0 N--CA 1.538 3.935 0 C-N-CA 123.734 0.813 . . . . 0.0 111.135 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -68.27 -36.3 79.19 Favored 'General case' 0 N--CA 1.534 3.755 0 C-N-CA 123.096 0.558 . . . . 0.0 111.174 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.67 -36.77 81.32 Favored 'General case' 0 N--CA 1.525 3.276 0 C-N-CA 123.216 0.607 . . . . 0.0 111.905 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.35 158.41 88.06 Favored Pre-proline 0 N--CA 1.526 3.363 0 CA-C-O 118.535 -0.745 . . . . 0.0 111.851 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -86.46 -178.54 2.75 Favored 'Trans proline' 0 CA--C 1.563 1.972 0 C-N-CA 122.331 2.021 . . . . 0.0 111.189 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.446 ' HA ' ' HB3' ' A' ' 97' ' ' ARG . 3.1 t -97.04 -28.76 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.101 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.773 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -59.78 -45.22 92.94 Favored 'General case' 0 N--CA 1.514 2.762 0 CA-C-N 119.666 1.121 . . . . 0.0 110.009 -178.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.587 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.6 mp -100.02 -11.63 20.42 Favored 'General case' 0 N--CA 1.511 2.591 0 CA-C-O 118.307 -0.854 . . . . 0.0 112.706 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.446 ' HB3' ' HA ' ' A' ' 94' ' ' VAL . 0.2 OUTLIER -67.56 -30.84 70.58 Favored 'General case' 1 N--CA 1.544 4.269 0 N-CA-C 102.368 -3.197 . . . . 0.0 102.368 167.849 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -56.67 -38.54 72.37 Favored 'General case' 0 N--CA 1.515 2.823 0 C-N-CA 124.134 0.973 . . . . 0.0 110.277 175.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.646 ' CH2' ' HB2' ' B' ' 529' ' ' ALA . 53.5 t90 -66.45 -34.22 77.45 Favored 'General case' 0 N--CA 1.538 3.963 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 176.282 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.52 -37.15 62.53 Favored 'General case' 0 N--CA 1.535 3.775 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 176.152 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -68.06 -38.94 83.0 Favored 'General case' 1 N--CA 1.541 4.089 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 175.341 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.51 -23.8 58.99 Favored 'General case' 1 N--CA 1.544 4.247 0 C-N-CA 123.459 0.704 . . . . 0.0 110.643 175.734 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.504 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -120.88 2.73 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.493 0 C-N-CA 123.375 0.67 . . . . 0.0 112.617 -177.143 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -109.57 -56.95 2.24 Favored 'General case' 0 N--CA 1.518 2.935 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 177.117 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.3 tp . . . . . 0 N--CA 1.531 3.591 0 C-N-CA 125.149 1.38 . . . . 0.0 111.491 179.325 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 . . . . . 0 N--CA 1.52 3.047 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 519' ' ' TRP . . . . . 0.727 ' CE2' HD22 ' A' ' 39' ' ' LEU . 63.1 t-105 -42.54 -26.43 0.12 Allowed 'General case' 1 N--CA 1.552 4.64 0 C-N-CA 124.558 1.143 . . . . 0.0 113.753 178.523 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 520' ' ' LEU . . . . . 0.54 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.4 mm? -93.88 -34.29 13.18 Favored 'General case' 0 N--CA 1.526 3.369 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -172.299 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.58 -25.02 68.04 Favored 'General case' 0 N--CA 1.534 3.755 0 N-CA-C 106.291 -1.744 . . . . 0.0 106.291 172.521 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 522' ' ' PHE . . . . . 0.459 ' CE2' ' HA2' ' A' ' 52' ' ' GLY . 2.2 m-85 -78.74 -37.33 41.56 Favored 'General case' 0 N--CA 1.513 2.716 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 173.882 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 523' ' ' VAL . . . . . 0.47 HG23 ' O ' ' B' ' 519' ' ' TRP . 25.4 t -66.4 -23.35 31.46 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.232 0 CA-C-N 120.169 1.349 . . . . 0.0 111.646 179.103 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -75.19 -49.38 19.61 Favored 'General case' 0 N--CA 1.536 3.849 0 CA-C-N 120.063 1.301 . . . . 0.0 108.345 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 1.8 tp -65.5 -29.31 69.94 Favored 'General case' 1 N--CA 1.54 4.05 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 176.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 526' ' ' LEU . . . . . 0.443 HD23 ' O ' ' B' ' 522' ' ' PHE . 0.9 OUTLIER -68.41 -33.05 73.54 Favored 'General case' 0 N--CA 1.522 3.171 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 177.128 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 527' ' ' LYS . . . . . 0.447 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 31.0 ttmt -65.89 -25.52 67.21 Favored 'General case' 0 N--CA 1.519 3.01 0 CA-C-O 118.387 -0.816 . . . . 0.0 111.144 177.106 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -69.22 -39.94 78.28 Favored 'General case' 0 N--CA 1.536 3.829 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 176.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 529' ' ' ALA . . . . . 0.646 ' HB2' ' CH2' ' A' ' 99' ' ' TRP . . . -88.63 -9.5 51.93 Favored 'General case' 0 N--CA 1.506 2.367 0 CA-C-O 118.417 -0.802 . . . . 0.0 111.295 178.048 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 530' ' ' TYR . . . . . 0.447 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.9 OUTLIER -81.61 -32.9 31.79 Favored 'General case' 0 N--CA 1.532 3.625 0 CA-C-N 120.439 1.472 . . . . 0.0 108.733 -179.919 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -61.6 -44.43 97.02 Favored 'General case' 0 N--CA 1.538 3.944 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 176.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 61.4 m-80 -91.56 -86.45 0.22 Allowed 'General case' 0 N--CA 1.517 2.878 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 177.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 150.72 52.41 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.855 0 C-N-CA 128.027 2.531 . . . . 0.0 107.818 178.179 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 534' ' ' LEU . . . . . 0.587 HD22 ' CD2' ' A' ' 96' ' ' LEU . 4.8 mt -111.08 10.65 22.02 Favored 'General case' 0 N--CA 1.528 3.429 0 C-N-CA 124.558 1.143 . . . . 0.0 110.831 -178.816 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 535' ' ' HIS . . . . . 0.611 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 39.9 p-80 -82.43 -0.32 45.67 Favored 'General case' 0 N--CA 1.517 2.888 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 174.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 536' ' ' LEU . . . . . 0.469 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 34.6 mt -93.96 -51.63 0.26 Allowed Pre-proline 0 N--CA 1.504 2.266 0 CA-C-O 116.728 -1.606 . . . . 0.0 108.952 -175.909 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 537' ' ' PRO . . . . . 0.469 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 6.3 Cg_exo -66.19 -33.86 38.43 Favored 'Trans proline' 0 C--N 1.394 2.941 0 C-N-CA 122.158 1.906 . . . . 0.0 107.235 171.128 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 538' ' ' LEU . . . . . 0.438 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 0.6 OUTLIER -64.07 -45.69 87.6 Favored 'General case' 0 N--CA 1.521 3.108 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 176.292 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . 0.262 2.2 pp -81.89 -2.86 52.67 Favored 'General case' 1 N--CA 1.542 4.161 0 CA-C-N 118.824 0.738 . . . . 0.0 111.9 178.392 . . . . . . . . 3 2 . 1 . 009 nuclear build core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -81.51 -12.01 58.99 Favored 'General case' 0 N--CA 1.518 2.946 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 172.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 541' ' ' LEU . . . . . 0.629 HD13 ' N ' ' B' ' 542' ' ' MET . 0.0 OUTLIER -108.3 -45.05 3.99 Favored 'General case' 0 N--CA 1.512 2.635 0 C-N-CA 124.476 1.11 . . . . 0.0 109.639 -178.838 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 542' ' ' MET . . . . . 0.629 ' N ' HD13 ' B' ' 541' ' ' LEU . 12.2 ptp -84.51 -28.28 26.81 Favored 'General case' 1 N--CA 1.546 4.326 0 CA-C-O 117.61 -1.186 . . . . 0.0 111.988 -178.939 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 5.7 mp -107.35 -99.14 0.36 Allowed 'General case' 0 N--CA 1.527 3.392 0 CA-C-O 117.111 -1.423 . . . . 0.0 112.759 -176.893 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 544' ' ' THR . . . . . 0.428 HG23 ' HG3' ' B' ' 547' ' ' GLU . 3.1 t 153.77 147.48 0.0 OUTLIER Pre-proline 1 N--CA 1.574 5.774 0 C-N-CA 126.224 1.809 . . . . 0.0 109.023 -177.855 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -58.67 -34.33 98.84 Favored 'Trans proline' 0 N--CA 1.524 3.301 0 C-N-CA 123.32 2.68 . . . . 0.0 113.502 -179.141 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -57.79 -30.02 65.35 Favored 'General case' 1 N--CA 1.542 4.135 0 CA-C-N 118.508 0.594 . . . . 0.0 111.479 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 547' ' ' GLU . . . . . 0.428 ' HG3' HG23 ' B' ' 544' ' ' THR . 39.4 mt-10 -67.86 -38.5 83.19 Favored 'General case' 0 N--CA 1.526 3.33 0 CA-C-O 118.307 -0.854 . . . . 0.0 110.6 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 548' ' ' ARG . . . . . 0.439 ' HB2' ' HB2' ' A' ' 19' ' ' TRP . 4.2 ptt180 -76.44 -20.85 56.64 Favored 'General case' 0 N--CA 1.529 3.492 0 CA-C-O 118.135 -0.936 . . . . 0.0 111.289 178.037 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -65.57 -49.37 69.08 Favored 'General case' 0 N--CA 1.537 3.908 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 174.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -77.58 -13.88 59.8 Favored 'General case' 0 N--CA 1.511 2.598 0 CA-C-O 117.073 -1.441 . . . . 0.0 111.817 178.059 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 551' ' ' LEU . . . . . 0.663 HD22 ' CE3' ' A' ' 19' ' ' TRP . 11.7 tp -79.13 -30.39 43.66 Favored 'General case' 0 N--CA 1.53 3.529 0 CA-C-N 120.817 1.644 . . . . 0.0 107.73 175.028 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -71.15 -56.9 6.56 Favored Glycine 0 N--CA 1.498 2.783 0 N-CA-C 108.949 -1.661 . . . . 0.0 108.949 178.795 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 3.1 m -64.43 -31.29 72.44 Favored 'General case' 1 N--CA 1.541 4.092 0 CA-C-O 118.337 -0.839 . . . . 0.0 112.059 -179.169 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -65.5 -50.6 64.69 Favored 'General case' 1 N--CA 1.546 4.369 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 176.432 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 555' ' ' VAL . . . . . 0.44 HG23 ' O ' ' B' ' 551' ' ' LEU . 32.0 t -66.05 -15.98 19.87 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.849 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.03 177.434 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 18.6 mmt180 -79.82 -44.32 20.79 Favored 'General case' 0 N--CA 1.526 3.363 0 CA-C-O 117.327 -1.321 . . . . 0.0 111.319 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 557' ' ' ILE . . . . . 0.47 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -72.81 -24.58 21.41 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.186 0 CA-C-N 121.425 1.921 . . . . 0.0 110.406 -179.757 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 558' ' ' VAL . . . . . 0.47 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.0 OUTLIER -86.22 -53.47 10.3 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.073 0 CA-C-N 119.997 1.271 . . . . 0.0 107.635 -179.739 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -61.36 -22.04 64.58 Favored 'General case' 0 N--CA 1.532 3.636 0 CA-C-O 118.497 -0.763 . . . . 0.0 110.971 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -93.81 -24.78 17.65 Favored 'General case' 0 N--CA 1.523 3.183 0 CA-C-O 118.081 -0.961 . . . . 0.0 110.07 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 14.3 tp -71.01 -53.77 13.6 Favored 'General case' 0 N--CA 1.535 3.813 0 CA-C-N 119.708 1.14 . . . . 0.0 108.255 178.655 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 36.5 mt -48.62 -30.1 5.04 Favored 'General case' 1 N--CA 1.543 4.218 0 C-N-CA 124.157 0.983 . . . . 0.0 112.583 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 20.5 mmm180 -79.68 -49.89 11.44 Favored 'General case' 0 N--CA 1.53 3.546 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 72.11 89.19 0.13 Allowed Glycine 1 N--CA 1.52 4.274 0 CA-C-O 119.346 -0.697 . . . . 0.0 111.822 178.412 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -155.87 -55.82 0.09 Allowed 'General case' 0 N--CA 1.528 3.428 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 2.1 ptt? -147.84 66.34 1.11 Allowed 'General case' 0 N--CA 1.527 3.388 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 178.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 7.6 t -125.55 -15.41 6.09 Favored 'General case' 0 N--CA 1.519 3.001 0 CA-C-O 117.484 -1.246 . . . . 0.0 114.05 -176.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -98.81 -55.43 2.72 Favored 'General case' 0 N--CA 1.533 3.703 0 CA-C-N 120.803 1.638 . . . . 0.0 111.582 -178.436 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -107.49 -38.48 5.91 Favored 'General case' 0 N--CA 1.532 3.641 0 C-N-CA 123.433 0.693 . . . . 0.0 111.728 -177.344 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -81.52 -8.71 59.76 Favored 'General case' 0 N--CA 1.518 2.966 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -176.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 571' ' ' LEU . . . . . 0.93 HD23 HD11 ' B' ' 582' ' ' ILE . 26.1 tp -85.85 -48.6 8.61 Favored 'General case' 0 N--CA 1.535 3.783 0 CA-C-N 120.306 1.412 . . . . 0.0 112.973 -177.605 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -45.57 -29.54 1.22 Allowed 'General case' 1 N--CA 1.555 4.784 0 CA-C-N 120.23 1.377 . . . . 0.0 113.866 -177.517 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -67.09 -41.53 86.15 Favored 'General case' 1 N--CA 1.54 4.034 0 CA-C-N 118.819 0.736 . . . . 0.0 110.26 -179.507 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -48.41 -62.22 1.61 Allowed 'General case' 0 N--CA 1.529 3.5 0 C-N-CA 125.167 1.387 . . . . 0.0 113.157 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 575' ' ' LEU . . . . . 0.544 HD11 ' HB2' ' B' ' 577' ' ' ALA . 3.4 pp -119.09 -39.76 2.89 Favored 'General case' 0 N--CA 1.532 3.666 0 CA-C-N 118.736 0.698 . . . . 0.0 111.705 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 120.62 37.24 0.74 Allowed Glycine 1 N--CA 1.527 4.729 0 CA-C-O 118.572 -1.127 . . . . 0.0 111.953 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 577' ' ' ALA . . . . . 0.544 ' HB2' HD11 ' B' ' 575' ' ' LEU . . . -89.23 108.52 19.66 Favored 'General case' 0 N--CA 1.521 3.109 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 177.661 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -43.13 170.33 0.01 OUTLIER Glycine 1 N--CA 1.53 4.903 0 C-N-CA 125.095 1.331 . . . . 0.0 115.685 -177.53 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 579' ' ' ILE . . . . . 0.531 ' HA ' HG22 ' B' ' 582' ' ' ILE . 0.5 OUTLIER -84.14 -15.57 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.642 0 CA-C-O 117.549 -1.215 . . . . 0.0 108.724 177.464 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -70.09 -38.65 75.72 Favored 'General case' 0 N--CA 1.523 3.217 0 CA-C-N 120.213 1.37 . . . . 0.0 108.951 176.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -79.66 -36.3 37.93 Favored 'General case' 0 N--CA 1.539 3.996 0 CA-C-N 118.609 0.641 . . . . 0.0 112.247 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 582' ' ' ILE . . . . . 0.93 HD11 HD23 ' B' ' 571' ' ' LEU . 1.6 tt -71.01 -37.67 68.69 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.212 0 C-N-CA 122.9 0.48 . . . . 0.0 111.601 -175.605 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 65.0 p -98.25 -23.56 15.61 Favored 'General case' 0 N--CA 1.512 2.633 0 CA-C-O 117.968 -1.015 . . . . 0.0 111.746 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 13.8 ptt180 -79.7 -22.06 43.85 Favored 'General case' 0 N--CA 1.531 3.622 0 CA-C-N 120.164 1.347 . . . . 0.0 108.355 173.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -65.36 -33.63 87.14 Favored Glycine 1 N--CA 1.519 4.214 0 N-CA-C 108.975 -1.65 . . . . 0.0 108.975 175.807 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 83.0 p -64.1 -32.79 74.48 Favored 'General case' 0 N--CA 1.537 3.9 0 CA-C-N 118.224 1.012 . . . . 0.0 109.97 176.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -62.1 -31.53 71.99 Favored 'General case' 0 N--CA 1.538 3.962 0 C-N-CA 123.501 0.72 . . . . 0.0 110.826 178.463 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 50.3 m -63.17 -43.19 98.95 Favored 'General case' 1 N--CA 1.541 4.096 0 C-N-CA 123.379 0.672 . . . . 0.0 110.318 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 36.1 mt -54.86 -44.74 74.27 Favored 'General case' 0 N--CA 1.527 3.38 0 C-N-CA 124.015 0.926 . . . . 0.0 110.96 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -29.08 66.67 Favored 'General case' 0 N--CA 1.537 3.876 0 CA-C-O 118.76 -0.638 . . . . 0.0 111.135 178.87 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -64.84 -42.9 94.54 Favored 'General case' 0 N--CA 1.528 3.47 0 CA-C-N 118.737 0.699 . . . . 0.0 110.957 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -65.44 162.7 39.41 Favored Pre-proline 0 N--CA 1.534 3.767 0 CA-C-O 118.426 -0.797 . . . . 0.0 112.165 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 593' ' ' PRO . . . . . 0.43 ' O ' ' HB2' ' B' ' 597' ' ' ARG . 37.9 Cg_endo -79.23 179.77 6.13 Favored 'Trans proline' 0 C--N 1.38 2.185 0 C-N-CA 122.02 1.813 . . . . 0.0 111.081 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -94.27 -26.36 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.306 0 CA-C-O 118.01 -0.995 . . . . 0.0 111.495 -178.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -61.39 -45.1 95.77 Favored 'General case' 0 N--CA 1.517 2.898 0 CA-C-N 119.837 1.198 . . . . 0.0 109.47 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 596' ' ' LEU . . . . . 0.456 ' N ' HD12 ' B' ' 596' ' ' LEU . 6.9 mp -97.06 -9.09 28.78 Favored 'General case' 0 N--CA 1.508 2.466 0 C-N-CA 123.233 0.613 . . . . 0.0 111.843 179.086 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 597' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' B' ' 593' ' ' PRO . 0.0 OUTLIER -64.68 -39.18 93.22 Favored 'General case' 1 N--CA 1.548 4.464 0 N-CA-C 102.516 -3.142 . . . . 0.0 102.516 167.456 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -49.84 -36.77 27.96 Favored 'General case' 0 N--CA 1.519 2.985 0 C-N-CA 124.311 1.044 . . . . 0.0 111.676 174.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 599' ' ' TRP . . . . . 0.661 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 39.0 t90 -64.5 -40.67 96.09 Favored 'General case' 0 N--CA 1.528 3.468 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 178.303 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 10.6 mp -54.17 -32.83 56.55 Favored 'General case' 1 N--CA 1.544 4.228 0 CA-C-N 118.92 0.782 . . . . 0.0 109.226 176.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -74.96 -34.56 62.05 Favored 'General case' 0 N--CA 1.528 3.468 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 176.046 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 602' ' ' GLU . . . . . 0.452 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.5 OUTLIER -63.99 -22.77 67.07 Favored 'General case' 1 N--CA 1.549 4.501 0 C-N-CA 124.903 1.281 . . . . 0.0 111.405 175.969 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' B' B ' 603' ' ' VAL . . . . . 0.546 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.0 OUTLIER -108.8 -20.77 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.611 0 CA-C-O 118.01 -0.995 . . . . 0.0 112.231 -175.067 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 7.2 mp -88.78 -58.68 2.46 Favored 'General case' 0 N--CA 1.523 3.193 0 N-CA-C 105.499 -2.038 . . . . 0.0 105.499 175.309 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.528 3.457 0 C-N-CA 123.636 0.774 . . . . 0.0 110.658 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 . . . . . 0 N--CA 1.521 3.092 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.811 ' CE3' HD22 ' B' ' 551' ' ' LEU . 74.4 t-105 -50.62 -39.5 50.37 Favored 'General case' 0 N--CA 1.538 3.945 0 CA-C-N 119.572 1.078 . . . . 0.0 110.969 178.332 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.441 ' N ' HD22 ' A' ' 20' ' ' LEU . 2.2 mm? -81.18 -27.7 35.28 Favored 'General case' 0 N--CA 1.524 3.271 0 CA-C-O 117.792 -1.099 . . . . 0.0 112.387 -174.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.31 -28.12 66.51 Favored 'General case' 1 N--CA 1.54 4.072 0 N-CA-C 106.306 -1.738 . . . . 0.0 106.306 172.338 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.577 ' CG ' HD21 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -82.52 -37.46 25.21 Favored 'General case' 0 N--CA 1.503 2.215 0 CA-C-O 116.755 -1.593 . . . . 0.0 108.822 173.778 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.9 t -67.06 -25.37 34.01 Favored 'Isoleucine or valine' 1 N--CA 1.563 5.215 0 CA-C-N 121.283 1.856 . . . . 0.0 112.444 -176.255 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -78.03 -51.46 10.29 Favored 'General case' 0 N--CA 1.534 3.736 0 CA-C-N 119.901 1.228 . . . . 0.0 107.916 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.94 -19.83 65.79 Favored 'General case' 0 N--CA 1.537 3.889 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 176.04 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.36 -40.4 67.35 Favored 'General case' 0 N--CA 1.515 2.797 0 CA-C-O 117.873 -1.06 . . . . 0.0 108.153 177.465 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.444 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 20.2 mttt -59.77 -20.96 59.9 Favored 'General case' 0 N--CA 1.531 3.603 0 CA-C-O 118.3 -0.857 . . . . 0.0 111.42 176.551 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -73.6 -43.63 59.2 Favored 'General case' 0 N--CA 1.531 3.603 0 CA-C-N 119.273 0.942 . . . . 0.0 108.684 176.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.649 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -89.5 -1.53 58.07 Favored 'General case' 0 N--CA 1.511 2.6 0 CA-C-O 118.818 -0.61 . . . . 0.0 110.843 177.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.444 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -89.03 -34.64 16.73 Favored 'General case' 0 N--CA 1.533 3.683 0 CA-C-N 120.003 1.274 . . . . 0.0 108.594 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -65.04 -40.58 94.98 Favored 'General case' 0 N--CA 1.532 3.635 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 176.387 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 -89.99 -89.46 0.16 Allowed 'General case' 0 N--CA 1.513 2.709 0 N-CA-C 106.766 -1.568 . . . . 0.0 106.766 176.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 p30 153.11 44.64 0.0 OUTLIER 'General case' 1 N--CA 1.561 5.103 0 C-N-CA 127.504 2.322 . . . . 0.0 109.034 177.785 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.61 HD22 ' CD2' ' B' ' 596' ' ' LEU . 9.1 mt -103.08 15.14 30.16 Favored 'General case' 0 N--CA 1.524 3.268 0 C-N-CA 123.966 0.907 . . . . 0.0 110.901 -179.001 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.597 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 54.5 p-80 -84.91 5.5 28.71 Favored 'General case' 0 CA--C 1.594 2.648 0 C-N-CA 123.38 0.672 . . . . 0.0 109.22 174.844 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.519 HD23 HD12 ' A' ' 39' ' ' LEU . 18.9 mt -95.53 -49.58 0.25 Allowed Pre-proline 0 N--CA 1.508 2.466 0 C-N-CA 125.792 1.637 . . . . 0.0 109.031 -175.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.456 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 4.4 Cg_exo -67.21 -37.32 18.64 Favored 'Trans proline' 0 C--N 1.388 2.64 0 N-CA-C 106.053 -2.326 . . . . 0.0 106.053 169.539 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.597 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 1.9 tm? -60.64 -36.75 79.42 Favored 'General case' 0 N--CA 1.53 3.565 0 C-N-CA 124.058 0.943 . . . . 0.0 108.839 175.539 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.742 HD11 ' CE2' ' B' ' 519' ' ' TRP . 0.5 OUTLIER -59.18 -49.43 77.9 Favored 'General case' 1 N--CA 1.553 4.71 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 176.134 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.5 t30 -59.28 -15.59 16.63 Favored 'General case' 0 N--CA 1.536 3.832 0 CA-C-O 118.113 -0.946 . . . . 0.0 113.52 -178.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.457 HD23 ' HA ' ' A' ' 38' ' ' LEU . 0.7 OUTLIER -103.72 -46.77 4.42 Favored 'General case' 0 N--CA 1.522 3.133 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 -177.178 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.3 ptt? -122.04 14.87 10.71 Favored 'General case' 1 N--CA 1.554 4.748 0 CA-C-N 120.014 1.279 . . . . 0.0 113.016 -174.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.7 mp -123.06 -48.97 1.97 Allowed 'General case' 0 N--CA 1.494 1.725 0 CA-C-O 117.702 -1.142 . . . . 0.0 110.432 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 77.5 p 107.27 158.94 0.0 OUTLIER Pre-proline 1 N--CA 1.566 5.333 0 C-N-CA 127.642 2.377 . . . . 0.0 110.919 -179.171 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo -71.86 -32.14 11.8 Favored 'Trans proline' 0 C--N 1.391 2.789 0 C-N-CA 122.145 1.897 . . . . 0.0 107.371 172.13 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -69.03 -14.79 63.24 Favored 'General case' 0 N--CA 1.521 3.114 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.695 176.342 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -77.94 -40.74 38.54 Favored 'General case' 0 N--CA 1.514 2.744 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 177.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.9 ptt-85 -83.36 -11.5 57.56 Favored 'General case' 0 N--CA 1.532 3.662 0 CA-C-N 119.253 0.933 . . . . 0.0 109.933 175.144 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -74.12 -39.44 63.34 Favored 'General case' 0 N--CA 1.525 3.302 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 174.514 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.42 ' HB1' ' CZ ' ' A' ' 54' ' ' ARG . . . -84.24 -31.4 25.02 Favored 'General case' 0 N--CA 1.501 2.102 0 CA-C-O 117.432 -1.271 . . . . 0.0 110.357 -179.572 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.414 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 17.9 tp -70.35 -25.53 63.32 Favored 'General case' 1 N--CA 1.545 4.28 0 CA-C-N 120.961 1.71 . . . . 0.0 106.82 173.426 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.449 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -65.28 -73.45 0.59 Allowed Glycine 0 N--CA 1.507 3.382 0 C-N-CA 125.56 1.552 . . . . 0.0 111.295 176.602 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 m -69.66 -25.56 63.96 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-O 117.736 -1.126 . . . . 0.0 113.159 -177.306 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.42 ' CZ ' ' HB1' ' A' ' 50' ' ' ALA . 36.7 mtm180 -71.54 -48.34 49.29 Favored 'General case' 0 N--CA 1.53 3.529 0 CA-C-N 120.101 1.319 . . . . 0.0 107.849 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 51' ' ' LEU . 21.6 t -67.06 -18.07 23.64 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.042 0 CA-C-N 119.543 1.065 . . . . 0.0 109.684 175.206 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.82 -48.46 31.16 Favored 'General case' 0 N--CA 1.529 3.52 0 CA-C-N 119.828 1.195 . . . . 0.0 111.559 178.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.416 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -73.93 -24.84 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.555 0 CA-C-N 120.619 1.554 . . . . 0.0 111.378 -178.83 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.56 HG11 HD11 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -85.01 -49.33 15.79 Favored 'Isoleucine or valine' 1 N--CA 1.546 4.354 0 CA-C-N 120.419 1.463 . . . . 0.0 107.666 -179.228 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -62.04 -27.33 68.81 Favored 'General case' 0 N--CA 1.528 3.441 0 CA-C-O 118.917 -0.563 . . . . 0.0 109.961 178.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -91.21 -19.62 22.84 Favored 'General case' 0 N--CA 1.521 3.106 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.683 177.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.2 mt -76.68 -47.09 23.16 Favored 'General case' 0 N--CA 1.537 3.91 0 CA-C-N 119.71 1.141 . . . . 0.0 108.55 178.296 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 47.4 mt -52.6 -27.6 17.59 Favored 'General case' 0 N--CA 1.539 3.986 0 C-N-CA 124.366 1.066 . . . . 0.0 112.319 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 27.9 mmm180 -92.31 -48.61 6.58 Favored 'General case' 0 N--CA 1.526 3.333 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.4 79.3 0.46 Allowed Glycine 1 N--CA 1.52 4.241 0 CA-C-O 119.433 -0.648 . . . . 0.0 111.933 178.342 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -143.74 -59.44 0.4 Allowed 'General case' 0 N--CA 1.524 3.265 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 38.5 mtt -137.0 70.62 1.4 Allowed 'General case' 0 N--CA 1.522 3.149 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 178.079 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.418 ' HA ' HD22 ' A' ' 71' ' ' LEU . 9.7 t -128.77 -25.39 2.84 Favored 'General case' 0 N--CA 1.524 3.237 0 CA-C-O 117.573 -1.203 . . . . 0.0 113.634 -176.854 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -104.48 -59.89 1.67 Allowed 'General case' 0 N--CA 1.531 3.589 0 CA-C-N 120.166 1.348 . . . . 0.0 112.352 -176.298 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.79 -62.83 1.37 Allowed 'General case' 0 N--CA 1.527 3.421 0 C-N-CA 122.916 0.486 . . . . 0.0 111.741 -176.693 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -73.7 -3.54 28.91 Favored 'General case' 0 N--CA 1.52 3.033 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -176.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.59 HD23 HG21 ' A' ' 82' ' ' ILE . 46.2 tp -78.51 -51.38 10.06 Favored 'General case' 0 N--CA 1.525 3.308 0 CA-C-N 120.35 1.432 . . . . 0.0 112.683 -178.6 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -44.65 -31.29 1.11 Allowed 'General case' 1 N--CA 1.547 4.418 0 CA-C-N 119.612 1.096 . . . . 0.0 113.787 -176.538 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 25.2 t30 -71.67 -41.09 69.14 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-N 118.389 0.54 . . . . 0.0 110.459 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -62.97 -56.43 17.21 Favored 'General case' 0 N--CA 1.524 3.235 0 C-N-CA 124.076 0.95 . . . . 0.0 112.667 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.402 HD12 HD11 ' A' ' 71' ' ' LEU . 42.7 mt -99.54 -53.44 3.2 Favored 'General case' 0 N--CA 1.531 3.599 0 C-N-CA 123.013 0.525 . . . . 0.0 111.6 -177.561 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 117.23 25.49 3.22 Favored Glycine 1 N--CA 1.525 4.619 0 CA-C-O 118.392 -1.226 . . . . 0.0 111.186 -177.693 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -93.51 119.93 33.17 Favored 'General case' 0 N--CA 1.515 2.804 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 178.285 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -45.24 171.3 0.01 OUTLIER Glycine 1 N--CA 1.533 5.103 0 C-N-CA 124.253 0.93 . . . . 0.0 115.07 -178.063 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -80.21 -17.1 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.907 0 CA-C-O 117.9 -1.047 . . . . 0.0 108.594 178.126 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.33 -36.12 76.61 Favored 'General case' 0 N--CA 1.524 3.234 0 CA-C-N 119.584 1.083 . . . . 0.0 110.747 178.058 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.7 p -80.21 -42.16 23.82 Favored 'General case' 0 N--CA 1.536 3.864 0 CA-C-N 119.315 0.961 . . . . 0.0 111.526 -179.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.59 HG21 HD23 ' A' ' 71' ' ' LEU . 4.8 pt -71.68 -17.32 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.903 0 CA-C-O 117.597 -1.192 . . . . 0.0 113.632 -177.171 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 63.3 p -111.85 -28.89 7.88 Favored 'General case' 0 N--CA 1.515 2.821 0 CA-C-N 120.039 1.29 . . . . 0.0 110.833 178.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.6 ptt180 -76.4 -22.01 55.27 Favored 'General case' 0 N--CA 1.524 3.274 0 CA-C-N 119.605 1.093 . . . . 0.0 108.175 174.003 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -62.13 -36.07 92.42 Favored Glycine 1 N--CA 1.516 4.023 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 177.016 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 74.5 p -66.5 -33.09 74.92 Favored 'General case' 0 N--CA 1.535 3.783 0 CA-C-N 118.27 1.035 . . . . 0.0 109.971 176.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -61.21 -32.74 72.51 Favored 'General case' 1 N--CA 1.543 4.179 0 C-N-CA 123.474 0.71 . . . . 0.0 111.307 178.451 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.1 m -58.79 -38.51 78.72 Favored 'General case' 1 N--CA 1.545 4.321 0 C-N-CA 123.5 0.72 . . . . 0.0 111.179 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 12.8 mt -58.86 -41.49 87.12 Favored 'General case' 0 N--CA 1.532 3.647 0 C-N-CA 124.303 1.041 . . . . 0.0 111.084 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.7 -20.54 65.8 Favored 'General case' 1 N--CA 1.539 4.013 0 CA-C-O 118.439 -0.791 . . . . 0.0 112.416 -179.669 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -86.54 -43.7 12.51 Favored 'General case' 0 N--CA 1.514 2.735 0 CA-C-N 118.876 0.762 . . . . 0.0 110.196 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.11 163.9 9.37 Favored Pre-proline 1 N--CA 1.543 4.192 0 CA-C-O 118.09 -0.957 . . . . 0.0 112.508 179.689 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -84.41 166.74 12.18 Favored 'Trans proline' 0 C--N 1.381 2.268 0 C-N-CA 121.886 1.724 . . . . 0.0 111.131 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 t -91.59 -23.08 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.075 0 CA-C-O 117.663 -1.161 . . . . 0.0 111.374 -179.665 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -61.15 -42.82 99.24 Favored 'General case' 0 N--CA 1.518 2.955 0 CA-C-N 120.316 1.416 . . . . 0.0 109.894 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.578 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.2 mp -98.08 -13.17 21.15 Favored 'General case' 0 N--CA 1.512 2.647 0 C-N-CA 123.527 0.731 . . . . 0.0 111.851 178.361 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -32.35 73.68 Favored 'General case' 1 N--CA 1.541 4.081 0 N-CA-C 103.397 -2.816 . . . . 0.0 103.397 167.732 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -53.93 -38.53 65.0 Favored 'General case' 0 N--CA 1.515 2.818 0 C-N-CA 124.735 1.214 . . . . 0.0 110.384 174.842 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.612 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 48.6 t90 -65.32 -37.94 88.63 Favored 'General case' 0 N--CA 1.53 3.542 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 176.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.35 -36.2 52.95 Favored 'General case' 1 N--CA 1.541 4.125 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 176.402 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -70.69 -38.42 73.71 Favored 'General case' 0 N--CA 1.539 3.989 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 175.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.444 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 2.6 mt-10 -58.62 -22.77 57.4 Favored 'General case' 1 N--CA 1.544 4.226 0 C-N-CA 123.938 0.895 . . . . 0.0 110.926 175.473 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.512 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -110.16 -2.68 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.332 0 CA-C-O 117.968 -1.015 . . . . 0.0 113.482 -175.941 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 7.0 mp -114.04 -61.37 1.75 Allowed 'General case' 0 N--CA 1.523 3.188 0 N-CA-C 106.419 -1.697 . . . . 0.0 106.419 174.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.5 tt . . . . . 1 N--CA 1.546 4.37 0 C-N-CA 125.056 1.343 . . . . 0.0 112.875 -178.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 . . . . . 0 N--CA 1.525 3.324 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 519' ' ' TRP . . . . . 0.742 ' CE2' HD11 ' A' ' 39' ' ' LEU . 63.4 t-105 -42.8 -27.58 0.19 Allowed 'General case' 1 N--CA 1.543 4.198 0 C-N-CA 124.213 1.005 . . . . 0.0 113.667 178.828 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 520' ' ' LEU . . . . . 0.53 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.3 mm? -91.83 -33.38 14.98 Favored 'General case' 0 N--CA 1.523 3.221 0 CA-C-O 117.613 -1.184 . . . . 0.0 113.738 -171.037 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 16.0 ttp180 -64.79 -23.08 67.13 Favored 'General case' 0 N--CA 1.531 3.594 0 N-CA-C 106.125 -1.806 . . . . 0.0 106.125 171.878 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 522' ' ' PHE . . . . . 0.565 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.1 m-85 -78.04 -37.88 45.84 Favored 'General case' 0 N--CA 1.512 2.665 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 173.855 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 523' ' ' VAL . . . . . 0.423 HG23 ' O ' ' B' ' 519' ' ' TRP . 44.9 t -67.2 -20.09 26.34 Favored 'Isoleucine or valine' 1 N--CA 1.559 4.992 0 CA-C-O 117.799 -1.096 . . . . 0.0 111.352 177.366 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -76.52 -53.2 8.42 Favored 'General case' 0 N--CA 1.531 3.621 0 CA-C-N 120.337 1.426 . . . . 0.0 108.058 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 6.2 mp -67.57 -21.5 65.44 Favored 'General case' 0 N--CA 1.533 3.685 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 175.652 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 526' ' ' LEU . . . . . 0.421 ' HB2' ' HA ' ' B' ' 523' ' ' VAL . 0.8 OUTLIER -69.78 -36.06 75.41 Favored 'General case' 0 N--CA 1.519 3.02 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 176.507 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 527' ' ' LYS . . . . . 0.408 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 9.6 tttt -67.31 -23.29 65.63 Favored 'General case' 0 N--CA 1.521 3.08 0 CA-C-O 118.409 -0.805 . . . . 0.0 110.905 176.692 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -72.21 -40.87 67.5 Favored 'General case' 0 N--CA 1.533 3.7 0 CA-C-N 119.151 0.887 . . . . 0.0 109.59 178.052 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 529' ' ' ALA . . . . . 0.612 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -86.79 -13.75 44.24 Favored 'General case' 0 N--CA 1.509 2.49 0 CA-C-O 118.719 -0.658 . . . . 0.0 110.517 178.199 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 530' ' ' TYR . . . . . 0.408 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.8 OUTLIER -74.99 -29.69 60.95 Favored 'General case' 0 N--CA 1.536 3.838 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 177.696 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -61.94 -49.62 75.39 Favored 'General case' 0 N--CA 1.532 3.659 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 177.293 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -91.95 -87.93 0.21 Allowed 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 177.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.6 p30 155.8 51.77 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.84 0 C-N-CA 127.325 2.25 . . . . 0.0 107.54 177.479 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 534' ' ' LEU . . . . . 0.578 HD22 ' CD2' ' A' ' 96' ' ' LEU . 7.1 mt -109.95 11.33 24.12 Favored 'General case' 0 N--CA 1.529 3.523 0 C-N-CA 124.54 1.136 . . . . 0.0 110.988 -178.145 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 535' ' ' HIS . . . . . 0.555 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 40.7 p-80 -82.9 2.53 34.0 Favored 'General case' 0 N--CA 1.515 2.792 0 C-N-CA 123.419 0.688 . . . . 0.0 109.235 175.376 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 536' ' ' LEU . . . . . 0.445 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 36.4 mt -97.15 -50.69 0.23 Allowed Pre-proline 0 N--CA 1.509 2.507 0 CA-C-O 116.854 -1.546 . . . . 0.0 109.22 -175.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 537' ' ' PRO . . . . . 0.445 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 3.9 Cg_exo -68.68 -29.93 28.78 Favored 'Trans proline' 0 C--N 1.391 2.795 0 N-CA-C 106.79 -2.042 . . . . 0.0 106.79 171.086 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 538' ' ' LEU . . . . . 0.456 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 0.6 OUTLIER -65.28 -45.32 84.94 Favored 'General case' 0 N--CA 1.512 2.658 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 175.36 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 1.1 pp -76.52 -7.97 56.24 Favored 'General case' 0 N--CA 1.536 3.861 0 CA-C-N 118.992 0.814 . . . . 0.0 111.828 177.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -84.78 -0.69 54.66 Favored 'General case' 0 N--CA 1.525 3.303 0 CA-C-N 119.195 0.907 . . . . 0.0 109.635 175.253 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 541' ' ' LEU . . . . . 0.621 HD13 ' N ' ' B' ' 542' ' ' MET . 0.0 OUTLIER -118.72 -48.37 2.48 Favored 'General case' 0 N--CA 1.512 2.671 0 C-N-CA 125.039 1.336 . . . . 0.0 108.724 -178.731 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 542' ' ' MET . . . . . 0.621 ' N ' HD13 ' B' ' 541' ' ' LEU . 4.0 ptm -101.3 11.86 38.51 Favored 'General case' 0 N--CA 1.538 3.932 0 CA-C-O 118.584 -0.722 . . . . 0.0 112.83 -178.031 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 543' ' ' LEU . . . . . 0.489 ' O ' HG23 ' B' ' 544' ' ' THR . 0.2 OUTLIER -129.58 -86.24 0.54 Allowed 'General case' 0 N--CA 1.526 3.348 0 CA-C-O 117.322 -1.323 . . . . 0.0 112.182 -179.852 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 544' ' ' THR . . . . . 0.489 HG23 ' O ' ' B' ' 543' ' ' LEU . 7.8 p 137.08 137.39 0.0 OUTLIER Pre-proline 1 N--CA 1.569 5.515 0 C-N-CA 127.8 2.44 . . . . 0.0 107.289 -178.777 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -62.55 -29.65 78.57 Favored 'Trans proline' 0 N--CA 1.516 2.835 0 C-N-CA 122.839 2.359 . . . . 0.0 112.964 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -62.8 -28.5 70.04 Favored 'General case' 1 N--CA 1.54 4.069 0 CA-C-N 118.744 0.702 . . . . 0.0 111.282 179.415 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -70.72 -41.87 71.32 Favored 'General case' 0 N--CA 1.525 3.322 0 CA-C-O 118.712 -0.661 . . . . 0.0 109.918 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 548' ' ' ARG . . . . . 0.428 ' HB2' ' HB2' ' A' ' 19' ' ' TRP . 28.8 ptt180 -72.9 -21.97 60.82 Favored 'General case' 0 N--CA 1.529 3.494 0 CA-C-O 118.273 -0.87 . . . . 0.0 111.276 177.68 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -66.36 -50.88 62.03 Favored 'General case' 1 N--CA 1.54 4.062 0 N-CA-C 106.614 -1.625 . . . . 0.0 106.614 175.634 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -76.55 -9.86 58.97 Favored 'General case' 0 N--CA 1.508 2.465 0 CA-C-O 117.363 -1.303 . . . . 0.0 111.026 177.56 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 551' ' ' LEU . . . . . 0.811 HD22 ' CE3' ' A' ' 19' ' ' TRP . 5.8 tp -79.88 -31.5 40.35 Favored 'General case' 0 N--CA 1.516 2.827 0 CA-C-N 120.158 1.344 . . . . 0.0 107.68 174.224 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -70.49 -56.17 7.88 Favored Glycine 0 N--CA 1.51 3.577 0 N-CA-C 108.68 -1.768 . . . . 0.0 108.68 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.5 m -64.88 -27.98 69.23 Favored 'General case' 0 N--CA 1.537 3.882 0 CA-C-O 118.043 -0.979 . . . . 0.0 112.042 -179.52 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 6.5 mtm180 -69.26 -49.84 52.48 Favored 'General case' 1 N--CA 1.543 4.188 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 176.5 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 555' ' ' VAL . . . . . 0.406 HG23 ' O ' ' B' ' 551' ' ' LEU . 23.6 t -65.71 -16.89 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.679 0 CA-C-O 118.067 -0.968 . . . . 0.0 109.532 176.619 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 11.7 mtt180 -78.16 -47.29 18.45 Favored 'General case' 0 N--CA 1.521 3.113 0 CA-C-O 117.43 -1.271 . . . . 0.0 111.257 178.332 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 557' ' ' ILE . . . . . 0.462 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -70.75 -22.66 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.527 0 CA-C-N 121.456 1.934 . . . . 0.0 110.918 -179.297 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 558' ' ' VAL . . . . . 0.462 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -85.8 -51.05 13.84 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.002 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 179.979 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -57.26 -26.17 60.37 Favored 'General case' 0 N--CA 1.536 3.835 0 CA-C-O 118.543 -0.742 . . . . 0.0 110.178 177.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -90.39 -28.35 18.73 Favored 'General case' 0 N--CA 1.529 3.512 0 CA-C-O 118.586 -0.721 . . . . 0.0 109.749 177.412 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 6.8 mt -66.37 -44.01 84.34 Favored 'General case' 1 N--CA 1.546 4.342 0 CA-C-N 118.96 0.8 . . . . 0.0 109.552 178.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 14.7 mt -60.7 -22.91 64.44 Favored 'General case' 0 N--CA 1.534 3.761 0 C-N-CA 124.159 0.984 . . . . 0.0 111.795 179.369 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -82.62 -48.36 11.03 Favored 'General case' 0 N--CA 1.525 3.307 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 66.4 79.56 0.2 Allowed Glycine 1 N--CA 1.526 4.641 0 CA-C-O 119.318 -0.712 . . . . 0.0 111.663 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -155.8 -51.57 0.08 Allowed 'General case' 0 N--CA 1.527 3.388 0 CA-C-N 117.463 0.632 . . . . 0.0 109.56 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 10.5 ptt? -152.99 63.33 0.78 Allowed 'General case' 0 N--CA 1.527 3.419 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 78.6 p -130.63 3.19 4.54 Favored 'General case' 0 N--CA 1.522 3.131 0 CA-C-N 115.166 -0.924 . . . . 0.0 113.257 -176.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 42.4 mm-40 -110.02 -55.16 2.48 Favored 'General case' 0 N--CA 1.522 3.157 0 CA-C-N 119.579 1.081 . . . . 0.0 111.873 -178.53 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.94 -58.87 1.8 Allowed 'General case' 0 N--CA 1.529 3.52 0 CA-C-N 118.125 0.42 . . . . 0.0 111.875 -177.006 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -73.64 0.44 12.76 Favored 'General case' 0 N--CA 1.517 2.904 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -176.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 571' ' ' LEU . . . . . 0.706 HD23 HD11 ' B' ' 582' ' ' ILE . 15.7 tp -77.67 -45.59 24.48 Favored 'General case' 0 N--CA 1.524 3.227 0 CA-C-N 120.299 1.409 . . . . 0.0 110.515 -179.452 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 572' ' ' LYS . . . . . 0.589 ' NZ ' HD13 ' B' ' 579' ' ' ILE . 0.7 OUTLIER -54.65 -37.01 65.17 Favored 'General case' 1 N--CA 1.544 4.233 0 CA-C-N 120.002 1.274 . . . . 0.0 110.889 178.303 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 31.0 t30 -61.71 -38.54 88.24 Favored 'General case' 0 N--CA 1.535 3.788 0 C-N-CA 123.154 0.581 . . . . 0.0 110.109 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -65.01 -64.01 0.97 Allowed 'General case' 0 N--CA 1.518 2.93 0 C-N-CA 124.078 0.951 . . . . 0.0 110.663 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 5.5 mp -97.81 -68.2 0.81 Allowed 'General case' 0 N--CA 1.522 3.13 0 C-N-CA 123.374 0.67 . . . . 0.0 111.044 -179.189 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 133.05 50.16 0.09 OUTLIER Glycine 1 N--CA 1.517 4.083 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 -178.376 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -111.18 114.72 28.16 Favored 'General case' 0 N--CA 1.52 3.067 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 178.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -41.88 167.34 0.01 OUTLIER Glycine 1 N--CA 1.535 5.267 0 C-N-CA 124.819 1.2 . . . . 0.0 115.914 -176.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 579' ' ' ILE . . . . . 0.589 HD13 ' NZ ' ' B' ' 572' ' ' LYS . 1.1 mp -81.86 -16.94 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.094 0 CA-C-O 117.643 -1.17 . . . . 0.0 108.438 176.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -68.74 -37.92 79.78 Favored 'General case' 0 N--CA 1.526 3.371 0 CA-C-N 120.047 1.294 . . . . 0.0 108.87 176.058 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.1 p -79.7 -37.24 36.14 Favored 'General case' 0 N--CA 1.534 3.733 0 C-N-CA 123.191 0.597 . . . . 0.0 112.544 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 582' ' ' ILE . . . . . 0.706 HD11 HD23 ' B' ' 571' ' ' LEU . 0.4 OUTLIER -70.86 -37.73 69.62 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.35 0 C-N-CA 123.336 0.654 . . . . 0.0 111.343 -175.096 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 82.3 p -95.22 -28.78 14.85 Favored 'General case' 0 N--CA 1.513 2.699 0 CA-C-O 117.987 -1.006 . . . . 0.0 111.003 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 14.2 ptt180 -74.65 -21.58 59.35 Favored 'General case' 0 N--CA 1.528 3.469 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 173.374 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -69.11 -26.49 74.62 Favored Glycine 1 N--CA 1.517 4.071 0 N-CA-C 108.464 -1.854 . . . . 0.0 108.464 173.355 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 16.4 m -68.41 -36.78 79.58 Favored 'General case' 1 N--CA 1.539 4.01 0 CA-C-N 118.293 1.046 . . . . 0.0 108.862 176.365 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -62.19 -22.35 65.84 Favored 'General case' 0 N--CA 1.539 3.977 0 C-N-CA 123.182 0.593 . . . . 0.0 110.478 176.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 62.4 m -47.63 -47.54 29.05 Favored 'General case' 1 N--CA 1.544 4.226 0 C-N-CA 124.97 1.308 . . . . 0.0 111.091 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 28.0 mt -69.58 -41.14 76.19 Favored 'General case' 0 N--CA 1.519 2.986 0 C-N-CA 123.655 0.782 . . . . 0.0 109.974 178.137 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 12.1 mmpt? -55.3 -29.11 57.57 Favored 'General case' 1 N--CA 1.545 4.297 0 C-N-CA 123.684 0.794 . . . . 0.0 112.361 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -82.81 -44.8 15.1 Favored 'General case' 0 N--CA 1.515 2.792 0 C-N-CA 123.104 0.562 . . . . 0.0 110.586 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -70.08 158.9 86.26 Favored Pre-proline 0 N--CA 1.53 3.544 0 CA-C-O 118.518 -0.753 . . . . 0.0 112.496 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -81.2 176.29 8.94 Favored 'Trans proline' 0 C--N 1.379 2.142 0 C-N-CA 122.273 1.982 . . . . 0.0 111.064 178.139 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.1 t -89.81 -26.71 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.522 3.149 0 CA-C-O 117.708 -1.139 . . . . 0.0 111.609 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -62.75 -39.17 93.29 Favored 'General case' 0 N--CA 1.516 2.852 0 CA-C-N 120.159 1.345 . . . . 0.0 109.872 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 596' ' ' LEU . . . . . 0.61 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.7 mp -100.26 -11.04 20.7 Favored 'General case' 0 N--CA 1.514 2.74 0 C-N-CA 123.564 0.746 . . . . 0.0 112.103 177.578 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -33.3 75.36 Favored 'General case' 1 N--CA 1.543 4.207 0 N-CA-C 102.344 -3.206 . . . . 0.0 102.344 165.996 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -56.63 -36.57 69.64 Favored 'General case' 0 N--CA 1.52 3.043 0 C-N-CA 124.712 1.205 . . . . 0.0 110.465 174.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 599' ' ' TRP . . . . . 0.649 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 35.4 t90 -63.25 -37.06 85.75 Favored 'General case' 1 N--CA 1.54 4.053 0 N-CA-C 107.092 -1.447 . . . . 0.0 107.092 176.439 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.79 -35.89 57.35 Favored 'General case' 0 N--CA 1.538 3.957 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 176.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -71.28 -37.0 71.89 Favored 'General case' 1 N--CA 1.541 4.111 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 175.366 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -60.34 -22.87 63.74 Favored 'General case' 1 N--CA 1.544 4.247 0 C-N-CA 123.5 0.72 . . . . 0.0 109.861 174.656 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 603' ' ' VAL . . . . . 0.551 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.0 OUTLIER -115.48 1.65 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.407 0 CA-C-O 118.423 -0.798 . . . . 0.0 112.471 -177.356 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 42.8 mt -108.28 -64.85 1.18 Allowed 'General case' 0 N--CA 1.523 3.212 0 N-CA-C 104.666 -2.346 . . . . 0.0 104.666 174.3 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 6.4 tp . . . . . 0 N--CA 1.537 3.875 0 C-N-CA 125.442 1.497 . . . . 0.0 111.912 178.461 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 . . . . . 0 N--CA 1.52 3.064 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.625 ' CZ3' HD22 ' B' ' 551' ' ' LEU . 76.4 t-105 -51.03 -42.35 60.41 Favored 'General case' 0 N--CA 1.532 3.625 0 C-N-CA 123.359 0.664 . . . . 0.0 110.085 176.228 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.432 ' N ' HD22 ' A' ' 20' ' ' LEU . 2.9 mm? -77.77 -28.18 50.49 Favored 'General case' 0 N--CA 1.516 2.833 0 O-C-N 124.925 1.391 . . . . 0.0 112.112 -176.019 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 27.7 tpt180 -57.9 -27.76 63.6 Favored 'General case' 1 N--CA 1.539 4.005 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 173.58 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.516 ' CG ' HD21 ' B' ' 551' ' ' LEU . 0.1 OUTLIER -81.6 -39.56 24.33 Favored 'General case' 0 N--CA 1.509 2.495 0 CA-C-O 117.092 -1.432 . . . . 0.0 108.829 172.876 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 26.3 t -66.97 -38.67 81.83 Favored 'Isoleucine or valine' 1 N--CA 1.561 5.085 0 CA-C-N 120.207 1.367 . . . . 0.0 113.478 -174.794 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -67.79 -50.87 54.61 Favored 'General case' 1 N--CA 1.542 4.135 0 CA-C-N 120.027 1.285 . . . . 0.0 109.349 -178.58 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.1 mp -69.86 -17.47 63.37 Favored 'General case' 0 N--CA 1.533 3.709 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 175.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.08 -37.82 84.64 Favored 'General case' 0 N--CA 1.519 3.004 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 175.488 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.443 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 23.9 ttmt -63.44 -23.48 67.42 Favored 'General case' 0 N--CA 1.526 3.348 0 CA-C-O 118.303 -0.856 . . . . 0.0 111.385 177.386 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -70.88 -41.89 70.74 Favored 'General case' 0 N--CA 1.534 3.751 0 CA-C-N 119.221 0.919 . . . . 0.0 108.525 176.509 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.65 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -89.24 -3.28 58.61 Favored 'General case' 0 CA--C 1.581 2.153 0 CA-C-O 118.446 -0.788 . . . . 0.0 110.672 177.918 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.443 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -86.5 -36.72 18.84 Favored 'General case' 0 N--CA 1.534 3.739 0 CA-C-N 120.513 1.506 . . . . 0.0 108.832 179.991 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -59.78 -44.33 93.97 Favored 'General case' 0 N--CA 1.536 3.853 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 177.091 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -87.44 -86.47 0.16 Allowed 'General case' 0 N--CA 1.514 2.741 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 176.557 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 p30 149.31 45.15 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.912 0 C-N-CA 127.656 2.382 . . . . 0.0 109.109 177.75 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.51 HD22 ' CD2' ' B' ' 596' ' ' LEU . 5.7 mt -104.79 15.33 28.07 Favored 'General case' 0 N--CA 1.528 3.436 0 C-N-CA 124.177 0.991 . . . . 0.0 110.25 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.556 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 48.9 p-80 -84.7 6.64 23.42 Favored 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 175.115 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.675 ' HA ' HD23 ' A' ' 39' ' ' LEU . 26.7 mt -95.58 -52.29 0.23 Allowed Pre-proline 0 N--CA 1.501 2.097 0 CA-C-O 116.942 -1.504 . . . . 0.0 108.633 -175.712 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.496 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 4.3 Cg_exo -67.16 -33.5 31.06 Favored 'Trans proline' 0 C--N 1.39 2.726 0 N-CA-C 106.64 -2.1 . . . . 0.0 106.64 170.826 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.556 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.6 OUTLIER -63.45 -40.64 97.68 Favored 'General case' 0 N--CA 1.517 2.884 0 CA-C-O 118.01 -0.995 . . . . 0.0 109.203 176.887 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.675 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -75.91 -18.45 59.37 Favored 'General case' 1 N--CA 1.544 4.231 0 CA-C-N 119.921 1.237 . . . . 0.0 110.46 177.333 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -80.09 -7.39 58.86 Favored 'General case' 0 N--CA 1.525 3.325 0 CA-C-N 119.45 1.023 . . . . 0.0 110.062 175.787 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.549 HD13 ' N ' ' A' ' 42' ' ' MET . 0.8 OUTLIER -106.46 -60.26 1.68 Allowed 'General case' 0 N--CA 1.521 3.112 0 C-N-CA 124.019 0.927 . . . . 0.0 111.58 -178.487 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.549 ' N ' HD13 ' A' ' 41' ' ' LEU . 13.5 ptt? -93.47 3.76 55.05 Favored 'General case' 1 N--CA 1.546 4.353 0 CA-C-N 119.442 1.019 . . . . 0.0 113.504 -177.056 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.532 HD11 HD11 ' B' ' 551' ' ' LEU . 5.1 mp -120.73 -94.63 0.5 Allowed 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 178.139 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.445 HG23 ' O ' ' A' ' 43' ' ' LEU . 0.7 OUTLIER 156.55 169.82 0.01 OUTLIER Pre-proline 1 N--CA 1.575 5.801 0 C-N-CA 125.747 1.619 . . . . 0.0 109.685 179.706 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -68.29 -37.37 14.02 Favored 'Trans proline' 0 C--N 1.392 2.841 0 C-N-CA 121.918 1.745 . . . . 0.0 108.099 174.581 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -64.25 -22.33 66.91 Favored 'General case' 0 N--CA 1.527 3.404 0 C-N-CA 123.518 0.727 . . . . 0.0 110.418 176.174 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -70.22 -38.45 75.25 Favored 'General case' 0 N--CA 1.524 3.257 0 CA-C-O 117.438 -1.267 . . . . 0.0 109.867 178.753 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 26.1 ptt180 -80.91 -17.34 50.92 Favored 'General case' 0 N--CA 1.539 3.986 0 CA-C-N 119.992 1.269 . . . . 0.0 108.32 173.486 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -74.47 -18.63 60.6 Favored 'General case' 0 N--CA 1.52 3.045 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 172.56 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 54' ' ' ARG . . . -90.14 -46.81 8.21 Favored 'General case' 0 N--CA 1.504 2.264 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 178.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.494 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 23.6 tp -66.81 -21.12 66.04 Favored 'General case' 1 N--CA 1.546 4.357 0 CA-C-N 120.613 1.551 . . . . 0.0 108.005 173.966 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.454 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -71.04 -72.21 0.93 Allowed Glycine 0 N--CA 1.502 3.089 0 C-N-CA 125.707 1.623 . . . . 0.0 111.421 177.524 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.9 m -70.18 -25.21 63.32 Favored 'General case' 0 N--CA 1.532 3.659 0 CA-C-O 117.639 -1.172 . . . . 0.0 112.526 -177.276 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 2.5 mpt_? -73.61 -51.8 15.59 Favored 'General case' 0 N--CA 1.53 3.539 0 CA-C-N 120.213 1.37 . . . . 0.0 107.545 177.827 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.2 t -62.23 -18.41 19.97 Favored 'Isoleucine or valine' 1 N--CA 1.545 4.309 0 CA-C-N 119.472 1.033 . . . . 0.0 109.853 175.067 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.6 mmm180 -75.86 -48.48 21.3 Favored 'General case' 0 N--CA 1.517 2.897 0 CA-C-O 117.343 -1.313 . . . . 0.0 111.903 178.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -71.32 -21.63 21.89 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.439 0 CA-C-N 121.171 1.805 . . . . 0.0 111.303 -178.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -87.69 -52.01 11.97 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.011 0 CA-C-N 119.96 1.255 . . . . 0.0 107.869 -178.91 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -62.73 -21.6 65.92 Favored 'General case' 0 N--CA 1.528 3.474 0 CA-C-O 118.58 -0.724 . . . . 0.0 110.202 177.415 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -91.86 -23.96 19.49 Favored 'General case' 0 N--CA 1.526 3.338 0 CA-C-O 118.082 -0.961 . . . . 0.0 110.273 177.279 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.6 mt -77.62 -61.86 1.85 Allowed 'General case' 0 N--CA 1.535 3.801 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 178.02 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.3 tt -43.4 -37.85 2.51 Favored 'General case' 1 N--CA 1.545 4.321 0 C-N-CA 125.98 1.712 . . . . 0.0 112.798 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -87.99 -62.64 1.45 Allowed 'General case' 0 N--CA 1.524 3.269 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.608 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.17 83.29 1.43 Allowed Glycine 0 N--CA 1.513 3.821 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 179.432 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -131.21 -58.3 1.0 Allowed 'General case' 0 N--CA 1.521 3.12 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 15.1 ptt? -154.4 82.32 1.12 Allowed 'General case' 0 N--CA 1.522 3.159 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 178.186 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.4 ' HA ' HD22 ' A' ' 71' ' ' LEU . 3.8 t -130.0 -9.52 4.35 Favored 'General case' 0 N--CA 1.523 3.214 0 CA-C-O 117.993 -1.003 . . . . 0.0 113.464 -176.459 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -106.75 -65.27 1.1 Allowed 'General case' 0 N--CA 1.533 3.71 0 CA-C-N 120.437 1.472 . . . . 0.0 111.54 -177.607 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.4 mtt180 -104.71 -45.88 4.48 Favored 'General case' 0 N--CA 1.53 3.533 0 C-N-CA 123.148 0.579 . . . . 0.0 109.843 -178.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -66.82 -10.35 46.96 Favored 'General case' 0 N--CA 1.52 3.062 0 CA-C-O 118.376 -0.821 . . . . 0.0 112.962 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.644 HD23 HG21 ' A' ' 82' ' ' ILE . 28.6 tp -88.73 -55.44 3.71 Favored 'General case' 0 N--CA 1.524 3.234 0 CA-C-N 119.748 1.158 . . . . 0.0 113.186 -177.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -37.99 -37.47 0.26 Allowed 'General case' 1 N--CA 1.552 4.664 0 N-CA-C 114.217 1.192 . . . . 0.0 114.217 -177.118 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -73.72 -44.11 57.3 Favored 'General case' 0 N--CA 1.533 3.687 0 CA-C-N 118.158 0.435 . . . . 0.0 110.411 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -46.57 -49.51 18.69 Favored 'General case' 0 N--CA 1.533 3.692 0 C-N-CA 124.888 1.275 . . . . 0.0 113.49 -179.136 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.4 pp -132.34 -43.0 0.95 Allowed 'General case' 0 N--CA 1.532 3.656 0 CA-C-O 118.803 -0.618 . . . . 0.0 111.974 -178.958 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 111.62 74.88 0.74 Allowed Glycine 1 N--CA 1.525 4.61 0 N-CA-C 110.588 -1.005 . . . . 0.0 110.588 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.68 -37.48 5.9 Favored 'General case' 0 N--CA 1.526 3.334 0 C-N-CA 123.409 0.684 . . . . 0.0 110.528 179.047 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 100.16 163.8 28.66 Favored Glycine 1 N--CA 1.523 4.459 0 N-CA-C 109.429 -1.468 . . . . 0.0 109.429 -177.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.0 mt -86.57 -11.49 11.1 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.664 0 CA-C-N 119.403 1.602 . . . . 0.0 109.296 178.209 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.34 -36.93 68.95 Favored 'General case' 0 N--CA 1.526 3.326 0 CA-C-N 119.93 1.241 . . . . 0.0 110.49 176.732 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.2 p -83.93 -39.18 20.1 Favored 'General case' 1 N--CA 1.541 4.081 0 CA-C-N 119.517 1.053 . . . . 0.0 112.227 -179.02 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.644 HG21 HD23 ' A' ' 71' ' ' LEU . 1.8 pt -73.28 -14.79 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.718 0 CA-C-O 117.85 -1.071 . . . . 0.0 112.938 -177.763 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 50.3 p -112.6 -33.18 6.22 Favored 'General case' 0 N--CA 1.514 2.755 0 CA-C-N 119.951 1.251 . . . . 0.0 110.184 178.123 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 13.8 ptt180 -72.81 -21.46 60.97 Favored 'General case' 0 N--CA 1.532 3.659 0 CA-C-N 119.464 1.029 . . . . 0.0 108.426 174.193 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -64.73 -33.49 87.37 Favored Glycine 1 N--CA 1.52 4.249 0 N-CA-C 109.313 -1.515 . . . . 0.0 109.313 175.612 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.6 t -63.96 -33.18 75.15 Favored 'General case' 1 N--CA 1.539 4.021 0 CA-C-N 118.282 1.041 . . . . 0.0 109.748 176.798 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -55.65 -33.8 64.39 Favored 'General case' 1 N--CA 1.547 4.376 0 C-N-CA 123.335 0.654 . . . . 0.0 111.285 177.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.7 m -62.15 -34.71 76.91 Favored 'General case' 1 N--CA 1.54 4.043 0 C-N-CA 123.728 0.811 . . . . 0.0 112.114 -179.56 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.3 mt -56.13 -42.32 76.73 Favored 'General case' 0 N--CA 1.536 3.831 0 C-N-CA 123.892 0.877 . . . . 0.0 111.166 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -21.53 61.49 Favored 'General case' 0 N--CA 1.534 3.739 0 CA-C-O 118.244 -0.884 . . . . 0.0 112.116 -179.401 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.76 -41.65 26.17 Favored 'General case' 0 N--CA 1.517 2.892 0 CA-C-N 119.157 0.889 . . . . 0.0 111.669 -179.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.17 159.9 13.56 Favored Pre-proline 1 N--CA 1.543 4.203 0 CA-C-O 118.471 -0.776 . . . . 0.0 113.079 -178.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -85.1 157.22 11.32 Favored 'Trans proline' 0 C--N 1.379 2.183 0 C-N-CA 122.285 1.99 . . . . 0.0 110.261 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 t -78.54 -27.71 14.22 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.114 0 CA-C-O 117.873 -1.061 . . . . 0.0 111.102 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -58.82 -44.21 90.79 Favored 'General case' 0 N--CA 1.518 2.932 0 CA-C-N 120.173 1.351 . . . . 0.0 109.949 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.769 HD21 HD22 ' B' ' 534' ' ' LEU . 7.7 mp -100.18 -7.46 24.73 Favored 'General case' 0 N--CA 1.512 2.667 0 CA-C-O 118.362 -0.827 . . . . 0.0 112.71 177.65 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -35.86 81.9 Favored 'General case' 0 N--CA 1.539 3.979 0 N-CA-C 102.361 -3.2 . . . . 0.0 102.361 168.048 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.59 -40.39 65.64 Favored 'General case' 0 N--CA 1.515 2.794 0 C-N-CA 124.492 1.117 . . . . 0.0 111.332 174.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.67 ' CH2' ' HB2' ' B' ' 529' ' ' ALA . 51.5 t90 -64.47 -35.59 81.44 Favored 'General case' 1 N--CA 1.541 4.09 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 177.601 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.57 -37.69 63.17 Favored 'General case' 0 N--CA 1.533 3.681 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 176.827 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -69.0 -37.24 78.6 Favored 'General case' 1 N--CA 1.539 4.016 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 175.5 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.15 -25.31 61.32 Favored 'General case' 1 N--CA 1.542 4.156 0 C-N-CA 123.089 0.556 . . . . 0.0 110.067 175.575 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.524 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.3 OUTLIER -120.37 5.51 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.482 0 C-N-CA 123.592 0.757 . . . . 0.0 112.792 -176.845 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -125.45 -56.85 1.5 Allowed 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 178.474 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 4.1 tt . . . . . 1 N--CA 1.544 4.273 0 C-N-CA 124.914 1.286 . . . . 0.0 113.524 -179.136 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 . . . . . 0 N--CA 1.523 3.212 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 519' ' ' TRP . . . . . 0.664 ' CE2' HD22 ' A' ' 39' ' ' LEU . 71.7 t-105 -43.07 -28.66 0.29 Allowed 'General case' 1 N--CA 1.55 4.555 0 C-N-CA 124.279 1.032 . . . . 0.0 113.424 179.855 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 520' ' ' LEU . . . . . 0.587 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.3 mm? -95.76 -31.43 13.2 Favored 'General case' 0 N--CA 1.526 3.373 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.693 -173.262 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.11 -22.92 65.1 Favored 'General case' 0 N--CA 1.539 3.994 0 N-CA-C 106.904 -1.517 . . . . 0.0 106.904 171.753 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 522' ' ' PHE . . . . . 0.515 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.6 m-85 -81.82 -40.16 22.94 Favored 'General case' 0 N--CA 1.509 2.494 0 N-CA-C 107.208 -1.404 . . . . 0.0 107.208 174.167 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 20.4 t -58.88 -44.81 91.56 Favored 'Isoleucine or valine' 1 N--CA 1.565 5.313 0 CA-C-O 117.603 -1.189 . . . . 0.0 113.292 -179.059 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -61.05 -46.11 92.01 Favored 'General case' 1 N--CA 1.548 4.462 0 CA-C-N 120.641 1.564 . . . . 0.0 110.038 -178.484 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 1.7 tp -67.38 -26.52 66.5 Favored 'General case' 0 N--CA 1.536 3.829 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 176.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 526' ' ' LEU . . . . . 0.441 HD23 ' O ' ' B' ' 522' ' ' PHE . 1.6 mm? -68.06 -31.78 71.67 Favored 'General case' 0 N--CA 1.522 3.141 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 176.745 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 527' ' ' LYS . . . . . 0.484 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 15.2 tttt -67.79 -23.3 65.19 Favored 'General case' 0 N--CA 1.521 3.118 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.833 177.884 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -71.99 -41.27 67.83 Favored 'General case' 0 N--CA 1.534 3.744 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 176.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 529' ' ' ALA . . . . . 0.67 ' HB2' ' CH2' ' A' ' 99' ' ' TRP . . . -88.6 -7.34 56.59 Favored 'General case' 0 N--CA 1.503 2.219 0 CA-C-O 118.427 -0.797 . . . . 0.0 110.569 177.957 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 530' ' ' TYR . . . . . 0.484 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.5 OUTLIER -82.07 -35.68 28.44 Favored 'General case' 0 N--CA 1.532 3.671 0 CA-C-N 120.309 1.413 . . . . 0.0 108.737 179.798 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -60.7 -45.07 95.6 Favored 'General case' 0 N--CA 1.538 3.932 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.033 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -90.67 -84.0 0.25 Allowed 'General case' 0 N--CA 1.515 2.805 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 177.415 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.0 p30 149.31 47.34 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.88 0 C-N-CA 128.105 2.562 . . . . 0.0 108.104 178.633 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 534' ' ' LEU . . . . . 0.769 HD22 HD21 ' A' ' 96' ' ' LEU . 7.3 mt -102.89 9.13 39.0 Favored 'General case' 0 N--CA 1.529 3.523 0 C-N-CA 124.095 0.958 . . . . 0.0 111.606 -178.552 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 535' ' ' HIS . . . . . 0.623 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 49.2 p-80 -80.76 0.38 34.95 Favored 'General case' 0 N--CA 1.512 2.657 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 175.006 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 536' ' ' LEU . . . . . 0.441 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 33.8 mt -94.01 -51.43 0.26 Allowed Pre-proline 0 N--CA 1.505 2.303 0 CA-C-O 116.343 -1.789 . . . . 0.0 109.067 -175.686 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 537' ' ' PRO . . . . . 0.441 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 3.7 Cg_exo -64.57 -37.42 37.71 Favored 'Trans proline' 0 C--N 1.396 3.048 0 N-CA-C 107.071 -1.934 . . . . 0.0 107.071 170.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 538' ' ' LEU . . . . . 0.437 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 1.2 tm? -60.28 -41.53 93.51 Favored 'General case' 0 N--CA 1.527 3.387 0 C-N-CA 124.332 1.053 . . . . 0.0 108.736 175.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 11.0 mt -71.78 -25.04 61.86 Favored 'General case' 0 N--CA 1.536 3.836 0 CA-C-O 118.247 -0.883 . . . . 0.0 111.452 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -77.88 -8.05 57.54 Favored 'General case' 0 N--CA 1.53 3.526 0 CA-C-N 119.31 0.959 . . . . 0.0 110.187 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 541' ' ' LEU . . . . . 0.497 HD22 ' O ' ' B' ' 541' ' ' LEU . 0.0 OUTLIER -103.6 -42.17 5.74 Favored 'General case' 0 N--CA 1.512 2.656 0 C-N-CA 124.033 0.933 . . . . 0.0 109.779 -179.388 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 542' ' ' MET . . . . . 0.48 ' N ' HD13 ' B' ' 541' ' ' LEU . 15.1 ptp -85.2 -28.08 25.69 Favored 'General case' 0 N--CA 1.534 3.764 0 CA-C-O 117.439 -1.267 . . . . 0.0 113.252 -177.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 1.8 tt -131.54 -110.27 0.25 Allowed 'General case' 0 N--CA 1.533 3.691 0 CA-C-O 116.967 -1.492 . . . . 0.0 112.886 -177.132 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 24.3 p -163.75 162.81 16.57 Favored Pre-proline 1 N--CA 1.542 4.168 0 CA-C-N 120.754 1.615 . . . . 0.0 111.823 -177.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -76.43 -32.09 4.06 Favored 'Trans proline' 0 CA--C 1.578 2.677 0 C-N-CA 122.792 2.328 . . . . 0.0 109.551 174.201 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -55.63 -36.41 66.97 Favored 'General case' 1 N--CA 1.546 4.338 0 C-N-CA 123.876 0.87 . . . . 0.0 111.523 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -71.66 -32.57 68.03 Favored 'General case' 0 N--CA 1.523 3.191 0 CA-C-O 117.637 -1.173 . . . . 0.0 110.778 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 20.5 ptt180 -74.16 -21.21 59.94 Favored 'General case' 0 N--CA 1.534 3.731 0 CA-C-N 120.027 1.285 . . . . 0.0 109.618 175.379 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -65.19 -44.43 88.41 Favored 'General case' 0 N--CA 1.536 3.832 0 N-CA-C 106.184 -1.784 . . . . 0.0 106.184 173.142 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -72.22 -20.29 61.59 Favored 'General case' 0 N--CA 1.517 2.915 0 CA-C-O 117.198 -1.382 . . . . 0.0 110.764 176.442 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 551' ' ' LEU . . . . . 0.625 HD22 ' CZ3' ' A' ' 19' ' ' TRP . 12.3 tp -80.42 -20.26 44.32 Favored 'General case' 0 N--CA 1.524 3.238 0 CA-C-N 120.582 1.537 . . . . 0.0 109.168 175.481 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -77.35 -52.18 5.73 Favored Glycine 0 N--CA 1.507 3.401 0 N-CA-C 108.333 -1.907 . . . . 0.0 108.333 177.658 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.5 m -70.32 -32.54 70.33 Favored 'General case' 0 N--CA 1.535 3.825 0 CA-C-O 118.703 -0.665 . . . . 0.0 110.842 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -63.9 -54.64 31.56 Favored 'General case' 1 N--CA 1.539 4.007 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 176.733 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 38.9 t -66.28 -14.9 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.531 0 CA-C-O 117.759 -1.115 . . . . 0.0 110.995 177.86 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.77 -44.39 20.77 Favored 'General case' 0 N--CA 1.526 3.374 0 CA-C-N 120.168 1.349 . . . . 0.0 111.539 178.359 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 557' ' ' ILE . . . . . 0.451 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -71.94 -22.49 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.278 0 CA-C-N 120.724 1.602 . . . . 0.0 110.213 -179.669 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 558' ' ' VAL . . . . . 0.451 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -88.44 -52.49 11.09 Favored 'Isoleucine or valine' 1 N--CA 1.543 4.181 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 -179.789 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -57.72 -24.28 56.12 Favored 'General case' 0 N--CA 1.536 3.826 0 CA-C-O 118.895 -0.574 . . . . 0.0 110.487 177.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -98.07 -22.81 16.04 Favored 'General case' 0 N--CA 1.527 3.377 0 CA-C-O 118.059 -0.972 . . . . 0.0 111.363 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 16.6 tp -78.72 -63.17 1.47 Allowed 'General case' 0 N--CA 1.537 3.878 0 CA-C-N 119.637 1.108 . . . . 0.0 108.473 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 25.9 mt -41.82 -31.38 0.31 Allowed 'General case' 1 N--CA 1.547 4.422 0 C-N-CA 125.303 1.441 . . . . 0.0 113.513 -178.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 11.4 mmm180 -75.75 -51.01 13.61 Favored 'General case' 0 N--CA 1.527 3.398 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.646 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 80.67 93.47 0.44 Allowed Glycine 1 N--CA 1.516 4.02 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 177.982 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -161.54 -53.34 0.05 OUTLIER 'General case' 0 N--CA 1.529 3.508 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.129 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 48.1 mtt -153.31 77.8 1.14 Allowed 'General case' 0 N--CA 1.522 3.151 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 95.1 p -136.34 4.59 2.92 Favored 'General case' 0 N--CA 1.519 2.979 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -175.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -110.99 -69.69 0.85 Allowed 'General case' 0 N--CA 1.529 3.491 0 CA-C-N 120.153 1.342 . . . . 0.0 111.592 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.98 -45.4 6.94 Favored 'General case' 0 N--CA 1.53 3.559 0 CA-C-N 118.538 0.608 . . . . 0.0 111.806 -176.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -80.05 -5.13 55.28 Favored 'General case' 0 N--CA 1.522 3.172 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 -177.056 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 571' ' ' LEU . . . . . 0.815 HD23 HD11 ' B' ' 582' ' ' ILE . 27.9 tp -83.42 -48.49 10.3 Favored 'General case' 0 N--CA 1.531 3.594 0 CA-C-N 120.165 1.348 . . . . 0.0 112.555 -177.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -47.06 -30.61 2.81 Favored 'General case' 1 N--CA 1.552 4.628 0 CA-C-N 119.855 1.207 . . . . 0.0 113.82 -178.682 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -68.84 -38.08 79.56 Favored 'General case' 0 N--CA 1.537 3.92 0 CA-C-N 118.724 0.693 . . . . 0.0 110.881 -178.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -49.96 -61.25 2.25 Favored 'General case' 0 N--CA 1.53 3.549 0 C-N-CA 124.769 1.228 . . . . 0.0 113.0 -179.343 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.0 -36.56 3.25 Favored 'General case' 0 N--CA 1.534 3.747 0 CA-C-O 118.511 -0.756 . . . . 0.0 111.905 -178.626 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 115.25 57.71 0.35 Allowed Glycine 1 N--CA 1.525 4.57 0 CA-C-N 119.144 0.883 . . . . 0.0 111.039 179.577 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -114.54 103.16 10.75 Favored 'General case' 0 N--CA 1.52 3.069 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 177.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -39.0 164.28 0.01 OUTLIER Glycine 1 N--CA 1.544 5.834 0 C-N-CA 125.441 1.496 . . . . 0.0 115.311 -176.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 579' ' ' ILE . . . . . 0.443 ' HA ' HG22 ' B' ' 582' ' ' ILE 0.262 10.9 mt -81.89 -12.24 12.4 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.333 0 CA-C-N 118.888 1.344 . . . . 0.0 109.341 178.383 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -70.05 -41.64 73.94 Favored 'General case' 0 N--CA 1.531 3.577 0 CA-C-N 120.363 1.438 . . . . 0.0 109.285 175.444 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -77.4 -37.71 51.37 Favored 'General case' 1 N--CA 1.54 4.03 0 CA-C-N 118.909 0.777 . . . . 0.0 111.877 179.144 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 582' ' ' ILE . . . . . 0.815 HD11 HD23 ' B' ' 571' ' ' LEU . 1.0 OUTLIER -66.57 -40.04 85.35 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.375 0 C-N-CA 123.421 0.688 . . . . 0.0 111.722 -176.101 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 583' ' ' THR . . . . . 0.537 HG23 ' CG2' ' B' ' 582' ' ' ILE . 44.2 p -99.89 -18.36 17.15 Favored 'General case' 0 N--CA 1.506 2.368 0 CA-C-O 117.744 -1.122 . . . . 0.0 112.057 -178.199 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -81.64 -20.95 38.58 Favored 'General case' 0 N--CA 1.528 3.475 0 CA-C-N 120.265 1.393 . . . . 0.0 107.909 173.22 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -66.33 -35.49 90.32 Favored Glycine 1 N--CA 1.518 4.116 0 N-CA-C 108.785 -1.726 . . . . 0.0 108.785 176.084 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 88.8 p -66.55 -32.6 74.04 Favored 'General case' 0 N--CA 1.534 3.769 0 CA-C-N 117.803 0.802 . . . . 0.0 111.188 177.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -64.14 -31.32 72.47 Favored 'General case' 0 N--CA 1.53 3.544 0 C-N-CA 123.566 0.747 . . . . 0.0 110.778 178.748 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 52.9 m -62.95 -41.07 99.39 Favored 'General case' 1 N--CA 1.54 4.047 0 C-N-CA 123.5 0.72 . . . . 0.0 110.77 178.81 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 57.2 mt -52.78 -48.49 66.79 Favored 'General case' 0 N--CA 1.531 3.578 0 C-N-CA 124.46 1.104 . . . . 0.0 111.956 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -61.03 -29.81 69.94 Favored 'General case' 1 N--CA 1.54 4.049 0 CA-C-O 118.691 -0.671 . . . . 0.0 112.349 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -71.39 -41.61 69.43 Favored 'General case' 0 N--CA 1.52 3.03 0 CA-C-N 118.391 0.541 . . . . 0.0 110.806 179.399 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -57.72 162.52 4.91 Favored Pre-proline 1 N--CA 1.542 4.15 0 CA-C-O 118.194 -0.908 . . . . 0.0 112.132 179.228 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -78.97 -177.98 4.31 Favored 'Trans proline' 0 C--N 1.379 2.134 0 C-N-CA 121.439 1.426 . . . . 0.0 110.514 178.703 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.1 t -99.36 -29.2 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.098 0 CA-C-O 117.757 -1.116 . . . . 0.0 111.286 -179.133 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -63.4 -41.32 98.75 Favored 'General case' 0 N--CA 1.517 2.882 0 CA-C-N 119.761 1.164 . . . . 0.0 110.535 -178.352 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 596' ' ' LEU . . . . . 0.51 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.7 mp -99.52 -15.88 18.5 Favored 'General case' 0 N--CA 1.511 2.582 0 C-N-CA 123.331 0.653 . . . . 0.0 111.762 179.099 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 597' ' ' ARG . . . . . 0.408 ' HA ' HD13 ' B' ' 600' ' ' LEU . 0.1 OUTLIER -67.48 -29.68 69.19 Favored 'General case' 0 N--CA 1.531 3.617 0 N-CA-C 103.119 -2.919 . . . . 0.0 103.119 167.851 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -56.36 -36.91 69.33 Favored 'General case' 0 N--CA 1.521 3.094 0 C-N-CA 124.302 1.041 . . . . 0.0 110.388 173.697 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 599' ' ' TRP . . . . . 0.65 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 50.4 t90 -63.59 -35.61 81.07 Favored 'General case' 0 N--CA 1.53 3.558 0 CA-C-O 117.657 -1.164 . . . . 0.0 108.112 178.288 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 600' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' B' ' 597' ' ' ARG . 6.2 mp -54.93 -37.03 65.9 Favored 'General case' 1 N--CA 1.544 4.245 0 CA-C-N 119.37 0.986 . . . . 0.0 108.429 176.501 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -70.81 -34.18 71.47 Favored 'General case' 0 N--CA 1.532 3.634 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 176.329 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 602' ' ' GLU . . . . . 0.406 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.5 OUTLIER -62.2 -24.4 67.2 Favored 'General case' 1 N--CA 1.546 4.363 0 C-N-CA 123.491 0.716 . . . . 0.0 109.88 174.868 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' B' B ' 603' ' ' VAL . . . . . 0.564 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.5 OUTLIER -121.46 13.73 6.06 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.448 0 C-N-CA 123.851 0.861 . . . . 0.0 111.888 -177.565 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 45.0 mt -126.6 -61.95 1.16 Allowed 'General case' 0 N--CA 1.528 3.426 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 176.461 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.539 3.989 0 C-N-CA 124.573 1.149 . . . . 0.0 111.295 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 . . . . . 0 N--CA 1.534 3.737 0 N-CA-C 105.777 -1.935 . . . . 0.0 105.777 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.423 ' CE3' HD23 ' B' ' 551' ' ' LEU . 59.1 t-105 -51.03 -37.18 43.7 Favored 'General case' 1 N--CA 1.543 4.192 0 C-N-CA 124.253 1.021 . . . . 0.0 109.182 174.125 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.507 ' N ' HD22 ' A' ' 20' ' ' LEU . 2.9 mm? -90.34 -25.95 20.2 Favored 'General case' 0 N--CA 1.526 3.345 0 CA-C-O 117.852 -1.07 . . . . 0.0 111.089 -178.79 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.2 mtt-85 -53.69 -28.34 33.16 Favored 'General case' 1 N--CA 1.539 4.002 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 173.223 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.614 ' HB2' HG21 ' B' ' 555' ' ' VAL . 47.7 t80 -87.11 -39.04 15.92 Favored 'General case' 0 N--CA 1.501 2.125 0 CA-C-O 115.907 -1.997 . . . . 0.0 109.276 172.94 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 91.1 t -66.15 -58.26 7.36 Favored 'Isoleucine or valine' 1 N--CA 1.577 5.905 0 CA-C-N 122.462 2.392 . . . . 0.0 112.704 -177.182 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -55.7 -45.84 77.79 Favored 'General case' 1 N--CA 1.548 4.451 0 CA-C-N 119.957 1.253 . . . . 0.0 110.914 -177.739 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.7 mp -71.71 -24.34 61.79 Favored 'General case' 0 N--CA 1.531 3.603 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.23 177.399 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.501 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -66.85 -33.5 75.75 Favored 'General case' 0 N--CA 1.519 3.016 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 176.172 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -65.33 -26.91 68.25 Favored 'General case' 0 N--CA 1.518 2.956 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.679 177.259 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -69.7 -39.71 76.74 Favored 'General case' 0 N--CA 1.53 3.54 0 CA-C-N 119.167 0.894 . . . . 0.0 109.031 177.012 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.582 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -84.41 -8.9 58.83 Favored 'General case' 0 N--CA 1.504 2.232 0 CA-C-O 118.489 -0.767 . . . . 0.0 110.633 177.485 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -80.63 -32.79 36.17 Favored 'General case' 0 N--CA 1.529 3.522 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 176.293 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -56.02 -46.49 78.78 Favored 'General case' 0 N--CA 1.533 3.679 0 C-N-CA 124.2 1.0 . . . . 0.0 108.591 176.726 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -96.26 -83.48 0.37 Allowed 'General case' 0 N--CA 1.517 2.922 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 178.311 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p30 150.32 49.7 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.888 0 C-N-CA 127.875 2.47 . . . . 0.0 108.045 177.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.581 HD22 ' CD2' ' B' ' 596' ' ' LEU . 11.5 mt -103.16 9.49 38.28 Favored 'General case' 0 N--CA 1.526 3.326 0 C-N-CA 124.099 0.96 . . . . 0.0 111.156 -178.586 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.483 ' HA ' ' HB2' ' A' ' 38' ' ' LEU . 48.5 p-80 -81.17 3.86 22.18 Favored 'General case' 0 N--CA 1.513 2.711 0 C-N-CA 123.224 0.61 . . . . 0.0 109.558 174.547 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.513 HD23 HD12 ' A' ' 39' ' ' LEU . 17.7 mt -95.84 -49.94 0.24 Allowed Pre-proline 0 N--CA 1.512 2.649 0 C-N-CA 125.374 1.47 . . . . 0.0 109.373 -175.327 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.433 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 7.0 Cg_exo -62.87 -37.97 51.14 Favored 'Trans proline' 0 N--CA 1.513 2.638 0 N-CA-C 105.703 -2.46 . . . . 0.0 105.703 169.682 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.483 ' HB2' ' HA ' ' A' ' 35' ' ' HIS . 0.9 OUTLIER -54.44 -44.36 72.41 Favored 'General case' 0 N--CA 1.536 3.874 0 C-N-CA 124.442 1.097 . . . . 0.0 109.38 174.151 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.739 HD11 ' CE2' ' B' ' 519' ' ' TRP . 0.4 OUTLIER -54.79 -52.77 61.61 Favored 'General case' 1 N--CA 1.561 5.087 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.626 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -58.48 -17.1 18.38 Favored 'General case' 1 N--CA 1.543 4.194 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -179.233 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.639 HD22 ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -107.27 -35.23 6.87 Favored 'General case' 0 N--CA 1.529 3.496 0 CA-C-O 117.738 -1.125 . . . . 0.0 112.971 -176.611 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.423 ' N ' HD13 ' A' ' 41' ' ' LEU . 18.0 ptp -125.48 21.87 7.77 Favored 'General case' 1 N--CA 1.549 4.485 0 CA-C-N 120.505 1.502 . . . . 0.0 112.641 -177.958 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -137.76 -68.75 0.46 Allowed 'General case' 0 N--CA 1.515 2.804 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.295 177.174 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.4 p 122.82 157.25 0.0 OUTLIER Pre-proline 1 N--CA 1.568 5.439 0 C-N-CA 128.528 2.731 . . . . 0.0 109.534 -179.526 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -67.28 -30.49 37.14 Favored 'Trans proline' 0 C--N 1.393 2.875 0 C-N-CA 122.316 2.011 . . . . 0.0 109.429 175.393 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -68.35 -27.07 65.93 Favored 'General case' 0 N--CA 1.531 3.575 0 CA-C-O 118.208 -0.901 . . . . 0.0 109.55 176.456 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -70.65 -30.47 67.1 Favored 'General case' 0 N--CA 1.52 3.069 0 CA-C-O 117.588 -1.196 . . . . 0.0 109.935 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 -85.76 -18.0 34.25 Favored 'General case' 0 N--CA 1.537 3.88 0 CA-C-N 119.617 1.098 . . . . 0.0 108.394 174.165 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -75.86 -22.91 55.72 Favored 'General case' 0 N--CA 1.523 3.179 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 172.548 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.79 -35.24 15.81 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 117.729 -1.129 . . . . 0.0 109.252 179.217 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.481 ' O ' HG23 ' A' ' 55' ' ' VAL . 31.2 tp -74.16 -20.0 60.37 Favored 'General case' 0 N--CA 1.534 3.741 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 172.691 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.405 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -67.95 -70.51 1.12 Allowed Glycine 0 N--CA 1.496 2.687 0 C-N-CA 125.161 1.363 . . . . 0.0 110.627 177.593 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.6 m -73.54 -25.43 60.39 Favored 'General case' 0 N--CA 1.531 3.607 0 CA-C-O 117.759 -1.115 . . . . 0.0 112.46 -178.317 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -69.62 -51.4 35.37 Favored 'General case' 0 N--CA 1.536 3.866 0 CA-C-N 120.269 1.395 . . . . 0.0 107.914 177.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.551 HG22 ' HE2' ' B' ' 542' ' ' MET . 21.5 t -61.82 -20.22 23.08 Favored 'Isoleucine or valine' 1 N--CA 1.543 4.199 0 O-C-N 120.977 -1.077 . . . . 0.0 109.402 175.13 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.5 mmm180 -74.55 -44.08 52.76 Favored 'General case' 0 N--CA 1.522 3.147 0 CA-C-O 117.098 -1.429 . . . . 0.0 112.082 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.417 HD13 ' N ' ' A' ' 58' ' ' VAL . 0.0 OUTLIER -74.15 -23.87 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.507 0 CA-C-N 121.942 2.155 . . . . 0.0 111.161 -179.866 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.417 ' N ' HD13 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -88.36 -50.56 13.4 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.107 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 -178.153 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -62.26 -25.46 67.85 Favored 'General case' 0 N--CA 1.532 3.653 0 CA-C-O 118.818 -0.611 . . . . 0.0 109.976 178.296 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -95.05 -21.39 18.6 Favored 'General case' 0 N--CA 1.524 3.258 0 CA-C-O 117.828 -1.082 . . . . 0.0 111.113 178.553 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -78.08 -46.14 21.61 Favored 'General case' 0 N--CA 1.533 3.678 0 CA-C-N 120.011 1.278 . . . . 0.0 108.026 178.247 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 30.9 mt -51.84 -26.32 9.7 Favored 'General case' 0 N--CA 1.539 3.987 0 C-N-CA 124.546 1.139 . . . . 0.0 112.203 178.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -90.23 -52.08 5.12 Favored 'General case' 0 N--CA 1.521 3.075 0 N-CA-C 107.397 -1.335 . . . . 0.0 107.397 178.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.1 94.41 0.26 Allowed Glycine 0 N--CA 1.514 3.854 0 CA-C-O 119.442 -0.643 . . . . 0.0 112.424 177.337 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -160.23 -59.05 0.06 Allowed 'General case' 0 N--CA 1.529 3.504 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 177.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 59.0 mtt -140.19 74.1 1.45 Allowed 'General case' 0 N--CA 1.526 3.351 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 178.369 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 8.4 t -136.08 -14.59 1.79 Allowed 'General case' 0 N--CA 1.525 3.296 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -176.398 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -106.7 -56.49 2.18 Favored 'General case' 0 N--CA 1.529 3.492 0 CA-C-N 120.284 1.402 . . . . 0.0 112.122 -176.661 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 1.9 ttm180 -102.57 -54.03 2.75 Favored 'General case' 0 N--CA 1.53 3.535 0 C-N-CA 123.294 0.638 . . . . 0.0 111.469 -176.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.39 -8.54 56.29 Favored 'General case' 0 N--CA 1.518 2.947 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -176.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.56 HD23 HG21 ' A' ' 82' ' ' ILE . 37.0 tp -80.91 -51.33 8.68 Favored 'General case' 0 N--CA 1.528 3.45 0 CA-C-O 117.6 -1.19 . . . . 0.0 113.061 -178.017 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.06 -31.85 0.14 Allowed 'General case' 1 N--CA 1.552 4.669 0 N-CA-C 115.038 1.496 . . . . 0.0 115.038 -176.937 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -72.78 -44.24 61.81 Favored 'General case' 0 N--CA 1.536 3.847 0 CA-C-N 119.18 0.9 . . . . 0.0 110.048 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -53.26 -50.14 65.44 Favored 'General case' 0 N--CA 1.529 3.504 0 C-N-CA 124.631 1.172 . . . . 0.0 112.903 -179.255 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 56.7 mt -110.54 -51.33 2.88 Favored 'General case' 0 N--CA 1.526 3.365 0 C-N-CA 122.973 0.509 . . . . 0.0 111.646 -177.23 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 117.59 17.94 5.44 Favored Glycine 1 N--CA 1.527 4.724 0 CA-C-O 118.095 -1.392 . . . . 0.0 111.867 -178.089 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -89.21 112.74 23.84 Favored 'General case' 0 N--CA 1.512 2.643 0 CA-C-N 119.594 1.697 . . . . 0.0 106.508 178.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -42.67 173.95 0.01 OUTLIER Glycine 1 N--CA 1.535 5.299 0 C-N-CA 125.25 1.405 . . . . 0.0 115.253 -177.759 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.8 mt -80.06 -17.29 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.707 0 CA-C-N 118.5 1.15 . . . . 0.0 107.984 177.552 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.86 -6.63 43.12 Favored 'General case' 0 N--CA 1.521 3.121 0 CA-C-O 117.403 -1.284 . . . . 0.0 111.223 174.715 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -104.17 -44.28 5.02 Favored 'General case' 0 N--CA 1.53 3.539 0 CA-C-N 120.77 1.623 . . . . 0.0 110.26 177.292 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.56 HG21 HD23 ' A' ' 71' ' ' LEU . 0.1 OUTLIER -72.23 -38.71 62.92 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.652 0 CA-C-N 119.307 0.958 . . . . 0.0 111.202 -177.771 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 44.3 p -82.15 -25.65 34.17 Favored 'General case' 0 N--CA 1.521 3.104 0 CA-C-O 118.865 -0.588 . . . . 0.0 109.917 178.065 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.9 ttp180 -67.71 -35.54 78.97 Favored 'General case' 1 N--CA 1.54 4.044 0 N-CA-C 107.319 -1.363 . . . . 0.0 107.319 173.894 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -69.94 -26.24 74.59 Favored Glycine 1 N--CA 1.516 4.025 0 CA-C-O 118.094 -1.392 . . . . 0.0 111.916 178.214 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 89.7 p -66.14 -25.5 67.0 Favored 'General case' 1 N--CA 1.543 4.222 0 CA-C-N 119.537 1.669 . . . . 0.0 110.754 178.534 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -54.81 -25.28 27.3 Favored 'General case' 1 N--CA 1.545 4.287 0 C-N-CA 123.281 0.632 . . . . 0.0 110.752 176.732 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.9 m -49.88 -42.85 48.74 Favored 'General case' 1 N--CA 1.547 4.382 0 C-N-CA 124.837 1.255 . . . . 0.0 111.467 178.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 37.8 mt -65.02 -41.98 94.8 Favored 'General case' 0 N--CA 1.519 2.99 0 C-N-CA 123.324 0.65 . . . . 0.0 110.259 178.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.11 0.06 55.88 Favored 'General case' 0 N--CA 1.532 3.643 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -179.45 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -113.18 -64.0 1.37 Allowed 'General case' 0 N--CA 1.518 2.958 0 CA-C-N 120.047 1.294 . . . . 0.0 111.741 -179.206 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -49.73 159.31 0.74 Allowed Pre-proline 1 N--CA 1.548 4.461 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -178.528 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.407 ' O ' ' HB2' ' A' ' 97' ' ' ARG . 39.8 Cg_endo -78.01 -179.31 5.33 Favored 'Trans proline' 0 C--N 1.384 2.427 0 C-N-CA 121.735 1.623 . . . . 0.0 110.248 177.823 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.1 t -98.75 -27.15 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.117 0 CA-C-O 117.545 -1.217 . . . . 0.0 111.69 -178.768 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -61.9 -43.51 98.69 Favored 'General case' 0 N--CA 1.518 2.936 0 CA-C-N 120.189 1.359 . . . . 0.0 110.459 -178.342 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.423 ' CD2' HD22 ' B' ' 534' ' ' LEU . 6.9 mp -98.57 -16.07 19.26 Favored 'General case' 0 N--CA 1.509 2.52 0 CA-C-O 118.676 -0.678 . . . . 0.0 112.149 179.545 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -67.76 -29.65 68.91 Favored 'General case' 0 N--CA 1.538 3.948 0 N-CA-C 103.591 -2.744 . . . . 0.0 103.591 168.51 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -55.24 -39.1 69.34 Favored 'General case' 0 N--CA 1.518 2.971 0 C-N-CA 123.892 0.877 . . . . 0.0 110.259 174.02 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.632 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 54.9 t90 -66.22 -34.67 78.53 Favored 'General case' 0 N--CA 1.528 3.462 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 177.246 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.1 -35.29 59.46 Favored 'General case' 0 N--CA 1.537 3.916 0 CA-C-N 118.923 0.783 . . . . 0.0 108.905 175.834 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -71.76 -37.12 70.56 Favored 'General case' 1 N--CA 1.539 4.002 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 175.461 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.451 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 3.0 mt-10 -60.51 -22.27 63.38 Favored 'General case' 1 N--CA 1.544 4.251 0 C-N-CA 123.607 0.763 . . . . 0.0 110.636 175.047 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.517 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -118.05 6.46 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.514 0 CA-C-O 118.744 -0.646 . . . . 0.0 112.215 -177.017 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.2 mt -111.67 -62.05 1.61 Allowed 'General case' 0 N--CA 1.525 3.281 0 N-CA-C 105.793 -1.929 . . . . 0.0 105.793 175.201 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.0 tt . . . . . 1 N--CA 1.54 4.049 0 C-N-CA 125.572 1.549 . . . . 0.0 112.287 -179.113 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 . . . . . 0 N--CA 1.521 3.091 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 519' ' ' TRP . . . . . 0.739 ' CE2' HD11 ' A' ' 39' ' ' LEU . 64.2 t-105 -42.43 -29.54 0.28 Allowed 'General case' 1 N--CA 1.549 4.482 0 C-N-CA 123.954 0.901 . . . . 0.0 113.335 179.166 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 520' ' ' LEU . . . . . 0.55 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.2 mm? -93.98 -31.64 14.18 Favored 'General case' 0 N--CA 1.524 3.274 0 CA-C-O 117.696 -1.145 . . . . 0.0 113.879 -172.197 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 54.3 mtt-85 -61.7 -25.76 67.62 Favored 'General case' 1 N--CA 1.546 4.361 0 N-CA-C 105.729 -1.952 . . . . 0.0 105.729 171.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 522' ' ' PHE . . . . . 0.53 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 2.0 m-85 -76.24 -43.24 42.97 Favored 'General case' 0 N--CA 1.511 2.602 0 CA-C-O 117.287 -1.34 . . . . 0.0 107.401 173.641 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 523' ' ' VAL . . . . . 0.451 HG23 ' O ' ' B' ' 519' ' ' TRP . 54.1 t -65.82 -17.29 21.95 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.24 0 CA-C-O 117.717 -1.135 . . . . 0.0 112.246 179.549 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -77.62 -52.59 8.77 Favored 'General case' 0 N--CA 1.527 3.419 0 CA-C-N 120.396 1.453 . . . . 0.0 107.885 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 525' ' ' LEU . . . . . 0.509 HD23 ' HB ' ' A' ' 103' ' ' VAL . 5.1 mp -75.35 -14.6 60.49 Favored 'General case' 0 N--CA 1.53 3.547 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 175.798 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.23 -35.92 68.97 Favored 'General case' 0 N--CA 1.521 3.102 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 174.153 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 30.7 ttmt -68.73 -21.96 64.36 Favored 'General case' 0 N--CA 1.512 2.644 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.633 176.183 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -67.55 -40.17 84.96 Favored 'General case' 0 N--CA 1.535 3.82 0 CA-C-N 119.365 0.984 . . . . 0.0 108.465 176.454 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 529' ' ' ALA . . . . . 0.632 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -90.22 -13.46 35.41 Favored 'General case' 0 N--CA 1.504 2.24 0 CA-C-O 117.968 -1.015 . . . . 0.0 111.637 178.71 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.29 -28.64 42.25 Favored 'General case' 0 N--CA 1.537 3.908 0 CA-C-N 120.787 1.63 . . . . 0.0 107.461 177.478 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -61.7 -47.77 83.81 Favored 'General case' 0 N--CA 1.527 3.415 0 C-N-CA 124.421 1.089 . . . . 0.0 108.425 176.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -91.4 -85.33 0.24 Allowed 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 177.256 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.8 p30 152.58 51.76 0.0 OUTLIER 'General case' 1 N--CA 1.555 4.825 0 C-N-CA 127.339 2.256 . . . . 0.0 108.263 176.456 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 534' ' ' LEU . . . . . 0.423 HD22 ' CD2' ' A' ' 96' ' ' LEU . 7.0 mt -109.89 12.16 23.95 Favored 'General case' 0 N--CA 1.519 2.997 0 C-N-CA 125.249 1.42 . . . . 0.0 109.924 -179.435 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 535' ' ' HIS . . . . . 0.493 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 24.6 p-80 -86.38 9.09 19.08 Favored 'General case' 0 N--CA 1.516 2.871 0 C-N-CA 124.146 0.979 . . . . 0.0 108.873 175.461 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 536' ' ' LEU . . . . . 0.526 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 20.3 mt -97.05 -52.04 0.22 Allowed Pre-proline 0 N--CA 1.502 2.173 0 CA-C-O 116.589 -1.672 . . . . 0.0 107.794 -176.314 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 537' ' ' PRO . . . . . 0.526 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 2.7 Cg_exo -65.8 -34.1 41.22 Favored 'Trans proline' 0 C--N 1.401 3.308 0 N-CA-C 106.693 -2.08 . . . . 0.0 106.693 170.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.47 -51.68 68.83 Favored 'General case' 0 N--CA 1.523 3.211 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 174.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 40.1 mt -77.45 -6.81 54.79 Favored 'General case' 0 N--CA 1.535 3.811 0 CA-C-O 118.441 -0.79 . . . . 0.0 112.599 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -75.36 -22.67 57.36 Favored 'General case' 0 N--CA 1.518 2.963 0 CA-C-O 117.601 -1.19 . . . . 0.0 111.576 179.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 541' ' ' LEU . . . . . 0.408 HD13 ' O ' ' B' ' 541' ' ' LEU . 0.2 OUTLIER -127.58 -27.47 2.86 Favored 'General case' 0 N--CA 1.524 3.256 0 CA-C-O 117.214 -1.374 . . . . 0.0 113.648 -179.839 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 542' ' ' MET . . . . . 0.551 ' HE2' HG22 ' A' ' 55' ' ' VAL . 2.2 ptp -79.77 9.68 4.92 Favored 'General case' 1 N--CA 1.543 4.221 0 CA-C-N 121.663 2.028 . . . . 0.0 110.583 177.42 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 1.6 tp -132.78 -89.36 0.42 Allowed 'General case' 0 N--CA 1.519 2.985 0 CA-C-N 120.183 1.356 . . . . 0.0 111.823 178.591 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 162.56 175.45 0.04 OUTLIER Pre-proline 1 N--CA 1.578 5.967 0 C-N-CA 125.12 1.368 . . . . 0.0 109.971 -177.682 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -64.73 -21.45 64.93 Favored 'Trans proline' 0 N--CA 1.527 3.475 0 C-N-CA 122.25 1.967 . . . . 0.0 109.834 173.761 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -72.29 8.87 1.17 Allowed 'General case' 0 N--CA 1.517 2.908 0 C-N-CA 123.38 0.672 . . . . 0.0 110.728 175.517 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.6 -57.91 3.96 Favored 'General case' 0 N--CA 1.51 2.568 0 CA-C-O 117.493 -1.241 . . . . 0.0 108.326 178.474 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 -93.65 -5.98 47.42 Favored 'General case' 0 N--CA 1.527 3.422 0 CA-C-N 120.303 1.41 . . . . 0.0 111.507 175.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -74.35 -45.89 44.2 Favored 'General case' 0 N--CA 1.535 3.777 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 173.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -90.34 -23.33 21.16 Favored 'General case' 0 N--CA 1.521 3.108 0 CA-C-O 117.652 -1.166 . . . . 0.0 112.363 179.239 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 551' ' ' LEU . . . . . 0.423 HD23 ' CE3' ' A' ' 19' ' ' TRP . 17.4 tp -80.86 -33.28 34.6 Favored 'General case' 1 N--CA 1.54 4.071 0 CA-C-N 120.657 1.571 . . . . 0.0 107.707 176.539 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -73.49 -52.76 8.11 Favored Glycine 0 N--CA 1.496 2.676 0 N-CA-C 109.905 -1.278 . . . . 0.0 109.905 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 1.8 m -71.97 -33.8 68.45 Favored 'General case' 0 N--CA 1.536 3.873 0 CA-C-N 118.415 1.108 . . . . 0.0 112.574 -177.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -67.23 -52.64 38.54 Favored 'General case' 1 N--CA 1.54 4.052 0 N-CA-C 106.916 -1.512 . . . . 0.0 106.916 176.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 555' ' ' VAL . . . . . 0.614 HG21 ' HB2' ' A' ' 22' ' ' PHE . 42.8 t -61.25 -18.43 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.66 0 CA-C-O 117.938 -1.03 . . . . 0.0 110.485 177.406 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 -79.25 -42.21 26.41 Favored 'General case' 0 N--CA 1.525 3.291 0 CA-C-O 116.869 -1.539 . . . . 0.0 111.152 177.4 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 557' ' ' ILE . . . . . 0.537 ' HB ' HG22 ' B' ' 582' ' ' ILE . 0.0 OUTLIER -71.83 -22.04 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.946 0 CA-C-N 122.178 2.263 . . . . 0.0 110.742 179.911 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 558' ' ' VAL . . . . . 0.542 ' CG1' HD21 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -87.14 -52.1 12.06 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.746 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 -178.784 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -67.1 -17.0 64.68 Favored 'General case' 0 N--CA 1.523 3.188 0 CA-C-O 118.599 -0.715 . . . . 0.0 110.975 178.375 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -96.97 -23.9 16.07 Favored 'General case' 0 N--CA 1.528 3.445 0 CA-C-O 118.277 -0.868 . . . . 0.0 109.946 176.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 21.2 tp -78.47 -56.66 4.27 Favored 'General case' 0 N--CA 1.534 3.742 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 178.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 6.7 tp -45.18 -30.11 1.1 Allowed 'General case' 0 N--CA 1.537 3.914 0 C-N-CA 125.196 1.398 . . . . 0.0 112.82 -179.257 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.14 -50.22 7.59 Favored 'General case' 0 N--CA 1.527 3.392 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 177.341 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 77.7 94.55 0.24 Allowed Glycine 0 N--CA 1.514 3.862 0 CA-C-O 119.616 -0.547 . . . . 0.0 113.51 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -165.86 -57.95 0.03 OUTLIER 'General case' 0 N--CA 1.531 3.608 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 177.179 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 47.4 mtt -131.18 69.9 1.47 Allowed 'General case' 0 N--CA 1.519 3.0 0 N-CA-C 106.564 -1.643 . . . . 0.0 106.564 178.623 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 567' ' ' SER . . . . . 0.43 ' HA ' HD22 ' B' ' 571' ' ' LEU . 6.1 t -126.25 -8.52 6.44 Favored 'General case' 0 N--CA 1.523 3.209 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -177.071 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -113.47 -70.67 0.79 Allowed 'General case' 0 N--CA 1.526 3.366 0 CA-C-N 120.042 1.292 . . . . 0.0 111.843 -178.135 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 24.0 mtt180 -91.43 -52.37 4.82 Favored 'General case' 0 N--CA 1.53 3.532 0 CA-C-N 118.853 0.751 . . . . 0.0 110.38 -178.207 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -68.68 -12.16 61.05 Favored 'General case' 0 N--CA 1.519 3.0 0 CA-C-O 118.183 -0.913 . . . . 0.0 112.613 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 571' ' ' LEU . . . . . 0.598 HD23 HG21 ' B' ' 582' ' ' ILE . 24.2 tp -80.72 -54.72 5.38 Favored 'General case' 0 N--CA 1.517 2.912 0 CA-C-N 119.554 1.07 . . . . 0.0 109.798 179.586 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -45.88 -32.35 2.6 Favored 'General case' 1 N--CA 1.545 4.281 0 CA-C-N 119.229 0.922 . . . . 0.0 112.507 -179.716 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -72.65 -42.12 64.72 Favored 'General case' 0 N--CA 1.534 3.757 0 C-N-CA 122.988 0.515 . . . . 0.0 110.61 -179.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -43.97 -56.57 3.86 Favored 'General case' 1 N--CA 1.539 4.002 0 C-N-CA 125.137 1.375 . . . . 0.0 113.568 -179.165 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -137.43 -41.74 0.56 Allowed 'General case' 0 N--CA 1.528 3.447 0 CA-C-O 118.814 -0.612 . . . . 0.0 111.579 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 125.66 98.78 1.15 Allowed Glycine 1 N--CA 1.517 4.047 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -126.72 -47.34 1.54 Allowed 'General case' 0 N--CA 1.525 3.311 0 C-N-CA 123.529 0.732 . . . . 0.0 109.44 178.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 108.14 161.05 20.65 Favored Glycine 1 N--CA 1.519 4.22 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -178.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.01 -18.0 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.861 0 CA-C-N 119.219 1.51 . . . . 0.0 108.062 177.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -71.01 -38.33 72.63 Favored 'General case' 0 N--CA 1.522 3.149 0 CA-C-N 119.843 1.201 . . . . 0.0 110.301 177.318 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 4.2 p -78.07 -46.86 19.7 Favored 'General case' 0 N--CA 1.536 3.855 0 CA-C-N 119.689 1.131 . . . . 0.0 111.659 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 582' ' ' ILE . . . . . 0.598 HG21 HD23 ' B' ' 571' ' ' LEU . 1.4 pt -68.49 -22.36 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.932 0 CA-C-O 117.854 -1.07 . . . . 0.0 113.289 -177.319 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 31.0 p -108.74 -21.55 12.63 Favored 'General case' 0 N--CA 1.521 3.095 0 CA-C-N 119.728 1.149 . . . . 0.0 111.95 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 11.3 ptt180 -82.75 -21.55 34.65 Favored 'General case' 0 N--CA 1.531 3.592 0 CA-C-N 119.98 1.264 . . . . 0.0 107.875 173.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -67.66 -31.87 77.09 Favored Glycine 0 N--CA 1.514 3.853 0 N-CA-C 109.703 -1.359 . . . . 0.0 109.703 176.181 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 88.2 p -65.92 -34.83 79.01 Favored 'General case' 1 N--CA 1.54 4.044 0 CA-C-N 118.537 1.168 . . . . 0.0 110.053 177.408 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -58.06 -29.04 65.08 Favored 'General case' 1 N--CA 1.539 4.01 0 C-N-CA 123.888 0.875 . . . . 0.0 111.306 178.773 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.31 -35.43 80.99 Favored 'General case' 0 N--CA 1.537 3.917 0 C-N-CA 123.26 0.624 . . . . 0.0 110.507 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 23.6 mt -73.14 -45.76 54.86 Favored 'General case' 0 N--CA 1.518 2.954 0 C-N-CA 123.651 0.78 . . . . 0.0 110.699 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.46 -30.71 31.19 Favored 'General case' 1 N--CA 1.552 4.631 0 C-N-CA 123.672 0.789 . . . . 0.0 112.351 -179.608 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -96.61 -35.22 11.13 Favored 'General case' 0 N--CA 1.519 3.013 0 C-N-CA 123.301 0.64 . . . . 0.0 111.259 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 592' ' ' ALA . . . . . 0.403 ' HB1' ' HD2' ' B' ' 593' ' ' PRO . . . -51.72 164.32 0.55 Allowed Pre-proline 1 N--CA 1.543 4.191 0 CA-C-O 118.197 -0.906 . . . . 0.0 112.941 -179.818 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 593' ' ' PRO . . . . . 0.403 ' HD2' ' HB1' ' B' ' 592' ' ' ALA . 38.4 Cg_endo -76.09 147.64 30.27 Favored 'Trans proline' 0 C--N 1.38 2.212 0 C-N-CA 121.873 1.715 . . . . 0.0 110.028 178.349 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.7 t -84.6 -26.24 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.745 0 CA-C-O 117.442 -1.266 . . . . 0.0 112.016 -178.117 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -65.17 -35.6 81.6 Favored 'General case' 0 N--CA 1.518 2.925 0 CA-C-N 120.282 1.401 . . . . 0.0 110.596 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 596' ' ' LEU . . . . . 0.581 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.8 mp -97.75 -21.23 17.09 Favored 'General case' 0 N--CA 1.517 2.879 0 C-N-CA 123.929 0.892 . . . . 0.0 110.423 178.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.51 -35.36 77.49 Favored 'General case' 1 N--CA 1.55 4.527 0 N-CA-C 103.764 -2.68 . . . . 0.0 103.764 168.503 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -57.36 -40.46 78.13 Favored 'General case' 0 N--CA 1.52 3.046 0 C-N-CA 125.358 1.463 . . . . 0.0 111.278 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 599' ' ' TRP . . . . . 0.582 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 57.5 t90 -57.97 -34.44 69.94 Favored 'General case' 1 N--CA 1.54 4.064 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 179.387 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 54.1 mt -53.68 -42.38 67.88 Favored 'General case' 0 N--CA 1.538 3.962 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 176.681 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -68.07 -33.76 75.16 Favored 'General case' 0 N--CA 1.53 3.545 0 O-C-N 123.802 0.689 . . . . 0.0 109.42 176.703 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 602' ' ' GLU . . . . . 0.418 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.6 OUTLIER -61.29 -25.02 66.83 Favored 'General case' 1 N--CA 1.542 4.149 0 C-N-CA 123.362 0.665 . . . . 0.0 110.148 175.27 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' B' B ' 603' ' ' VAL . . . . . 0.546 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.2 OUTLIER -120.59 7.61 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.463 0 C-N-CA 123.747 0.819 . . . . 0.0 112.772 -177.003 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.73 -57.06 1.92 Allowed 'General case' 0 N--CA 1.512 2.643 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 178.075 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.533 3.677 0 C-N-CA 124.869 1.268 . . . . 0.0 113.51 -177.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 . . . . . 0 N--CA 1.526 3.375 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.683 ' CZ3' HD22 ' B' ' 551' ' ' LEU . 76.7 t-105 -51.35 -39.96 58.14 Favored 'General case' 1 N--CA 1.541 4.085 0 C-N-CA 123.034 0.534 . . . . 0.0 109.664 176.376 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.482 ' N ' HD22 ' A' ' 20' ' ' LEU . 2.6 mm? -81.5 -26.91 34.77 Favored 'General case' 0 N--CA 1.519 2.987 0 O-C-N 124.699 1.249 . . . . 0.0 111.633 -176.861 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.0 ttm180 -56.27 -29.17 60.75 Favored 'General case' 0 N--CA 1.539 3.982 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 173.125 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.561 ' CG ' HD21 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -86.03 -36.47 19.71 Favored 'General case' 0 N--CA 1.508 2.441 0 CA-C-O 116.218 -1.849 . . . . 0.0 108.784 173.6 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.5 t -68.73 -26.0 31.89 Favored 'Isoleucine or valine' 1 N--CA 1.571 5.606 0 CA-C-N 121.364 1.893 . . . . 0.0 112.645 -176.332 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -76.1 -50.32 15.0 Favored 'General case' 0 N--CA 1.534 3.737 0 CA-C-N 120.017 1.281 . . . . 0.0 107.588 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.7 mp -70.79 -16.46 62.74 Favored 'General case' 0 N--CA 1.527 3.386 0 O-C-N 123.428 0.455 . . . . 0.0 110.013 175.106 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -72.16 -36.7 69.37 Favored 'General case' 0 N--CA 1.519 2.997 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 175.762 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.451 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 22.1 tttt -66.02 -20.87 66.33 Favored 'General case' 0 N--CA 1.518 2.939 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.658 176.288 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -71.75 -40.97 68.99 Favored 'General case' 0 N--CA 1.529 3.485 0 CA-C-N 119.275 0.943 . . . . 0.0 108.722 176.771 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.604 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -87.89 -8.75 55.36 Favored 'General case' 0 N--CA 1.507 2.382 0 CA-C-O 118.566 -0.73 . . . . 0.0 110.699 177.69 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.451 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -83.02 -28.51 29.59 Favored 'General case' 0 N--CA 1.532 3.64 0 CA-C-N 120.017 1.28 . . . . 0.0 107.768 177.994 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -64.13 -45.59 87.88 Favored 'General case' 0 N--CA 1.525 3.298 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 176.332 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -93.31 -89.64 0.2 Allowed 'General case' 0 N--CA 1.513 2.677 0 N-CA-C 106.434 -1.691 . . . . 0.0 106.434 176.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 p30 156.36 51.27 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.918 0 C-N-CA 126.825 2.05 . . . . 0.0 107.877 177.447 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.574 HD22 ' CD2' ' B' ' 596' ' ' LEU . 8.8 mt -109.88 12.44 23.87 Favored 'General case' 0 N--CA 1.525 3.289 0 C-N-CA 124.388 1.075 . . . . 0.0 110.669 -178.501 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.52 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 39.2 p-80 -81.86 2.59 29.65 Favored 'General case' 0 N--CA 1.516 2.841 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 174.888 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.479 HD23 HD12 ' A' ' 39' ' ' LEU . 22.6 mt -95.84 -51.11 0.24 Allowed Pre-proline 0 N--CA 1.508 2.43 0 CA-C-O 117.212 -1.375 . . . . 0.0 109.638 -175.538 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.445 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 4.8 Cg_exo -65.82 -35.23 36.87 Favored 'Trans proline' 0 CA--C 1.574 2.485 0 N-CA-C 105.975 -2.356 . . . . 0.0 105.975 170.259 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.52 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 1.9 tm? -59.64 -38.34 81.14 Favored 'General case' 0 N--CA 1.521 3.109 0 C-N-CA 124.149 0.98 . . . . 0.0 108.946 175.597 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.698 HD21 ' CZ2' ' B' ' 519' ' ' TRP . 2.1 mt -59.95 -44.67 94.26 Favored 'General case' 1 N--CA 1.559 5.005 0 CA-C-N 119.236 0.926 . . . . 0.0 108.903 177.108 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -61.71 -17.75 56.95 Favored 'General case' 1 N--CA 1.542 4.148 0 CA-C-O 118.642 -0.694 . . . . 0.0 112.834 -179.833 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.496 HD11 HG11 ' B' ' 558' ' ' VAL . 0.7 OUTLIER -97.61 -50.52 4.46 Favored 'General case' 0 N--CA 1.525 3.289 0 CA-C-O 118.067 -0.968 . . . . 0.0 113.115 -177.335 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.415 ' N ' HD13 ' A' ' 41' ' ' LEU . 2.9 ptt? -115.36 18.68 15.95 Favored 'General case' 1 N--CA 1.556 4.851 0 CA-C-N 119.829 1.195 . . . . 0.0 113.792 -175.935 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.495 ' O ' HG23 ' A' ' 44' ' ' THR . 4.8 tp -130.44 -80.78 0.54 Allowed 'General case' 0 N--CA 1.52 3.071 0 CA-C-O 117.481 -1.247 . . . . 0.0 110.233 176.671 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.495 HG23 ' O ' ' A' ' 43' ' ' LEU . 4.6 p 140.73 156.47 0.0 OUTLIER Pre-proline 1 N--CA 1.57 5.538 0 C-N-CA 127.178 2.191 . . . . 0.0 109.271 179.583 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -67.13 -37.84 17.54 Favored 'Trans proline' 0 N--CA 1.517 2.893 0 C-N-CA 123.167 2.578 . . . . 0.0 110.627 177.525 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -64.02 -21.98 66.73 Favored 'General case' 0 N--CA 1.532 3.651 0 CA-C-O 118.666 -0.683 . . . . 0.0 110.755 178.249 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -73.39 -28.97 62.3 Favored 'General case' 0 N--CA 1.52 3.045 0 CA-C-O 117.368 -1.301 . . . . 0.0 110.513 179.018 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 24.1 ptt180 -83.34 -24.55 32.05 Favored 'General case' 0 N--CA 1.537 3.907 0 CA-C-N 120.175 1.352 . . . . 0.0 107.703 174.318 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -67.58 -26.41 66.27 Favored 'General case' 1 N--CA 1.542 4.17 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 172.721 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -92.53 -28.74 16.59 Favored 'General case' 0 N--CA 1.511 2.592 0 C-N-CA 124.809 1.244 . . . . 0.0 111.316 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.457 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 34.8 tp -78.08 -20.05 53.03 Favored 'General case' 0 N--CA 1.537 3.894 0 N-CA-C 105.501 -2.037 . . . . 0.0 105.501 172.137 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.431 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -69.97 -70.96 1.07 Allowed Glycine 0 C--N 1.374 2.686 0 C-N-CA 125.311 1.434 . . . . 0.0 109.557 177.386 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.6 m -66.18 -25.35 66.9 Favored 'General case' 0 N--CA 1.531 3.607 0 CA-C-O 117.744 -1.122 . . . . 0.0 112.85 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -70.77 -52.07 23.02 Favored 'General case' 0 N--CA 1.534 3.754 0 CA-C-N 120.063 1.302 . . . . 0.0 108.417 177.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 23.0 t -64.42 -16.19 18.85 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.171 0 O-C-N 120.871 -1.143 . . . . 0.0 109.61 175.599 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -76.75 -46.46 25.17 Favored 'General case' 0 N--CA 1.523 3.199 0 CA-C-N 120.001 1.273 . . . . 0.0 111.793 178.779 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.451 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -72.58 -23.26 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.41 0 CA-C-N 120.843 1.656 . . . . 0.0 111.297 -179.216 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -88.69 -52.53 10.94 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.846 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -58.02 -24.67 59.22 Favored 'General case' 1 N--CA 1.54 4.034 0 CA-C-O 118.871 -0.585 . . . . 0.0 110.138 178.145 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -88.35 -32.25 18.5 Favored 'General case' 0 N--CA 1.519 3.009 0 CA-C-O 118.345 -0.836 . . . . 0.0 109.555 177.208 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 16.8 tp -64.09 -58.24 7.24 Favored 'General case' 0 N--CA 1.539 4.0 0 CA-C-N 119.3 0.955 . . . . 0.0 110.463 -179.795 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 33.1 mt -49.17 -26.7 3.0 Favored 'General case' 1 N--CA 1.542 4.132 0 C-N-CA 123.72 0.808 . . . . 0.0 112.891 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 26.9 mmm180 -88.01 -42.32 12.52 Favored 'General case' 0 N--CA 1.527 3.421 0 CA-C-N 118.474 0.579 . . . . 0.0 110.216 -179.548 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 67.17 88.09 0.07 OUTLIER Glycine 1 N--CA 1.525 4.602 0 CA-C-O 119.134 -0.814 . . . . 0.0 111.703 178.687 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -160.45 -54.24 0.05 Allowed 'General case' 0 N--CA 1.53 3.563 0 CA-C-N 117.714 0.757 . . . . 0.0 110.468 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 9.0 ptt? -142.32 73.76 1.42 Allowed 'General case' 0 N--CA 1.531 3.622 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.434 ' HA ' HD22 ' A' ' 71' ' ' LEU . 18.1 m -133.38 -13.94 2.62 Favored 'General case' 0 N--CA 1.522 3.126 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 -173.71 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -111.98 -67.82 0.97 Allowed 'General case' 0 N--CA 1.529 3.482 0 CA-C-N 120.179 1.354 . . . . 0.0 112.776 -177.499 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 11.0 mtt180 -94.94 -47.1 6.57 Favored 'General case' 0 N--CA 1.532 3.642 0 CA-C-N 118.83 0.741 . . . . 0.0 111.097 -177.368 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -72.95 -12.17 60.85 Favored 'General case' 0 N--CA 1.517 2.906 0 CA-C-O 118.438 -0.792 . . . . 0.0 112.759 -179.704 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.608 HD23 HG21 ' A' ' 82' ' ' ILE . 26.0 tp -80.21 -54.54 5.65 Favored 'General case' 0 N--CA 1.527 3.401 0 CA-C-O 117.735 -1.126 . . . . 0.0 113.429 -177.287 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -40.11 -48.7 2.53 Favored 'General case' 1 N--CA 1.558 4.94 0 CA-C-N 119.943 1.247 . . . . 0.0 114.162 -177.39 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -68.88 -34.88 76.16 Favored 'General case' 0 N--CA 1.535 3.782 0 CA-C-O 118.967 -0.54 . . . . 0.0 112.154 -177.899 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -53.12 -52.67 57.94 Favored 'General case' 0 N--CA 1.534 3.753 0 C-N-CA 124.196 0.998 . . . . 0.0 113.023 -178.764 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.9 pp -121.6 -41.45 2.48 Favored 'General case' 0 N--CA 1.534 3.733 0 CA-C-O 118.895 -0.574 . . . . 0.0 111.326 -178.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 122.25 64.55 0.22 Allowed Glycine 1 N--CA 1.523 4.463 0 N-CA-C 110.81 -0.916 . . . . 0.0 110.81 179.341 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -133.3 109.6 9.49 Favored 'General case' 0 N--CA 1.518 2.957 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 178.518 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -45.14 171.61 0.01 OUTLIER Glycine 1 N--CA 1.546 5.983 0 C-N-CA 124.448 1.023 . . . . 0.0 114.388 -177.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.6 mt -82.13 -14.35 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.666 0 CA-C-N 118.69 1.245 . . . . 0.0 108.9 178.468 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.03 -31.72 69.49 Favored 'General case' 0 N--CA 1.523 3.188 0 CA-C-N 119.821 1.191 . . . . 0.0 110.675 176.756 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.3 p -83.51 -42.61 16.67 Favored 'General case' 1 N--CA 1.541 4.115 0 CA-C-N 119.926 1.239 . . . . 0.0 111.636 -179.702 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.608 HG21 HD23 ' A' ' 71' ' ' LEU . 0.7 OUTLIER -70.61 -23.42 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.873 0 CA-C-O 118.043 -0.98 . . . . 0.0 112.587 -178.18 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 70.8 p -105.5 -25.32 12.37 Favored 'General case' 0 N--CA 1.517 2.901 0 CA-C-N 119.605 1.093 . . . . 0.0 111.321 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.9 ptt180 -79.11 -22.51 45.1 Favored 'General case' 0 N--CA 1.535 3.811 0 CA-C-N 120.105 1.321 . . . . 0.0 108.116 174.261 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.49 -32.29 82.91 Favored Glycine 1 N--CA 1.516 4.005 0 N-CA-C 110.009 -1.237 . . . . 0.0 110.009 176.682 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 60.2 p -68.07 -32.3 72.54 Favored 'General case' 0 N--CA 1.537 3.91 0 CA-C-N 118.577 1.189 . . . . 0.0 110.031 177.025 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -60.15 -30.66 69.45 Favored 'General case' 1 N--CA 1.541 4.093 0 C-N-CA 123.726 0.81 . . . . 0.0 111.132 178.224 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.432 ' HB3' ' HA ' ' B' ' 541' ' ' LEU . 18.4 m -61.04 -42.0 97.65 Favored 'General case' 0 N--CA 1.537 3.909 0 C-N-CA 123.813 0.845 . . . . 0.0 111.578 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 22.1 mt -57.54 -39.72 77.24 Favored 'General case' 0 N--CA 1.531 3.585 0 C-N-CA 124.064 0.946 . . . . 0.0 111.42 -179.614 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 12.1 mmpt? -59.3 -20.82 57.58 Favored 'General case' 1 N--CA 1.542 4.131 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -178.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -95.88 -48.15 5.85 Favored 'General case' 0 N--CA 1.52 3.044 0 CA-C-N 119.083 0.856 . . . . 0.0 111.864 -178.464 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.35 160.7 0.35 Allowed Pre-proline 1 N--CA 1.553 4.716 0 CA-C-O 118.14 -0.933 . . . . 0.0 113.486 -178.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -79.68 174.62 11.52 Favored 'Trans proline' 0 C--N 1.381 2.286 0 C-N-CA 121.661 1.574 . . . . 0.0 110.444 179.091 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -98.82 -28.65 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.972 0 CA-C-O 117.484 -1.246 . . . . 0.0 111.779 -178.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -63.64 -40.61 97.31 Favored 'General case' 0 N--CA 1.515 2.804 0 CA-C-N 119.966 1.257 . . . . 0.0 110.468 -178.478 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.467 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.5 mp -98.13 -18.29 18.58 Favored 'General case' 0 N--CA 1.512 2.641 0 C-N-CA 123.337 0.655 . . . . 0.0 111.517 178.701 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.53 -29.18 69.21 Favored 'General case' 1 N--CA 1.547 4.397 0 N-CA-C 103.293 -2.854 . . . . 0.0 103.293 169.029 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -57.36 -39.72 76.58 Favored 'General case' 0 N--CA 1.515 2.797 0 C-N-CA 124.29 1.036 . . . . 0.0 110.335 174.716 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.63 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 53.0 t90 -64.03 -34.98 79.25 Favored 'General case' 0 N--CA 1.533 3.701 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 177.018 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.78 -38.25 60.8 Favored 'General case' 1 N--CA 1.54 4.056 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 176.408 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -68.03 -38.69 82.85 Favored 'General case' 1 N--CA 1.54 4.062 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 175.772 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -61.58 -22.33 65.11 Favored 'General case' 1 N--CA 1.544 4.263 0 C-N-CA 123.45 0.7 . . . . 0.0 110.983 176.6 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.507 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -118.97 6.32 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.543 0 CA-C-N 118.481 0.582 . . . . 0.0 112.192 -177.785 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -108.27 -56.28 2.27 Favored 'General case' 0 N--CA 1.514 2.757 0 N-CA-C 106.028 -1.842 . . . . 0.0 106.028 176.288 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 35.2 mt . . . . . 1 N--CA 1.544 4.248 0 C-N-CA 125.708 1.603 . . . . 0.0 111.712 179.072 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 . . . . . 0 N--CA 1.525 3.295 0 CA-C-O 118.947 -0.549 . . . . 0.0 109.749 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 519' ' ' TRP . . . . . 0.698 ' CZ2' HD21 ' A' ' 39' ' ' LEU . 64.6 t-105 -40.64 -32.47 0.21 Allowed 'General case' 1 N--CA 1.548 4.449 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -179.297 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 520' ' ' LEU . . . . . 0.534 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.3 mm? -90.12 -31.06 17.26 Favored 'General case' 0 N--CA 1.525 3.298 0 CA-C-O 117.867 -1.063 . . . . 0.0 113.418 -172.601 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 31.6 ttt180 -61.51 -23.09 65.67 Favored 'General case' 1 N--CA 1.544 4.269 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 171.803 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 522' ' ' PHE . . . . . 0.546 ' O ' HD23 ' B' ' 526' ' ' LEU . 1.1 m-85 -82.02 -39.36 23.65 Favored 'General case' 0 N--CA 1.513 2.722 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 174.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 41.2 t -64.99 -22.45 31.46 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.228 0 CA-C-O 117.911 -1.042 . . . . 0.0 112.08 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -76.62 -52.8 9.01 Favored 'General case' 0 N--CA 1.534 3.761 0 CA-C-N 120.116 1.326 . . . . 0.0 107.963 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 7.4 mp -66.74 -21.64 66.06 Favored 'General case' 0 N--CA 1.533 3.722 0 CA-C-O 119.401 -0.333 . . . . 0.0 110.273 176.293 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 526' ' ' LEU . . . . . 0.546 HD23 ' O ' ' B' ' 522' ' ' PHE . 1.8 mm? -70.06 -37.16 75.44 Favored 'General case' 0 N--CA 1.52 3.036 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 176.419 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 10.3 ttmt -66.68 -24.56 66.28 Favored 'General case' 0 N--CA 1.517 2.888 0 CA-C-O 118.153 -0.927 . . . . 0.0 110.695 176.339 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -69.21 -38.2 78.46 Favored 'General case' 1 N--CA 1.541 4.08 0 CA-C-N 119.544 1.065 . . . . 0.0 109.017 176.819 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 529' ' ' ALA . . . . . 0.63 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -91.68 -9.02 45.4 Favored 'General case' 0 N--CA 1.499 1.983 0 CA-C-O 118.019 -0.991 . . . . 0.0 111.242 178.882 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -81.72 -30.79 32.39 Favored 'General case' 0 N--CA 1.53 3.549 0 CA-C-N 120.73 1.605 . . . . 0.0 108.595 179.106 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -61.53 -42.87 99.45 Favored 'General case' 0 N--CA 1.538 3.928 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 176.705 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -95.71 -86.72 0.3 Allowed 'General case' 0 N--CA 1.518 2.969 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 177.371 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.8 p30 151.26 52.87 0.0 OUTLIER 'General case' 1 N--CA 1.558 4.94 0 C-N-CA 127.755 2.422 . . . . 0.0 107.59 177.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 534' ' ' LEU . . . . . 0.467 HD22 ' CD2' ' A' ' 96' ' ' LEU . 6.2 mt -111.11 8.02 21.59 Favored 'General case' 0 N--CA 1.532 3.675 0 C-N-CA 124.161 0.985 . . . . 0.0 111.703 -178.226 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 535' ' ' HIS . . . . . 0.607 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 53.3 p-80 -81.98 -1.82 49.45 Favored 'General case' 0 N--CA 1.513 2.712 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 175.361 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 536' ' ' LEU . . . . . 0.442 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 46.3 mt -91.87 -50.32 0.31 Allowed Pre-proline 0 N--CA 1.507 2.388 0 CA-C-O 116.346 -1.787 . . . . 0.0 109.092 -176.446 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 537' ' ' PRO . . . . . 0.442 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 3.3 Cg_exo -64.48 -37.13 40.06 Favored 'Trans proline' 0 C--N 1.394 2.959 0 N-CA-C 107.225 -1.875 . . . . 0.0 107.225 171.593 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 538' ' ' LEU . . . . . 0.4 ' C ' HD13 ' B' ' 538' ' ' LEU . 0.2 OUTLIER -61.94 -41.3 97.8 Favored 'General case' 0 N--CA 1.527 3.394 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 175.39 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 8.1 mt -70.15 -24.11 63.11 Favored 'General case' 0 N--CA 1.536 3.84 0 CA-C-O 118.045 -0.979 . . . . 0.0 111.448 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -78.34 -6.76 56.07 Favored 'General case' 0 N--CA 1.526 3.365 0 CA-C-N 119.405 1.002 . . . . 0.0 110.645 178.523 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 541' ' ' LEU . . . . . 0.608 HD13 ' N ' ' B' ' 542' ' ' MET . 0.0 OUTLIER -106.67 -43.22 4.77 Favored 'General case' 0 N--CA 1.513 2.718 0 C-N-CA 124.159 0.984 . . . . 0.0 109.212 -179.587 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 542' ' ' MET . . . . . 0.608 ' N ' HD13 ' B' ' 541' ' ' LEU . 7.8 ptt? -94.84 -3.44 48.89 Favored 'General case' 0 N--CA 1.53 3.571 0 CA-C-O 117.78 -1.105 . . . . 0.0 112.728 -179.286 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.67 -108.17 0.3 Allowed 'General case' 0 N--CA 1.526 3.34 0 CA-C-N 120.386 1.448 . . . . 0.0 112.236 -177.505 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 3.9 t 157.07 140.2 0.0 OUTLIER Pre-proline 1 N--CA 1.567 5.406 0 C-N-CA 126.654 1.982 . . . . 0.0 108.332 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -52.27 -29.57 38.79 Favored 'Trans proline' 0 N--CA 1.524 3.276 0 C-N-CA 123.818 3.012 . . . . 0.0 115.891 -176.716 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -58.85 -31.48 68.56 Favored 'General case' 1 N--CA 1.545 4.285 0 CA-C-N 118.898 0.772 . . . . 0.0 112.514 -177.626 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.72 -31.28 63.3 Favored 'General case' 0 N--CA 1.524 3.239 0 CA-C-O 117.947 -1.025 . . . . 0.0 110.782 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -79.57 -20.18 47.62 Favored 'General case' 0 N--CA 1.527 3.41 0 CA-C-N 119.574 1.079 . . . . 0.0 110.633 177.111 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -70.07 -47.44 61.9 Favored 'General case' 0 N--CA 1.534 3.768 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 174.197 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -77.5 -11.67 59.88 Favored 'General case' 0 N--CA 1.512 2.664 0 CA-C-O 117.295 -1.335 . . . . 0.0 111.288 176.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 551' ' ' LEU . . . . . 0.683 HD22 ' CZ3' ' A' ' 19' ' ' TRP . 13.3 tp -81.5 -33.95 31.58 Favored 'General case' 0 N--CA 1.527 3.4 0 CA-C-N 120.722 1.601 . . . . 0.0 107.486 175.384 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -68.47 -52.45 26.1 Favored Glycine 0 N--CA 1.509 3.518 0 N-CA-C 108.732 -1.747 . . . . 0.0 108.732 178.429 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.9 m -67.34 -30.61 70.48 Favored 'General case' 0 N--CA 1.532 3.628 0 CA-C-O 118.205 -0.902 . . . . 0.0 111.891 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 11.5 mtm180 -67.49 -46.74 72.06 Favored 'General case' 1 N--CA 1.545 4.32 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 176.898 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 555' ' ' VAL . . . . . 0.411 HG23 ' O ' ' B' ' 551' ' ' LEU . 19.6 t -69.81 -15.64 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.681 0 CA-C-O 118.158 -0.925 . . . . 0.0 109.5 176.752 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 6.8 mtm-85 -80.04 -40.82 26.94 Favored 'General case' 0 N--CA 1.523 3.217 0 CA-C-O 117.583 -1.199 . . . . 0.0 111.202 178.004 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 557' ' ' ILE . . . . . 0.459 ' HB ' HG22 ' B' ' 582' ' ' ILE . 0.0 OUTLIER -74.36 -25.1 19.27 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.557 0 CA-C-N 121.115 1.78 . . . . 0.0 110.236 -179.547 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 558' ' ' VAL . . . . . 0.496 HG11 HD11 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -85.56 -50.92 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.928 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 179.74 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -58.8 -26.6 64.24 Favored 'General case' 0 N--CA 1.537 3.879 0 CA-C-O 118.985 -0.531 . . . . 0.0 110.377 178.399 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -95.03 -21.87 18.29 Favored 'General case' 0 N--CA 1.525 3.31 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.854 178.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 27.7 tp -71.44 -47.36 56.35 Favored 'General case' 0 N--CA 1.537 3.914 0 CA-C-N 119.751 1.16 . . . . 0.0 108.617 178.701 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 51.7 mt -59.26 -18.5 37.94 Favored 'General case' 0 N--CA 1.536 3.839 0 CA-C-O 118.143 -0.932 . . . . 0.0 113.157 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -94.21 -46.53 7.04 Favored 'General case' 0 N--CA 1.526 3.369 0 CA-C-N 119.359 0.982 . . . . 0.0 108.971 179.33 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 68.42 66.75 2.19 Favored Glycine 1 N--CA 1.52 4.262 0 CA-C-O 119.374 -0.681 . . . . 0.0 112.364 178.583 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -118.31 -59.56 1.88 Allowed 'General case' 0 N--CA 1.525 3.316 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 178.177 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 75.1 mtm -152.65 80.64 1.22 Allowed 'General case' 0 N--CA 1.522 3.138 0 N-CA-C 105.25 -2.13 . . . . 0.0 105.25 178.038 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 567' ' ' SER . . . . . 0.425 ' HA ' ' HB2' ' B' ' 571' ' ' LEU . 50.0 m -131.63 -9.0 3.62 Favored 'General case' 0 N--CA 1.524 3.248 0 N-CA-C 114.049 1.129 . . . . 0.0 114.049 -173.698 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -117.27 -56.15 2.26 Favored 'General case' 0 N--CA 1.526 3.325 0 CA-C-N 119.852 1.205 . . . . 0.0 110.989 -179.017 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -89.74 -62.8 1.39 Allowed 'General case' 0 N--CA 1.526 3.375 0 C-N-CA 122.661 0.385 . . . . 0.0 111.538 -178.071 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -80.59 -0.45 37.93 Favored 'General case' 0 N--CA 1.521 3.076 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -176.016 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 571' ' ' LEU . . . . . 0.601 HD23 HG21 ' B' ' 582' ' ' ILE . 21.4 tp -78.84 -45.81 20.01 Favored 'General case' 0 N--CA 1.526 3.337 0 CA-C-N 120.207 1.367 . . . . 0.0 110.398 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -45.81 -28.75 1.14 Allowed 'General case' 0 N--CA 1.534 3.771 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 -177.573 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -73.25 -41.33 63.82 Favored 'General case' 0 N--CA 1.532 3.666 0 CA-C-N 118.283 0.492 . . . . 0.0 111.358 -178.459 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -47.29 -51.58 18.73 Favored 'General case' 0 N--CA 1.536 3.836 0 C-N-CA 124.591 1.157 . . . . 0.0 113.672 -178.156 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -130.07 -39.75 1.36 Allowed 'General case' 0 N--CA 1.535 3.811 0 CA-C-O 118.662 -0.685 . . . . 0.0 111.857 -179.048 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 107.31 76.02 0.96 Allowed Glycine 1 N--CA 1.52 4.262 0 N-CA-C 110.331 -1.107 . . . . 0.0 110.331 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -114.23 -1.88 13.51 Favored 'General case' 0 N--CA 1.526 3.374 0 C-N-CA 123.463 0.705 . . . . 0.0 111.47 178.691 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 72.49 169.24 12.95 Favored Glycine 1 N--CA 1.52 4.272 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -178.859 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -90.4 -13.18 9.31 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.812 0 CA-C-N 118.554 1.177 . . . . 0.0 108.966 177.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -64.98 -37.65 88.35 Favored 'General case' 0 N--CA 1.526 3.346 0 CA-C-N 120.154 1.343 . . . . 0.0 111.583 178.618 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 2.8 p -82.97 -41.98 18.13 Favored 'General case' 1 N--CA 1.542 4.145 0 CA-C-N 120.1 1.318 . . . . 0.0 111.839 -179.378 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 582' ' ' ILE . . . . . 0.601 HG21 HD23 ' B' ' 571' ' ' LEU . 17.2 pt -70.25 -18.11 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.959 0 CA-C-O 117.685 -1.15 . . . . 0.0 113.385 -177.371 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 80.0 p -112.76 -27.49 8.13 Favored 'General case' 0 N--CA 1.514 2.774 0 CA-C-N 119.962 1.255 . . . . 0.0 111.038 177.536 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -75.57 -20.31 58.71 Favored 'General case' 0 N--CA 1.535 3.775 0 CA-C-N 120.049 1.295 . . . . 0.0 108.491 174.531 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -65.12 -36.59 93.12 Favored Glycine 1 N--CA 1.517 4.037 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 176.979 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 68.4 p -64.95 -33.85 77.02 Favored 'General case' 1 N--CA 1.541 4.119 0 CA-C-N 118.399 1.099 . . . . 0.0 110.325 177.564 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -56.52 -35.06 67.62 Favored 'General case' 1 N--CA 1.545 4.289 0 C-N-CA 123.819 0.848 . . . . 0.0 111.134 178.679 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 28.5 m -57.55 -42.84 83.79 Favored 'General case' 1 N--CA 1.541 4.096 0 C-N-CA 123.651 0.78 . . . . 0.0 111.153 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 19.8 mt -56.46 -44.82 80.9 Favored 'General case' 0 N--CA 1.528 3.447 0 C-N-CA 124.03 0.932 . . . . 0.0 111.63 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 20.9 mmmt -57.46 -26.47 61.27 Favored 'General case' 1 N--CA 1.544 4.229 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.995 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -86.86 -39.98 15.33 Favored 'General case' 0 N--CA 1.515 2.801 0 CA-C-N 118.493 0.588 . . . . 0.0 110.728 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.6 162.3 28.42 Favored Pre-proline 1 N--CA 1.542 4.136 0 CA-C-O 118.346 -0.835 . . . . 0.0 111.974 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -84.98 172.07 8.92 Favored 'Trans proline' 0 C--N 1.377 2.068 0 C-N-CA 122.045 1.83 . . . . 0.0 111.309 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.2 t -92.31 -24.64 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.118 0 CA-C-O 117.818 -1.087 . . . . 0.0 111.497 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -62.9 -40.66 98.24 Favored 'General case' 0 N--CA 1.516 2.866 0 CA-C-N 120.004 1.275 . . . . 0.0 110.437 -179.087 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 596' ' ' LEU . . . . . 0.574 ' CD2' HD22 ' A' ' 34' ' ' LEU . 7.1 mp -102.14 -12.54 17.99 Favored 'General case' 0 N--CA 1.511 2.59 0 C-N-CA 123.388 0.675 . . . . 0.0 112.188 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -31.46 71.46 Favored 'General case' 1 N--CA 1.544 4.241 0 N-CA-C 102.572 -3.122 . . . . 0.0 102.572 167.055 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.47 -38.29 68.91 Favored 'General case' 0 N--CA 1.52 3.054 0 C-N-CA 124.937 1.295 . . . . 0.0 110.289 174.598 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 599' ' ' TRP . . . . . 0.604 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 53.2 t90 -64.72 -35.84 82.37 Favored 'General case' 0 N--CA 1.538 3.946 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 176.798 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.37 -37.44 62.41 Favored 'General case' 0 N--CA 1.535 3.822 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 176.282 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -68.91 -37.53 79.02 Favored 'General case' 1 N--CA 1.544 4.248 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 175.273 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 602' ' ' GLU . . . . . 0.409 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 3.1 mm-40 -60.88 -21.75 63.6 Favored 'General case' 1 N--CA 1.543 4.192 0 C-N-CA 123.362 0.665 . . . . 0.0 110.494 175.867 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 603' ' ' VAL . . . . . 0.546 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.2 OUTLIER -123.9 6.99 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.536 0 C-N-CA 123.269 0.628 . . . . 0.0 112.439 -177.618 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -111.11 -59.43 1.97 Allowed 'General case' 0 N--CA 1.514 2.74 0 N-CA-C 105.385 -2.08 . . . . 0.0 105.385 176.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 12.6 tp . . . . . 0 N--CA 1.537 3.917 0 C-N-CA 125.085 1.354 . . . . 0.0 111.546 177.528 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 . . . . . 0 N--CA 1.516 2.832 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.82 ' CE3' HD22 ' B' ' 551' ' ' LEU . 66.6 t-105 -53.42 -39.46 64.36 Favored 'General case' 0 N--CA 1.536 3.85 0 C-N-CA 123.042 0.537 . . . . 0.0 109.64 175.804 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.45 ' N ' HD22 ' A' ' 20' ' ' LEU . 2.5 mm? -79.93 -27.29 39.86 Favored 'General case' 0 N--CA 1.517 2.898 0 CA-C-O 117.372 -1.299 . . . . 0.0 112.259 -175.557 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.8 mtt-85 -57.6 -31.72 66.49 Favored 'General case' 1 N--CA 1.547 4.406 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 172.126 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.58 ' CG ' HD21 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -80.78 -36.81 31.31 Favored 'General case' 0 N--CA 1.504 2.247 0 CA-C-O 116.22 -1.847 . . . . 0.0 109.668 174.615 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.7 t -69.98 -22.83 24.87 Favored 'Isoleucine or valine' 1 N--CA 1.565 5.289 0 CA-C-N 121.373 1.897 . . . . 0.0 112.498 -176.147 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -78.21 -48.56 15.56 Favored 'General case' 0 N--CA 1.535 3.781 0 CA-C-N 120.418 1.463 . . . . 0.0 107.496 178.576 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.2 mp -70.38 -17.9 63.04 Favored 'General case' 0 N--CA 1.535 3.818 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 175.195 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.429 HD23 ' CE2' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -72.53 -38.56 67.99 Favored 'General case' 0 N--CA 1.517 2.907 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 176.793 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.51 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 32.6 tttt -66.61 -16.94 64.55 Favored 'General case' 0 N--CA 1.514 2.727 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.025 176.594 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -74.14 -40.08 62.86 Favored 'General case' 0 N--CA 1.528 3.457 0 N-CA-C 108.32 -0.992 . . . . 0.0 108.32 175.756 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.611 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -89.92 -4.5 57.48 Favored 'General case' 0 N--CA 1.505 2.321 0 CA-C-O 118.701 -0.666 . . . . 0.0 110.434 177.23 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.51 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -87.55 -33.98 18.73 Favored 'General case' 0 N--CA 1.529 3.518 0 CA-C-N 120.364 1.438 . . . . 0.0 108.381 179.34 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -61.64 -41.82 98.03 Favored 'General case' 0 N--CA 1.537 3.907 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -92.55 -85.38 0.26 Allowed 'General case' 0 N--CA 1.511 2.612 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 177.282 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p30 150.47 46.84 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.071 0 C-N-CA 127.673 2.389 . . . . 0.0 108.56 177.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.474 HD22 ' CD2' ' B' ' 596' ' ' LEU . 7.8 mt -106.02 16.19 25.41 Favored 'General case' 0 N--CA 1.522 3.171 0 C-N-CA 124.557 1.143 . . . . 0.0 110.365 -178.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.562 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 42.7 p-80 -82.65 4.2 25.82 Favored 'General case' 0 N--CA 1.514 2.735 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 175.27 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.446 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 17.5 mt -92.67 -50.45 0.28 Allowed Pre-proline 0 N--CA 1.509 2.49 0 C-N-CA 125.462 1.505 . . . . 0.0 108.665 -176.116 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.446 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 9.5 Cg_exo -62.51 -35.96 68.14 Favored 'Trans proline' 0 C--N 1.391 2.811 0 N-CA-C 105.945 -2.367 . . . . 0.0 105.945 168.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.1 tt -53.7 -44.24 69.63 Favored 'General case' 0 N--CA 1.534 3.725 0 C-N-CA 124.085 0.954 . . . . 0.0 108.998 174.422 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.748 HD11 ' CE2' ' B' ' 519' ' ' TRP . 0.5 OUTLIER -60.73 -40.91 94.14 Favored 'General case' 1 N--CA 1.557 4.898 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 177.834 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -63.59 -12.97 37.44 Favored 'General case' 0 N--CA 1.535 3.807 0 CA-C-O 118.123 -0.942 . . . . 0.0 113.036 -179.473 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -110.92 -41.78 4.16 Favored 'General case' 0 N--CA 1.531 3.579 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 -177.41 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 4.0 ptp -128.72 13.27 6.39 Favored 'General case' 1 N--CA 1.55 4.571 0 CA-C-N 119.848 1.204 . . . . 0.0 113.436 -175.359 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -113.2 -72.65 0.7 Allowed 'General case' 0 N--CA 1.496 1.856 0 CA-C-N 118.99 0.814 . . . . 0.0 108.946 179.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 14.2 p 126.52 156.98 0.0 OUTLIER Pre-proline 1 N--CA 1.549 4.507 0 C-N-CA 128.629 2.772 . . . . 0.0 107.343 -178.02 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -70.03 -35.74 11.32 Favored 'Trans proline' 0 CA--C 1.571 2.366 0 C-N-CA 122.345 2.03 . . . . 0.0 107.572 174.189 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -65.31 -21.11 66.67 Favored 'General case' 0 N--CA 1.529 3.503 0 CA-C-O 118.175 -0.916 . . . . 0.0 110.296 175.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -75.03 -28.76 60.57 Favored 'General case' 0 N--CA 1.52 3.027 0 CA-C-O 117.283 -1.341 . . . . 0.0 110.137 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.8 ptt180 -87.21 -19.84 27.81 Favored 'General case' 0 N--CA 1.539 3.991 0 CA-C-N 120.406 1.457 . . . . 0.0 107.745 172.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -72.96 -24.09 60.74 Favored 'General case' 0 N--CA 1.525 3.302 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 172.485 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.438 ' O ' ' HB2' ' A' ' 54' ' ' ARG . . . -87.1 -42.95 12.65 Favored 'General case' 0 N--CA 1.501 2.1 0 CA-C-O 117.982 -1.009 . . . . 0.0 108.71 179.527 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.47 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 24.0 tp -68.24 -20.21 64.79 Favored 'General case' 1 N--CA 1.544 4.252 0 CA-C-N 120.753 1.615 . . . . 0.0 107.747 173.855 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.456 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -68.21 -69.27 1.42 Allowed Glycine 0 N--CA 1.5 2.966 0 C-N-CA 125.493 1.52 . . . . 0.0 111.17 177.475 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.7 m -75.44 -27.53 58.96 Favored 'General case' 0 N--CA 1.53 3.563 0 CA-C-O 117.838 -1.077 . . . . 0.0 112.442 -177.528 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -68.03 -49.4 61.72 Favored 'General case' 0 N--CA 1.531 3.62 0 CA-C-N 120.185 1.357 . . . . 0.0 107.705 177.514 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.3 t -65.67 -18.59 24.19 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.1 0 CA-C-O 117.929 -1.034 . . . . 0.0 109.776 176.258 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -71.84 -51.58 21.7 Favored 'General case' 0 N--CA 1.527 3.38 0 CA-C-N 120.012 1.278 . . . . 0.0 111.558 178.17 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -23.66 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.428 0 CA-C-N 120.789 1.631 . . . . 0.0 111.863 -178.049 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.423 ' CG1' HD22 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -86.13 -52.72 11.63 Favored 'Isoleucine or valine' 1 N--CA 1.548 4.454 0 CA-C-N 120.772 1.624 . . . . 0.0 107.308 -179.758 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -59.6 -24.06 63.47 Favored 'General case' 0 N--CA 1.532 3.634 0 CA-C-O 118.579 -0.724 . . . . 0.0 110.453 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -94.36 -24.18 17.49 Favored 'General case' 0 N--CA 1.524 3.23 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.5 177.338 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.423 HD22 ' OG ' ' A' ' 86' ' ' SER . 7.0 mt -72.2 -59.85 2.53 Favored 'General case' 0 N--CA 1.536 3.848 0 CA-C-N 119.521 1.055 . . . . 0.0 110.041 -179.622 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 46.3 mt -50.56 -29.29 10.39 Favored 'General case' 1 N--CA 1.545 4.308 0 C-N-CA 123.443 0.697 . . . . 0.0 112.732 -179.15 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -79.91 -47.78 14.51 Favored 'General case' 0 N--CA 1.528 3.446 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 71.67 86.99 0.15 Allowed Glycine 1 N--CA 1.519 4.169 0 CA-C-O 119.368 -0.684 . . . . 0.0 112.096 178.156 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -151.39 -54.71 0.14 Allowed 'General case' 0 N--CA 1.53 3.562 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.529 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 4.3 ttt -147.2 71.75 1.23 Allowed 'General case' 0 N--CA 1.52 3.045 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 178.56 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.523 ' HA ' HD22 ' A' ' 71' ' ' LEU . 97.2 p -142.86 7.41 1.64 Allowed 'General case' 0 N--CA 1.52 3.066 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -175.446 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -122.53 -62.31 1.38 Allowed 'General case' 0 N--CA 1.529 3.488 0 CA-C-N 119.672 1.124 . . . . 0.0 111.992 -178.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -110.28 -48.79 3.13 Favored 'General case' 0 N--CA 1.524 3.236 0 C-N-CA 123.547 0.739 . . . . 0.0 109.908 -177.422 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -78.47 4.6 12.77 Favored 'General case' 0 N--CA 1.513 2.71 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -177.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.681 HD23 HG21 ' A' ' 82' ' ' ILE . 44.0 tp -89.13 -46.54 8.74 Favored 'General case' 0 N--CA 1.53 3.567 0 CA-C-N 120.285 1.402 . . . . 0.0 113.233 -178.603 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -41.7 -42.59 2.6 Favored 'General case' 1 N--CA 1.544 4.228 0 N-CA-C 116.169 1.914 . . . . 0.0 116.169 -173.906 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -64.1 -21.52 66.57 Favored 'General case' 1 N--CA 1.545 4.306 0 CA-C-N 119.071 0.85 . . . . 0.0 113.117 -177.592 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -57.65 -59.77 4.69 Favored 'General case' 0 N--CA 1.529 3.476 0 C-N-CA 124.579 1.152 . . . . 0.0 112.587 -178.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.427 HD23 ' N ' ' A' ' 75' ' ' LEU . 1.3 pt? -130.78 -42.0 1.15 Allowed 'General case' 0 N--CA 1.526 3.369 0 CA-C-O 118.857 -0.592 . . . . 0.0 111.21 -179.538 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 120.34 78.26 0.53 Allowed Glycine 0 N--CA 1.514 3.897 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 179.344 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -104.53 -39.76 6.29 Favored 'General case' 0 N--CA 1.524 3.257 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 177.265 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.34 162.24 23.52 Favored Glycine 1 N--CA 1.524 4.547 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 -179.007 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.5 mt -84.7 -13.82 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.813 0 CA-C-N 119.721 1.761 . . . . 0.0 108.346 178.111 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.75 -40.31 72.77 Favored 'General case' 0 N--CA 1.517 2.878 0 CA-C-O 117.656 -1.164 . . . . 0.0 110.294 177.09 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 4.6 p -79.52 -42.37 25.32 Favored 'General case' 0 N--CA 1.538 3.961 0 CA-C-N 119.838 1.199 . . . . 0.0 112.807 -178.839 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.681 HG21 HD23 ' A' ' 71' ' ' LEU . 20.5 pt -70.88 -16.49 19.62 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.022 0 CA-C-O 117.853 -1.07 . . . . 0.0 113.749 -176.552 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 80.4 p -113.01 -32.75 6.26 Favored 'General case' 0 N--CA 1.514 2.773 0 CA-C-N 119.795 1.18 . . . . 0.0 110.216 178.007 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.5 ptt180 -71.91 -20.22 61.81 Favored 'General case' 0 N--CA 1.533 3.68 0 CA-C-N 119.56 1.073 . . . . 0.0 109.005 175.041 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -64.78 -38.18 95.26 Favored Glycine 1 N--CA 1.52 4.263 0 N-CA-C 108.529 -1.829 . . . . 0.0 108.529 175.43 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.423 ' OG ' HD22 ' A' ' 61' ' ' LEU . 50.3 m -65.09 -28.13 69.24 Favored 'General case' 1 N--CA 1.54 4.042 0 CA-C-N 117.747 0.773 . . . . 0.0 110.708 176.678 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -60.64 -31.62 70.82 Favored 'General case' 1 N--CA 1.54 4.046 0 CA-C-N 118.542 0.61 . . . . 0.0 111.228 179.218 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 2.6 m -65.59 -35.29 80.38 Favored 'General case' 0 N--CA 1.537 3.89 0 C-N-CA 123.471 0.708 . . . . 0.0 111.219 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 23.8 mt -56.33 -40.11 73.9 Favored 'General case' 0 N--CA 1.534 3.759 0 C-N-CA 124.165 0.986 . . . . 0.0 111.882 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -20.73 18.95 Favored 'General case' 1 N--CA 1.54 4.042 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 -178.756 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -106.56 -30.76 8.84 Favored 'General case' 0 N--CA 1.517 2.913 0 CA-C-N 119.301 0.955 . . . . 0.0 112.511 -179.421 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -49.88 160.37 0.64 Allowed Pre-proline 1 N--CA 1.55 4.531 0 CA-C-N 119.285 0.948 . . . . 0.0 113.508 -178.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -85.29 151.12 10.6 Favored 'Trans proline' 0 C--N 1.379 2.166 0 C-N-CA 122.497 2.131 . . . . 0.0 110.511 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.8 t -84.08 -25.83 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.217 0 CA-C-O 117.694 -1.146 . . . . 0.0 111.858 -179.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -63.27 -40.6 97.85 Favored 'General case' 0 N--CA 1.52 3.029 0 CA-C-N 120.346 1.43 . . . . 0.0 109.85 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.486 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.0 mp -97.87 -13.97 20.97 Favored 'General case' 0 N--CA 1.51 2.542 0 C-N-CA 123.818 0.847 . . . . 0.0 111.344 178.51 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.07 -36.65 84.7 Favored 'General case' 1 N--CA 1.544 4.237 0 N-CA-C 102.809 -3.034 . . . . 0.0 102.809 168.005 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -52.78 -38.27 60.87 Favored 'General case' 0 N--CA 1.517 2.886 0 C-N-CA 124.585 1.154 . . . . 0.0 111.621 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.661 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 50.6 t90 -63.0 -37.1 85.81 Favored 'General case' 0 N--CA 1.532 3.64 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.545 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 10.0 mp -55.31 -35.33 65.0 Favored 'General case' 1 N--CA 1.543 4.197 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 176.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -70.5 -35.95 73.51 Favored 'General case' 0 N--CA 1.536 3.853 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 175.177 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.411 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 3.0 mm-40 -62.2 -23.78 66.84 Favored 'General case' 1 N--CA 1.542 4.164 0 C-N-CA 123.739 0.816 . . . . 0.0 110.087 175.285 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.54 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -120.96 12.82 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.556 0 C-N-CA 123.673 0.789 . . . . 0.0 111.851 -178.052 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 43.4 mt -124.85 -62.32 1.25 Allowed 'General case' 0 N--CA 1.526 3.351 0 N-CA-C 106.573 -1.639 . . . . 0.0 106.573 176.234 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.411 HD23 ' O ' ' A' ' 105' ' ' LEU . 3.8 tt . . . . . 1 N--CA 1.548 4.448 0 C-N-CA 125.278 1.431 . . . . 0.0 111.899 179.073 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 . . . . . 0 N--CA 1.517 2.894 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 519' ' ' TRP . . . . . 0.748 ' CE2' HD11 ' A' ' 39' ' ' LEU . 68.5 t-105 -43.33 -28.09 0.3 Allowed 'General case' 1 N--CA 1.545 4.324 0 C-N-CA 124.206 1.002 . . . . 0.0 113.679 179.834 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 520' ' ' LEU . . . . . 0.578 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.2 mm? -96.12 -30.38 13.56 Favored 'General case' 0 N--CA 1.528 3.434 0 CA-C-O 117.847 -1.073 . . . . 0.0 113.733 -172.12 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 21.1 tpp180 -64.8 -23.44 67.24 Favored 'General case' 0 N--CA 1.533 3.679 0 N-CA-C 105.882 -1.896 . . . . 0.0 105.882 172.005 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 522' ' ' PHE . . . . . 0.543 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 2.1 m-85 -76.42 -41.39 47.85 Favored 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 106.059 -1.83 . . . . 0.0 106.059 172.466 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 523' ' ' VAL . . . . . 0.465 ' HA ' ' HB2' ' B' ' 526' ' ' LEU . 72.2 t -64.53 -18.32 22.98 Favored 'Isoleucine or valine' 1 N--CA 1.559 4.986 0 CA-C-N 119.52 1.055 . . . . 0.0 111.685 177.711 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -76.53 -56.22 4.82 Favored 'General case' 0 N--CA 1.532 3.669 0 CA-C-N 120.276 1.398 . . . . 0.0 107.842 -179.321 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 5.6 mp -67.61 -18.98 65.17 Favored 'General case' 0 N--CA 1.533 3.678 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 175.285 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 526' ' ' LEU . . . . . 0.465 ' HB2' ' HA ' ' B' ' 523' ' ' VAL . 0.4 OUTLIER -70.36 -39.78 74.44 Favored 'General case' 0 N--CA 1.513 2.716 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 177.688 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 527' ' ' LYS . . . . . 0.415 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 10.2 tttt -67.07 -18.65 65.43 Favored 'General case' 0 N--CA 1.524 3.24 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.884 177.229 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -72.97 -39.88 65.77 Favored 'General case' 0 N--CA 1.529 3.517 0 CA-C-N 119.46 1.027 . . . . 0.0 108.665 176.068 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 529' ' ' ALA . . . . . 0.661 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -92.83 -7.6 45.9 Favored 'General case' 0 N--CA 1.507 2.399 0 CA-C-O 118.629 -0.7 . . . . 0.0 111.166 178.221 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 530' ' ' TYR . . . . . 0.415 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.2 OUTLIER -83.73 -34.51 24.86 Favored 'General case' 0 N--CA 1.535 3.803 0 CA-C-N 120.35 1.432 . . . . 0.0 108.515 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -62.68 -41.35 99.05 Favored 'General case' 0 N--CA 1.534 3.728 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 177.192 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -91.85 -87.62 0.21 Allowed 'General case' 0 N--CA 1.514 2.732 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 176.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.9 p30 150.33 51.27 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.07 0 C-N-CA 127.755 2.422 . . . . 0.0 108.415 177.227 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 534' ' ' LEU . . . . . 0.486 HD22 ' CD2' ' A' ' 96' ' ' LEU . 4.8 mt -110.75 9.15 22.71 Favored 'General case' 0 N--CA 1.529 3.486 0 C-N-CA 124.624 1.17 . . . . 0.0 111.024 -178.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 535' ' ' HIS . . . . . 0.569 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 57.2 p-80 -82.53 -0.9 48.81 Favored 'General case' 0 N--CA 1.515 2.793 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 174.861 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 536' ' ' LEU . . . . . 0.43 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 39.2 mt -91.29 -49.82 0.33 Allowed Pre-proline 0 N--CA 1.505 2.277 0 CA-C-O 116.317 -1.802 . . . . 0.0 109.212 -176.088 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 537' ' ' PRO . . . . . 0.43 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 4.1 Cg_exo -66.26 -35.19 33.15 Favored 'Trans proline' 0 C--N 1.395 2.996 0 N-CA-C 107.345 -1.829 . . . . 0.0 107.345 171.252 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 538' ' ' LEU . . . . . 0.415 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 0.3 OUTLIER -62.17 -39.6 93.19 Favored 'General case' 0 N--CA 1.533 3.682 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 175.111 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 9.8 mt -73.32 -23.08 60.21 Favored 'General case' 0 N--CA 1.535 3.817 0 CA-C-O 118.583 -0.722 . . . . 0.0 111.125 177.401 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.53 -17.14 62.34 Favored 'General case' 0 N--CA 1.531 3.596 0 CA-C-N 118.853 0.751 . . . . 0.0 110.802 178.212 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 541' ' ' LEU . . . . . 0.433 ' O ' HD23 ' B' ' 541' ' ' LEU . 1.9 tt -101.01 -52.86 3.18 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 123.495 0.718 . . . . 0.0 110.916 -178.81 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 12.2 ptm -54.55 -41.52 69.87 Favored 'General case' 0 N--CA 1.531 3.611 0 CA-C-O 117.754 -1.117 . . . . 0.0 113.301 -174.537 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 1.3 tt -134.37 -104.3 0.23 Allowed 'General case' 0 N--CA 1.533 3.722 0 CA-C-O 117.307 -1.33 . . . . 0.0 113.545 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 31.0 p -156.27 163.47 24.77 Favored Pre-proline 1 N--CA 1.545 4.278 0 CA-C-N 121.322 1.874 . . . . 0.0 112.389 -177.466 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -67.54 -27.48 39.19 Favored 'Trans proline' 0 C--N 1.392 2.85 0 C-N-CA 122.849 2.366 . . . . 0.0 111.287 176.182 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -61.36 -21.57 64.16 Favored 'General case' 1 N--CA 1.54 4.03 0 CA-C-O 118.327 -0.844 . . . . 0.0 111.122 178.627 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -71.27 -38.48 71.85 Favored 'General case' 0 N--CA 1.528 3.446 0 CA-C-N 119.061 0.846 . . . . 0.0 108.923 177.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -79.78 -19.71 47.98 Favored 'General case' 0 N--CA 1.525 3.285 0 CA-C-O 117.792 -1.099 . . . . 0.0 111.126 177.207 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -68.65 -45.89 70.58 Favored 'General case' 0 N--CA 1.539 3.998 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 175.14 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -79.53 -16.41 56.02 Favored 'General case' 0 N--CA 1.509 2.508 0 CA-C-O 117.376 -1.297 . . . . 0.0 110.726 176.595 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 551' ' ' LEU . . . . . 0.82 HD22 ' CE3' ' A' ' 19' ' ' TRP . 5.7 tp -74.89 -31.54 61.6 Favored 'General case' 0 N--CA 1.528 3.451 0 CA-C-N 120.758 1.617 . . . . 0.0 107.765 174.759 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -70.74 -62.06 3.79 Favored Glycine 0 N--CA 1.5 2.918 0 N-CA-C 109.051 -1.62 . . . . 0.0 109.051 178.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 3.1 m -61.05 -27.37 68.29 Favored 'General case' 1 N--CA 1.54 4.058 0 CA-C-O 118.393 -0.813 . . . . 0.0 112.119 -179.34 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 7.5 mtm180 -69.5 -49.33 55.61 Favored 'General case' 0 N--CA 1.539 3.997 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 176.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 555' ' ' VAL . . . . . 0.556 HG23 ' O ' ' B' ' 551' ' ' LEU . 21.8 t -66.23 -15.51 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.865 0 CA-C-O 118.144 -0.931 . . . . 0.0 109.809 175.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 26.3 mtp180 -77.75 -46.71 20.94 Favored 'General case' 0 N--CA 1.52 3.067 0 CA-C-N 119.568 1.076 . . . . 0.0 110.807 178.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 557' ' ' ILE . . . . . 0.589 ' HB ' HG22 ' B' ' 582' ' ' ILE . 0.0 OUTLIER -71.56 -24.71 23.76 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.502 0 CA-C-N 120.282 1.401 . . . . 0.0 111.084 -179.054 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 558' ' ' VAL . . . . . 0.44 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -87.83 -52.64 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.76 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 -179.07 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -59.88 -22.95 63.02 Favored 'General case' 0 N--CA 1.534 3.741 0 CA-C-O 118.81 -0.614 . . . . 0.0 110.701 178.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -91.51 -28.34 17.65 Favored 'General case' 0 N--CA 1.524 3.249 0 CA-C-O 118.546 -0.74 . . . . 0.0 109.935 177.257 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -68.04 -46.17 71.92 Favored 'General case' 1 N--CA 1.539 4.015 0 CA-C-N 119.224 0.92 . . . . 0.0 109.249 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 33.3 mt -55.88 -25.71 43.78 Favored 'General case' 0 N--CA 1.535 3.781 0 C-N-CA 124.533 1.133 . . . . 0.0 112.234 178.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -82.99 -52.59 6.53 Favored 'General case' 0 N--CA 1.515 2.799 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 179.2 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 80.21 77.34 0.96 Allowed Glycine 0 N--CA 1.512 3.729 0 N-CA-C 110.018 -1.233 . . . . 0.0 110.018 179.556 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -144.61 -60.7 0.37 Allowed 'General case' 0 N--CA 1.523 3.208 0 CA-C-N 117.294 0.547 . . . . 0.0 109.615 -179.645 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 43.6 mtt -148.86 79.73 1.42 Allowed 'General case' 0 N--CA 1.524 3.251 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 567' ' ' SER . . . . . 0.402 ' HA ' HD22 ' B' ' 571' ' ' LEU . 17.4 m -140.46 -16.13 0.93 Allowed 'General case' 0 N--CA 1.522 3.169 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 -174.191 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -110.75 -53.43 2.7 Favored 'General case' 0 N--CA 1.531 3.6 0 CA-C-N 120.626 1.557 . . . . 0.0 112.159 -177.224 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -106.68 -53.37 2.63 Favored 'General case' 0 N--CA 1.528 3.458 0 C-N-CA 123.116 0.566 . . . . 0.0 110.475 -177.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -74.79 -0.13 17.27 Favored 'General case' 0 N--CA 1.515 2.812 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -177.685 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 571' ' ' LEU . . . . . 0.656 HD23 HG21 ' B' ' 582' ' ' ILE . 42.5 tp -88.64 -49.19 7.02 Favored 'General case' 0 N--CA 1.528 3.469 0 CA-C-N 120.142 1.337 . . . . 0.0 113.682 -177.861 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -44.39 -46.5 9.49 Favored 'General case' 1 N--CA 1.544 4.252 0 N-CA-C 114.935 1.457 . . . . 0.0 114.935 -175.11 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -62.47 -29.97 70.92 Favored 'General case' 1 N--CA 1.54 4.032 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -177.565 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -54.83 -57.36 11.87 Favored 'General case' 0 N--CA 1.528 3.437 0 C-N-CA 124.056 0.942 . . . . 0.0 112.636 -179.218 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -126.12 -38.99 2.11 Favored 'General case' 0 N--CA 1.533 3.709 0 CA-C-O 118.623 -0.703 . . . . 0.0 111.616 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 123.33 65.66 0.21 Allowed Glycine 1 N--CA 1.519 4.225 0 CA-C-N 118.971 0.805 . . . . 0.0 111.122 179.281 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -120.89 102.76 8.57 Favored 'General case' 0 N--CA 1.518 2.957 0 N-CA-C 105.506 -2.035 . . . . 0.0 105.506 177.343 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -40.4 162.82 0.01 OUTLIER Glycine 1 N--CA 1.539 5.513 0 C-N-CA 124.758 1.17 . . . . 0.0 114.653 -177.402 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 1.1 mt -79.43 -20.59 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.627 0 CA-C-N 119.028 1.414 . . . . 0.0 108.944 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -63.41 -33.53 75.75 Favored 'General case' 0 N--CA 1.53 3.545 0 CA-C-N 120.294 1.406 . . . . 0.0 109.853 175.72 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.8 p -80.24 -52.47 7.7 Favored 'General case' 0 N--CA 1.532 3.638 0 CA-C-N 118.997 0.817 . . . . 0.0 111.578 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 582' ' ' ILE . . . . . 0.656 HG21 HD23 ' B' ' 571' ' ' LEU . 24.2 pt -67.33 -18.7 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.83 0 CA-C-O 117.701 -1.143 . . . . 0.0 113.482 -176.632 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 61.0 p -107.57 -25.61 11.28 Favored 'General case' 0 N--CA 1.516 2.844 0 CA-C-N 119.814 1.188 . . . . 0.0 110.781 178.395 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 13.8 ptt180 -75.64 -22.27 56.95 Favored 'General case' 0 N--CA 1.532 3.653 0 CA-C-N 120.232 1.378 . . . . 0.0 108.087 174.225 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -69.59 -34.64 73.45 Favored Glycine 0 N--CA 1.513 3.826 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 175.767 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 60.2 p -72.32 -39.59 68.09 Favored 'General case' 0 N--CA 1.536 3.831 0 CA-C-N 118.362 1.081 . . . . 0.0 110.052 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -60.58 -32.59 71.69 Favored 'General case' 1 N--CA 1.541 4.09 0 C-N-CA 123.126 0.571 . . . . 0.0 110.523 179.085 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 1.4 m -58.87 -38.88 79.8 Favored 'General case' 1 N--CA 1.541 4.114 0 C-N-CA 123.436 0.695 . . . . 0.0 110.381 178.488 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 42.1 mt -61.47 -44.91 96.26 Favored 'General case' 0 N--CA 1.525 3.286 0 C-N-CA 123.955 0.902 . . . . 0.0 110.725 179.272 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.92 -26.21 64.14 Favored 'General case' 1 N--CA 1.543 4.202 0 C-N-CA 123.678 0.791 . . . . 0.0 112.158 179.53 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -84.05 -39.99 18.91 Favored 'General case' 0 N--CA 1.517 2.911 0 CA-C-N 118.627 0.649 . . . . 0.0 111.917 -178.324 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -55.63 161.58 3.07 Favored Pre-proline 1 N--CA 1.546 4.373 0 CA-C-O 118.258 -0.877 . . . . 0.0 113.098 -179.591 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -80.05 -179.89 5.65 Favored 'Trans proline' 0 C--N 1.379 2.171 0 C-N-CA 121.777 1.651 . . . . 0.0 110.355 178.655 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -97.83 -28.34 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.036 0 CA-C-O 117.865 -1.064 . . . . 0.0 111.489 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -61.1 -44.04 97.97 Favored 'General case' 0 N--CA 1.517 2.903 0 CA-C-N 119.808 1.185 . . . . 0.0 110.373 -178.657 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 596' ' ' LEU . . . . . 0.474 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.9 mp -99.47 -14.39 19.11 Favored 'General case' 0 N--CA 1.509 2.503 0 CA-C-O 118.653 -0.689 . . . . 0.0 112.023 179.299 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.85 -27.84 66.18 Favored 'General case' 1 N--CA 1.54 4.052 0 N-CA-C 103.35 -2.833 . . . . 0.0 103.35 168.75 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -56.87 -38.76 73.18 Favored 'General case' 0 N--CA 1.519 3.01 0 C-N-CA 123.889 0.876 . . . . 0.0 109.641 173.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 599' ' ' TRP . . . . . 0.611 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 44.0 t90 -63.75 -36.09 82.75 Favored 'General case' 0 N--CA 1.529 3.482 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 177.139 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.28 -37.08 54.51 Favored 'General case' 0 N--CA 1.535 3.803 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 177.073 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -69.9 -38.93 76.44 Favored 'General case' 0 N--CA 1.539 3.983 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 175.408 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.97 -23.8 48.42 Favored 'General case' 1 N--CA 1.546 4.367 0 C-N-CA 123.199 0.6 . . . . 0.0 110.598 175.295 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 603' ' ' VAL . . . . . 0.553 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.3 OUTLIER -120.57 0.85 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.321 0 CA-C-O 118.351 -0.833 . . . . 0.0 113.159 -176.475 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -112.87 -59.73 1.98 Allowed 'General case' 0 N--CA 1.509 2.522 0 N-CA-C 105.964 -1.865 . . . . 0.0 105.964 176.555 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 1 N--CA 1.542 4.138 0 C-N-CA 123.948 0.899 . . . . 0.0 110.552 178.7 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 . . . . . 0 N--CA 1.521 3.112 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.761 ' CE3' HD22 ' B' ' 551' ' ' LEU . 76.4 t-105 -51.37 -44.42 62.1 Favored 'General case' 1 N--CA 1.541 4.093 0 C-N-CA 123.471 0.708 . . . . 0.0 109.736 177.29 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.401 HD22 ' N ' ' A' ' 20' ' ' LEU . 2.3 mm? -77.41 -25.61 50.93 Favored 'General case' 0 N--CA 1.524 3.271 0 CA-C-O 117.557 -1.211 . . . . 0.0 111.745 -177.343 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.0 tpm_? -55.64 -30.54 61.17 Favored 'General case' 1 N--CA 1.544 4.266 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 173.813 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.55 ' HB2' HG21 ' B' ' 555' ' ' VAL . 0.0 OUTLIER -84.89 -37.57 20.46 Favored 'General case' 0 N--CA 1.507 2.411 0 CA-C-O 116.125 -1.893 . . . . 0.0 109.482 173.496 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 22.0 t -70.67 -29.9 40.03 Favored 'Isoleucine or valine' 1 N--CA 1.574 5.769 0 CA-C-N 121.382 1.901 . . . . 0.0 113.475 -174.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -73.05 -50.64 21.83 Favored 'General case' 0 N--CA 1.533 3.719 0 CA-C-N 120.298 1.408 . . . . 0.0 108.3 -179.786 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.7 mp -72.8 -15.69 61.63 Favored 'General case' 0 N--CA 1.525 3.314 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 175.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.537 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -69.79 -37.0 76.16 Favored 'General case' 0 N--CA 1.517 2.896 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 175.294 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.487 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 35.4 tttt -63.42 -21.68 66.44 Favored 'General case' 0 N--CA 1.522 3.169 0 CA-C-O 118.437 -0.792 . . . . 0.0 111.247 176.633 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -70.6 -41.47 72.27 Favored 'General case' 0 N--CA 1.534 3.768 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 175.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.633 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -88.72 -6.19 57.6 Favored 'General case' 0 N--CA 1.507 2.398 0 CA-C-O 118.676 -0.678 . . . . 0.0 110.908 178.073 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.487 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -83.94 -36.06 23.54 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-N 120.218 1.372 . . . . 0.0 108.52 179.486 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -61.08 -39.06 88.46 Favored 'General case' 0 N--CA 1.532 3.658 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 177.072 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -97.32 -85.45 0.36 Allowed 'General case' 0 N--CA 1.516 2.872 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 177.318 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p30 149.78 51.97 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.044 0 C-N-CA 127.515 2.326 . . . . 0.0 107.982 178.312 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.488 HD22 ' CD2' ' B' ' 596' ' ' LEU . 7.3 mt -112.32 11.56 20.1 Favored 'General case' 0 N--CA 1.532 3.652 0 C-N-CA 123.74 0.816 . . . . 0.0 111.354 -178.161 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.56 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 52.8 p-80 -81.4 0.29 38.12 Favored 'General case' 0 N--CA 1.518 2.966 0 C-N-CA 123.381 0.672 . . . . 0.0 109.473 174.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.463 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 22.8 mt -91.3 -50.98 0.31 Allowed Pre-proline 0 N--CA 1.51 2.555 0 C-N-CA 125.266 1.426 . . . . 0.0 109.148 -176.333 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.463 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 9.1 Cg_exo -62.11 -39.9 45.97 Favored 'Trans proline' 0 C--N 1.386 2.523 0 N-CA-C 106.428 -2.182 . . . . 0.0 106.428 170.305 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.458 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.3 OUTLIER -56.59 -38.64 72.29 Favored 'General case' 0 N--CA 1.531 3.606 0 C-N-CA 123.928 0.891 . . . . 0.0 109.736 176.11 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.648 HD11 ' CE2' ' B' ' 519' ' ' TRP . 3.0 mt -60.08 -42.25 94.2 Favored 'General case' 1 N--CA 1.561 5.093 0 CA-C-N 119.478 1.035 . . . . 0.0 109.237 175.979 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -63.27 -25.62 68.4 Favored 'General case' 1 N--CA 1.544 4.244 0 CA-C-O 118.614 -0.707 . . . . 0.0 112.732 -179.646 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.803 HD11 ' HB2' ' B' ' 592' ' ' ALA . 7.8 mp -81.19 -41.14 22.79 Favored 'General case' 0 N--CA 1.534 3.771 0 CA-C-N 118.827 0.74 . . . . 0.0 109.112 -179.357 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 11.9 ptt? -97.82 44.29 1.05 Allowed 'General case' 0 N--CA 1.53 3.537 0 N-CA-C 104.05 -2.574 . . . . 0.0 104.05 173.039 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.9 tp -30.73 -103.64 0.0 OUTLIER 'General case' 0 N--CA 1.531 3.611 0 C-N-CA 127.338 2.255 . . . . 0.0 115.41 -173.527 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 54.0 p 52.5 126.94 0.0 OUTLIER Pre-proline 0 N--CA 1.535 3.795 0 CA-C-N 120.624 1.557 . . . . 0.0 111.69 -178.477 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -62.09 -32.06 83.46 Favored 'Trans proline' 0 C--N 1.382 2.316 0 C-N-CA 121.27 1.313 . . . . 0.0 110.335 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -48.85 -21.78 0.7 Allowed 'General case' 1 N--CA 1.551 4.585 0 C-N-CA 124.394 1.078 . . . . 0.0 113.71 178.513 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -62.45 -73.81 0.1 Allowed 'General case' 0 N--CA 1.538 3.936 0 CA-C-N 119.671 1.123 . . . . 0.0 110.522 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -89.64 6.18 42.45 Favored 'General case' 0 N--CA 1.535 3.806 0 CA-C-N 119.806 1.184 . . . . 0.0 111.837 177.3 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -86.67 -30.77 21.48 Favored 'General case' 0 N--CA 1.518 2.975 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 172.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.88 -48.71 6.85 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.472 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 13.1 tp -65.06 -28.77 69.7 Favored 'General case' 1 N--CA 1.54 4.071 0 CA-C-N 119.98 1.263 . . . . 0.0 107.853 175.304 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.441 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -68.46 -73.72 0.67 Allowed Glycine 0 N--CA 1.505 3.262 0 C-N-CA 124.474 1.035 . . . . 0.0 112.64 177.343 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.5 m -69.78 -29.0 66.21 Favored 'General case' 0 N--CA 1.537 3.915 0 CA-C-O 117.989 -1.005 . . . . 0.0 113.418 -175.643 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.413 ' O ' HD13 ' A' ' 57' ' ' ILE . 6.6 mtt180 -73.39 -46.89 46.19 Favored 'General case' 0 N--CA 1.53 3.532 0 CA-C-N 120.179 1.354 . . . . 0.0 107.644 178.079 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.5 t -66.18 -16.96 21.57 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.9 0 O-C-N 120.648 -1.282 . . . . 0.0 109.41 174.345 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.32 -51.48 20.5 Favored 'General case' 0 N--CA 1.529 3.51 0 CA-C-N 120.022 1.283 . . . . 0.0 111.499 177.752 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.462 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -71.84 -23.57 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.51 0 CA-C-N 120.336 1.426 . . . . 0.0 112.123 -177.916 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.7 HG11 HD11 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -86.11 -51.51 13.15 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.088 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 -179.697 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -58.57 -25.0 62.07 Favored 'General case' 0 N--CA 1.538 3.931 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.505 178.002 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -94.45 -24.3 17.37 Favored 'General case' 0 N--CA 1.526 3.341 0 CA-C-O 118.303 -0.856 . . . . 0.0 110.859 177.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 20.7 tp -79.14 -70.2 0.52 Allowed 'General case' 0 N--CA 1.529 3.506 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.8 mt -42.84 -31.93 0.55 Allowed 'General case' 1 N--CA 1.544 4.232 0 C-N-CA 125.163 1.385 . . . . 0.0 113.683 -178.536 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.7 mmm180 -87.99 -43.33 11.82 Favored 'General case' 0 N--CA 1.526 3.345 0 CA-C-O 119.149 -0.453 . . . . 0.0 110.115 -179.166 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.37 87.12 0.59 Allowed Glycine 1 N--CA 1.517 4.097 0 N-CA-C 110.678 -0.969 . . . . 0.0 110.678 178.857 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -148.68 -54.53 0.19 Allowed 'General case' 0 N--CA 1.522 3.146 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.334 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 76.3 mtm -148.42 83.12 1.48 Allowed 'General case' 0 N--CA 1.516 2.83 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.8 t -146.95 14.9 1.18 Allowed 'General case' 0 N--CA 1.528 3.436 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -178.538 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -116.29 -72.18 0.7 Allowed 'General case' 0 N--CA 1.526 3.341 0 CA-C-N 119.154 0.888 . . . . 0.0 111.097 179.054 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -110.86 -46.29 3.37 Favored 'General case' 0 N--CA 1.522 3.149 0 C-N-CA 123.278 0.631 . . . . 0.0 110.135 -178.054 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -68.17 -14.62 63.12 Favored 'General case' 0 N--CA 1.517 2.892 0 CA-C-O 117.866 -1.064 . . . . 0.0 113.441 -178.305 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.73 HD23 HG21 ' A' ' 82' ' ' ILE . 13.6 tp -76.89 -60.34 2.4 Favored 'General case' 0 N--CA 1.529 3.485 0 CA-C-N 120.117 1.326 . . . . 0.0 112.701 -177.784 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -39.03 -32.63 0.09 Allowed 'General case' 1 N--CA 1.552 4.67 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -177.783 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -72.78 -44.64 61.31 Favored 'General case' 0 N--CA 1.532 3.642 0 CA-C-N 118.361 0.528 . . . . 0.0 110.46 -178.561 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -41.34 -51.65 3.63 Favored 'General case' 1 N--CA 1.541 4.094 0 C-N-CA 125.548 1.539 . . . . 0.0 113.39 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.99 -77.2 0.59 Allowed 'General case' 0 N--CA 1.532 3.674 0 CA-C-O 118.739 -0.648 . . . . 0.0 109.374 -179.703 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 157.63 45.89 0.01 OUTLIER Glycine 1 N--CA 1.522 4.38 0 CA-C-O 119.177 -0.79 . . . . 0.0 111.522 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -113.3 113.48 25.34 Favored 'General case' 0 N--CA 1.514 2.755 0 N-CA-C 107.4 -1.334 . . . . 0.0 107.4 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -44.67 176.24 0.01 OUTLIER Glycine 1 N--CA 1.541 5.652 0 C-N-CA 124.966 1.27 . . . . 0.0 115.184 -177.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.4 mt -81.55 -18.81 11.36 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.913 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 177.183 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.43 -0.19 19.2 Favored 'General case' 0 N--CA 1.513 2.694 0 CA-C-O 117.86 -1.067 . . . . 0.0 111.084 174.243 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.74 -47.94 3.91 Favored 'General case' 0 N--CA 1.536 3.864 0 CA-C-N 120.758 1.617 . . . . 0.0 109.283 176.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.73 HG21 HD23 ' A' ' 71' ' ' LEU . 0.1 OUTLIER -66.16 -41.01 88.56 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.912 0 CA-C-O 118.938 -0.553 . . . . 0.0 111.373 -178.192 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 50.3 p -82.64 -26.28 32.33 Favored 'General case' 0 N--CA 1.519 2.991 0 CA-C-O 118.743 -0.646 . . . . 0.0 109.991 178.46 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.6 ttp180 -65.15 -35.16 80.22 Favored 'General case' 1 N--CA 1.544 4.264 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 175.5 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -56.56 -36.61 71.66 Favored Glycine 1 N--CA 1.529 4.849 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 176.694 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 14.7 m -62.25 -41.43 98.43 Favored 'General case' 1 N--CA 1.542 4.158 0 CA-C-N 117.552 0.676 . . . . 0.0 110.181 177.526 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -61.67 -32.72 72.92 Favored 'General case' 1 N--CA 1.541 4.084 0 C-N-CA 123.893 0.877 . . . . 0.0 112.219 -179.677 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 2.5 m -68.32 -39.43 81.96 Favored 'General case' 1 N--CA 1.54 4.026 0 CA-C-N 118.311 0.505 . . . . 0.0 111.07 -178.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.4 mt -59.35 -40.46 86.47 Favored 'General case' 0 N--CA 1.528 3.471 0 C-N-CA 123.764 0.826 . . . . 0.0 111.588 -179.57 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -56.82 -28.69 61.87 Favored 'General case' 1 N--CA 1.543 4.219 0 CA-C-O 118.771 -0.633 . . . . 0.0 112.064 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.96 -38.0 21.55 Favored 'General case' 0 N--CA 1.516 2.874 0 CA-C-N 118.323 0.51 . . . . 0.0 111.216 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.11 161.86 0.68 Allowed Pre-proline 1 N--CA 1.548 4.434 0 CA-C-O 118.206 -0.902 . . . . 0.0 112.897 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -81.64 170.73 14.03 Favored 'Trans proline' 0 C--N 1.379 2.155 0 C-N-CA 121.687 1.591 . . . . 0.0 110.72 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.44 ' HA ' ' HB3' ' A' ' 97' ' ' ARG . 2.8 t -95.34 -29.08 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.029 0 CA-C-O 117.92 -1.038 . . . . 0.0 111.076 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -62.3 -42.61 99.5 Favored 'General case' 0 N--CA 1.513 2.685 0 CA-C-N 119.764 1.166 . . . . 0.0 109.962 -179.12 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.528 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.2 mp -98.84 -14.04 19.82 Favored 'General case' 0 N--CA 1.508 2.47 0 CA-C-O 118.302 -0.856 . . . . 0.0 112.221 179.072 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.44 ' HB3' ' HA ' ' A' ' 94' ' ' VAL . 0.1 OUTLIER -67.42 -30.57 70.35 Favored 'General case' 1 N--CA 1.549 4.522 0 N-CA-C 102.728 -3.064 . . . . 0.0 102.728 168.254 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -57.04 -39.59 75.14 Favored 'General case' 0 N--CA 1.517 2.914 0 C-N-CA 123.871 0.868 . . . . 0.0 110.201 174.725 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.658 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 47.8 t90 -65.1 -33.96 77.27 Favored 'General case' 0 N--CA 1.527 3.407 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 177.355 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.23 -36.68 61.3 Favored 'General case' 0 N--CA 1.538 3.928 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 176.429 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -69.51 -38.7 77.69 Favored 'General case' 1 N--CA 1.54 4.052 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 175.213 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.42 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 1.2 mm-40 -59.17 -23.99 62.69 Favored 'General case' 1 N--CA 1.546 4.341 0 C-N-CA 123.4 0.68 . . . . 0.0 110.63 175.865 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.508 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -113.37 -2.9 10.66 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.348 0 CA-C-O 118.11 -0.947 . . . . 0.0 112.399 -176.947 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 54.5 mt -102.99 -62.24 1.3 Allowed 'General case' 0 N--CA 1.527 3.378 0 N-CA-C 105.088 -2.19 . . . . 0.0 105.088 174.186 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.6 tp . . . . . 0 N--CA 1.53 3.538 0 C-N-CA 125.077 1.351 . . . . 0.0 111.384 177.912 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 . . . . . 0 N--CA 1.522 3.137 0 CA-C-O 118.66 -0.686 . . . . 0.0 110.924 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 519' ' ' TRP . . . . . 0.648 ' CE2' HD11 ' A' ' 39' ' ' LEU . 70.8 t-105 -43.7 -28.68 0.43 Allowed 'General case' 1 N--CA 1.55 4.559 0 N-CA-C 113.658 0.985 . . . . 0.0 113.658 -178.542 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 520' ' ' LEU . . . . . 0.605 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.1 mm? -97.76 -28.34 13.92 Favored 'General case' 0 N--CA 1.529 3.485 0 CA-C-O 117.637 -1.173 . . . . 0.0 113.715 -172.856 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -63.05 -24.84 68.1 Favored 'General case' 1 N--CA 1.54 4.039 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 171.355 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 522' ' ' PHE . . . . . 0.558 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.5 m-85 -76.73 -41.54 44.7 Favored 'General case' 0 N--CA 1.513 2.724 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 173.872 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 43.4 t -67.12 -22.51 29.38 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.25 0 CA-C-O 117.645 -1.169 . . . . 0.0 112.631 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -78.03 -51.45 10.31 Favored 'General case' 0 N--CA 1.528 3.44 0 CA-C-N 120.202 1.364 . . . . 0.0 109.153 -177.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 525' ' ' LEU . . . . . 0.454 HD23 ' HB ' ' A' ' 103' ' ' VAL . 5.0 mp -75.71 -18.84 59.46 Favored 'General case' 0 N--CA 1.524 3.249 0 O-C-N 123.395 0.434 . . . . 0.0 109.979 176.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 526' ' ' LEU . . . . . 0.444 HD23 ' O ' ' B' ' 522' ' ' PHE . 0.4 OUTLIER -71.89 -32.84 67.83 Favored 'General case' 0 N--CA 1.524 3.228 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 173.873 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -65.02 -26.35 68.23 Favored 'General case' 0 N--CA 1.518 2.966 0 CA-C-O 118.398 -0.81 . . . . 0.0 110.386 176.173 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -66.6 -41.93 87.67 Favored 'General case' 1 N--CA 1.54 4.071 0 CA-C-N 119.088 0.858 . . . . 0.0 108.861 176.715 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 529' ' ' ALA . . . . . 0.658 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -88.11 -10.47 49.96 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 118.035 -0.983 . . . . 0.0 111.548 178.855 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -81.31 -34.3 31.99 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-N 120.925 1.693 . . . . 0.0 108.864 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -60.31 -43.02 96.71 Favored 'General case' 0 N--CA 1.538 3.972 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 177.391 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 61.5 m-80 -92.96 -85.81 0.26 Allowed 'General case' 0 N--CA 1.516 2.864 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 177.142 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.9 p30 150.14 48.98 0.0 OUTLIER 'General case' 1 N--CA 1.559 5.017 0 C-N-CA 127.89 2.476 . . . . 0.0 108.245 177.658 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 534' ' ' LEU . . . . . 0.528 HD22 ' CD2' ' A' ' 96' ' ' LEU . 6.0 mt -105.45 7.7 33.21 Favored 'General case' 0 N--CA 1.53 3.564 0 C-N-CA 124.3 1.04 . . . . 0.0 111.012 -179.339 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 535' ' ' HIS . . . . . 0.615 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 46.6 p-80 -82.52 0.47 42.39 Favored 'General case' 0 N--CA 1.508 2.469 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 175.103 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 536' ' ' LEU . . . . . . . . . . . . . 42.5 mt -92.93 -49.16 0.29 Allowed Pre-proline 0 N--CA 1.508 2.458 0 CA-C-O 116.391 -1.766 . . . . 0.0 109.282 -176.023 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 537' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -67.11 -37.01 19.9 Favored 'Trans proline' 0 C--N 1.394 2.921 0 N-CA-C 107.179 -1.893 . . . . 0.0 107.179 171.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.85 -43.69 98.0 Favored 'General case' 0 N--CA 1.529 3.507 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 176.455 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 11.6 mt -66.36 -31.04 71.57 Favored 'General case' 0 N--CA 1.537 3.893 0 CA-C-O 118.865 -0.588 . . . . 0.0 110.781 179.323 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -54.63 -23.48 17.28 Favored 'General case' 1 N--CA 1.542 4.158 0 CA-C-N 118.952 0.796 . . . . 0.0 111.996 178.701 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 541' ' ' LEU . . . . . 0.7 HD11 HG11 ' A' ' 58' ' ' VAL . 0.0 OUTLIER -102.18 -41.34 6.43 Favored 'General case' 0 N--CA 1.519 2.98 0 C-N-CA 123.734 0.814 . . . . 0.0 109.297 -179.553 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 542' ' ' MET . . . . . 0.665 ' N ' HD13 ' B' ' 541' ' ' LEU . 4.3 ptt? -101.46 25.11 8.74 Favored 'General case' 1 N--CA 1.541 4.108 0 CA-C-N 119.061 0.846 . . . . 0.0 112.789 -178.427 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 543' ' ' LEU . . . . . 0.409 ' O ' HG23 ' B' ' 544' ' ' THR . 18.7 tp -131.64 -96.43 0.34 Allowed 'General case' 0 N--CA 1.536 3.84 0 CA-C-O 117.559 -1.21 . . . . 0.0 112.67 178.465 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 544' ' ' THR . . . . . 0.409 HG23 ' O ' ' B' ' 543' ' ' LEU . 18.1 p 129.14 140.23 0.0 OUTLIER Pre-proline 1 N--CA 1.558 4.952 0 C-N-CA 128.727 2.811 . . . . 0.0 106.94 -177.145 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -57.49 -32.56 94.5 Favored 'Trans proline' 0 N--CA 1.521 3.098 0 C-N-CA 122.84 2.36 . . . . 0.0 113.368 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -63.17 -34.76 78.32 Favored 'General case' 1 N--CA 1.539 4.024 0 CA-C-O 118.886 -0.578 . . . . 0.0 111.02 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -68.67 -40.97 79.91 Favored 'General case' 0 N--CA 1.53 3.534 0 CA-C-O 118.469 -0.777 . . . . 0.0 110.759 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 19.8 ptt180 -76.21 -20.5 57.41 Favored 'General case' 0 N--CA 1.529 3.519 0 CA-C-O 118.045 -0.979 . . . . 0.0 111.592 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -69.17 -44.26 72.57 Favored 'General case' 0 N--CA 1.536 3.842 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 174.248 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -80.18 -11.12 59.77 Favored 'General case' 0 N--CA 1.512 2.66 0 CA-C-O 117.736 -1.126 . . . . 0.0 111.538 177.419 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 551' ' ' LEU . . . . . 0.761 HD22 ' CE3' ' A' ' 19' ' ' TRP . 10.2 tp -77.23 -44.04 31.41 Favored 'General case' 0 N--CA 1.528 3.43 0 CA-C-N 120.779 1.627 . . . . 0.0 107.827 176.969 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -69.78 -49.23 37.22 Favored Glycine 0 N--CA 1.506 3.309 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 553' ' ' THR . . . . . 0.458 HG21 ' HB2' ' B' ' 577' ' ' ALA . 2.6 m -65.21 -33.81 76.88 Favored 'General case' 0 N--CA 1.532 3.667 0 CA-C-O 118.535 -0.745 . . . . 0.0 112.037 -178.752 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 22.6 mtt180 -65.31 -52.34 54.71 Favored 'General case' 1 N--CA 1.541 4.082 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 176.294 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 555' ' ' VAL . . . . . 0.55 HG21 ' HB2' ' A' ' 22' ' ' PHE . 17.5 t -64.86 -16.81 20.51 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.806 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.559 177.558 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 11.4 mmt180 -79.11 -43.49 23.98 Favored 'General case' 0 N--CA 1.52 3.03 0 CA-C-N 119.884 1.22 . . . . 0.0 110.5 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 557' ' ' ILE . . . . . 0.537 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -75.94 -25.68 17.23 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.93 0 CA-C-N 120.124 1.329 . . . . 0.0 111.421 -178.89 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 558' ' ' VAL . . . . . 0.537 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -86.43 -51.42 13.16 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.902 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 -178.708 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -61.08 -28.28 68.97 Favored 'General case' 0 N--CA 1.527 3.381 0 CA-C-O 118.6 -0.714 . . . . 0.0 110.326 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -89.49 -22.64 22.36 Favored 'General case' 0 N--CA 1.522 3.156 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.326 177.751 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.14 -46.62 70.31 Favored 'General case' 1 N--CA 1.543 4.185 0 CA-C-N 119.749 1.159 . . . . 0.0 108.379 177.503 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 15.2 mt -50.25 -28.61 7.97 Favored 'General case' 0 N--CA 1.537 3.911 0 C-N-CA 124.048 0.939 . . . . 0.0 111.978 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 24.8 mmm180 -82.61 -52.73 6.54 Favored 'General case' 0 N--CA 1.526 3.369 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.342 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 66.02 83.71 0.1 OUTLIER Glycine 1 N--CA 1.524 4.559 0 CA-C-O 119.308 -0.718 . . . . 0.0 112.949 177.729 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -161.8 -52.26 0.04 OUTLIER 'General case' 0 N--CA 1.528 3.46 0 CA-C-N 117.581 0.69 . . . . 0.0 109.729 178.535 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 86.9 mtp -145.02 54.53 1.22 Allowed 'General case' 0 N--CA 1.525 3.299 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 75.7 p -130.75 -4.88 4.09 Favored 'General case' 0 N--CA 1.522 3.16 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -176.543 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -107.29 -57.81 2.03 Favored 'General case' 0 N--CA 1.527 3.387 0 CA-C-N 119.938 1.244 . . . . 0.0 111.238 -178.192 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 3.5 ttm180 -99.53 -51.4 3.78 Favored 'General case' 0 N--CA 1.529 3.512 0 C-N-CA 123.234 0.613 . . . . 0.0 110.617 -177.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -73.73 3.77 6.03 Favored 'General case' 0 N--CA 1.515 2.797 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -176.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 571' ' ' LEU . . . . . 0.556 HD23 HD11 ' B' ' 582' ' ' ILE . 45.8 tp -91.12 -56.01 3.32 Favored 'General case' 0 N--CA 1.526 3.349 0 CA-C-N 120.219 1.372 . . . . 0.0 113.299 -178.585 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -30.12 -34.19 0.01 OUTLIER 'General case' 1 N--CA 1.551 4.615 0 N-CA-C 117.662 2.468 . . . . 0.0 117.662 -174.67 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -55.23 -20.36 10.63 Favored 'General case' 1 N--CA 1.545 4.276 0 CA-C-N 119.155 0.889 . . . . 0.0 112.779 -179.331 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -101.95 -83.1 0.47 Allowed 'General case' 0 N--CA 1.509 2.485 0 C-N-CA 124.287 1.035 . . . . 0.0 109.143 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 55.4 mt -139.17 17.85 2.6 Favored 'General case' 0 N--CA 1.53 3.529 0 CA-C-N 119.14 0.882 . . . . 0.0 111.51 -179.086 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . -47.68 -28.75 5.39 Favored Glycine 1 N--CA 1.548 6.138 0 O-C-N 120.866 -1.146 . . . . 0.0 113.851 -179.164 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 577' ' ' ALA . . . . . 0.458 ' HB2' HG21 ' B' ' 553' ' ' THR . . . 67.5 39.99 2.72 Favored 'General case' 1 N--CA 1.545 4.288 0 CA-C-N 118.539 1.17 . . . . 0.0 112.071 178.523 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 86.21 167.4 43.51 Favored Glycine 1 N--CA 1.519 4.195 0 CA-C-O 119.449 -0.639 . . . . 0.0 112.317 178.182 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 36.2 mm -84.63 -17.79 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.709 0 CA-C-N 118.621 1.21 . . . . 0.0 108.466 176.194 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -63.82 -39.39 94.12 Favored 'General case' 0 N--CA 1.523 3.218 0 CA-C-N 120.17 1.35 . . . . 0.0 110.097 177.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 15.2 p -77.44 -40.69 42.48 Favored 'General case' 1 N--CA 1.542 4.134 0 CA-C-N 119.208 0.913 . . . . 0.0 111.64 178.661 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 582' ' ' ILE . . . . . 0.556 HD11 HD23 ' B' ' 571' ' ' LEU . 1.1 tt -63.31 -36.8 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.258 0 C-N-CA 123.563 0.745 . . . . 0.0 112.682 -175.082 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 41.3 p -99.24 -30.15 12.42 Favored 'General case' 0 N--CA 1.513 2.722 0 CA-C-O 118.053 -0.975 . . . . 0.0 111.428 -178.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 21.3 ptt180 -71.91 -22.66 61.45 Favored 'General case' 0 N--CA 1.533 3.676 0 CA-C-N 119.891 1.223 . . . . 0.0 109.411 175.814 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -77.99 -28.06 57.17 Favored Glycine 0 N--CA 1.511 3.662 0 N-CA-C 109.428 -1.469 . . . . 0.0 109.428 176.065 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 10.9 m -63.16 -40.35 97.31 Favored 'General case' 0 N--CA 1.537 3.9 0 CA-C-N 118.239 1.019 . . . . 0.0 111.074 179.584 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -61.24 -24.93 66.72 Favored 'General case' 1 N--CA 1.54 4.03 0 CA-C-O 118.783 -0.627 . . . . 0.0 112.318 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 7.8 m -64.12 -41.88 97.07 Favored 'General case' 1 N--CA 1.541 4.093 0 CA-C-N 118.726 0.694 . . . . 0.0 110.663 179.46 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 42.1 mt -54.7 -43.3 72.41 Favored 'General case' 0 N--CA 1.531 3.588 0 C-N-CA 124.406 1.082 . . . . 0.0 111.944 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.86 -31.98 73.12 Favored 'General case' 1 N--CA 1.541 4.117 0 C-N-CA 123.339 0.656 . . . . 0.0 112.382 -178.83 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -74.35 -35.1 63.55 Favored 'General case' 0 N--CA 1.525 3.281 0 CA-C-N 118.352 0.524 . . . . 0.0 111.983 -179.306 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 592' ' ' ALA . . . . . 0.803 ' HB2' HD11 ' A' ' 41' ' ' LEU . . . -45.07 163.61 0.2 Allowed Pre-proline 1 N--CA 1.548 4.452 0 N-CA-C 115.207 1.558 . . . . 0.0 115.207 -178.837 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 593' ' ' PRO . . . . . 0.44 ' O ' ' HB2' ' B' ' 597' ' ' ARG . 60.1 Cg_endo -86.81 173.82 5.89 Favored 'Trans proline' 0 C--N 1.38 2.229 0 C-N-CA 122.125 1.884 . . . . 0.0 107.407 174.508 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.9 t -98.92 -27.62 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.311 0 CA-C-N 120.188 1.358 . . . . 0.0 111.662 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -62.55 -43.4 98.91 Favored 'General case' 0 N--CA 1.517 2.905 0 CA-C-N 120.079 1.309 . . . . 0.0 110.792 -178.232 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 596' ' ' LEU . . . . . 0.488 ' CD2' HD22 ' A' ' 34' ' ' LEU . 7.2 mp -99.97 -14.35 18.72 Favored 'General case' 0 N--CA 1.511 2.61 0 CA-C-O 118.723 -0.656 . . . . 0.0 112.26 179.382 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 597' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' B' ' 593' ' ' PRO . 0.0 OUTLIER -68.07 -30.17 69.3 Favored 'General case' 0 N--CA 1.538 3.927 0 N-CA-C 103.245 -2.872 . . . . 0.0 103.245 168.412 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -54.73 -37.97 66.55 Favored 'General case' 0 N--CA 1.521 3.115 0 C-N-CA 123.868 0.867 . . . . 0.0 110.094 173.444 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 599' ' ' TRP . . . . . 0.633 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 43.3 t90 -63.06 -38.41 91.07 Favored 'General case' 0 N--CA 1.536 3.828 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 177.262 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.85 -36.86 59.49 Favored 'General case' 0 N--CA 1.535 3.796 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 177.24 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -70.12 -36.24 74.67 Favored 'General case' 1 N--CA 1.541 4.117 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 175.699 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -62.27 -23.82 66.92 Favored 'General case' 1 N--CA 1.543 4.199 0 C-N-CA 123.619 0.768 . . . . 0.0 110.402 176.229 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 603' ' ' VAL . . . . . 0.51 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.1 OUTLIER -115.73 9.79 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.497 0 C-N-CA 123.163 0.585 . . . . 0.0 111.832 -177.501 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 26.7 mt -110.03 -63.1 1.42 Allowed 'General case' 0 N--CA 1.519 2.977 0 N-CA-C 105.281 -2.118 . . . . 0.0 105.281 175.554 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.525 3.285 0 C-N-CA 124.484 1.114 . . . . 0.0 109.932 179.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.412 -10.642 2 O4'-C1'-N19 118.852 13.814 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.343 4 O4'-C1'-N19 119.704 14.88 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.452 4 C4'-C3'-C2' 116.902 13.702 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . 0.407 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 6 O3'--C3' 1.565 10.289 4 O4'-C1'-N19 118.995 13.994 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' E' E ' 5' ' ' ' DC' . . . . . 0.66 ' H41' ' HA ' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.4 -11.793 5 O4'-C1'-N19 120.347 15.683 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.348 4 O4'-C1'-N19 120.115 15.394 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' E' E ' 7' ' ' ' DA' . . . . . 0.557 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.413 -10.509 5 N19-C1'-C2' 133.022 11.764 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' E' E ' 8' ' ' ' DG' . . . . . 0.557 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 5 C3'--C2' 1.421 -9.688 4 O4'-C1'-N19 119.673 14.842 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.409 -10.901 3 C4'-C3'-C2' 117.289 14.089 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.409 -10.919 3 O4'-C1'-N19 119.083 14.104 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.417 -10.078 4 O4'-C1'-N19 121.038 16.547 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.4 -11.753 2 O4'-C1'-N19 119.961 15.201 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.553 9.388 5 O4'-C1'-N19 123.301 19.376 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' E' E ' 14' ' ' ' DT' . . . . . 0.727 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 5 C3'--C2' 1.407 -11.136 5 O4'-C1'-N19 119.87 15.087 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' E' E ' 15' ' ' ' DA' . . . . . 0.769 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.419 -9.937 5 O4'-C1'-N19 120.292 15.615 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.413 -10.51 4 O4'-C1'-N19 120.331 15.663 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.576 11.189 5 O4'-C1'-N19 119.761 14.951 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.401 4 O4'-C1'-N19 120.783 16.229 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.607 3 O4'-C1'-N19 119.738 14.922 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.507 6.679 4 O4'-C1'-N19 119.506 14.632 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.361 3 O4'-C1'-N19 119.528 14.66 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.406 -11.241 5 O4'-C1'-N19 119.433 14.541 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.874 3 O4'-C1'-N19 119.866 15.083 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' F' F ' 4' ' ' ' DA' . . . . . 0.548 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 5 C3'--C2' 1.42 -9.83 4 O4'-C1'-N19 119.757 14.946 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' F' F ' 5' ' ' ' DC' . . . . . 0.46 ' H41' ' HA ' ' A' ' 80' ' ' ALA . . . . . . . . 6 O3'--C3' 1.575 11.048 4 O4'-C1'-N19 118.312 13.14 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.406 -11.174 3 O4'-C1'-N19 119.243 14.304 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.412 -11.625 4 N19-C1'-C2' 131.312 10.695 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.351 4 O4'-C1'-N19 119.423 14.529 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.503 4 O4'-C1'-N19 120.356 15.695 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.409 -10.899 4 O4'-C1'-N19 118.821 13.776 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.331 4 O4'-C1'-N19 120.417 15.771 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.228 5 C4'-C3'-C2' 117.227 14.027 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 4 O3'--C3' 1.551 9.195 4 O4'-C1'-N19 119.845 15.057 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' F' F ' 14' ' ' ' DT' . . . . . 0.56 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.41 -10.765 5 O4'-C1'-N19 118.762 13.703 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' F' F ' 15' ' ' ' DA' . . . . . 0.969 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 5 C3'--C2' 1.426 -9.212 3 O4'-C1'-N19 119.624 14.78 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.866 4 O4'-C1'-N19 119.401 14.502 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.647 3 O4'-C1'-N19 118.716 13.645 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.463 4 O4'-C1'-N19 120.21 15.513 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.564 10.253 3 O4'-C1'-N19 120.01 15.263 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C4'--C3' 1.598 6.954 5 O4'-C1'-N19 118.173 12.967 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 . . . . . 0 N--CA 1.499 1.977 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.6 t -144.21 129.82 9.73 Favored Pre-proline 0 N--CA 1.524 3.256 0 CA-C-O 117.298 -1.334 . . . . 0.0 110.134 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -72.4 -50.07 0.25 Allowed 'Trans proline' 0 C--N 1.392 2.822 0 C-N-CA 122.542 2.161 . . . . 0.0 110.213 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -120.85 140.92 51.1 Favored 'General case' 0 N--CA 1.528 3.463 0 C-N-CA 123.18 0.592 . . . . 0.0 110.218 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 46.8 m 66.56 125.79 0.02 OUTLIER 'General case' 0 N--CA 1.537 3.885 0 C-N-CA 124.584 1.154 . . . . 0.0 110.519 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -128.12 120.63 27.76 Favored 'General case' 0 N--CA 1.521 3.076 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 63.18 122.49 0.02 OUTLIER 'General case' 0 N--CA 1.534 3.748 0 C-N-CA 124.662 1.185 . . . . 0.0 111.323 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 36.6 ttp -103.15 124.8 49.27 Favored 'General case' 0 N--CA 1.518 2.931 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -145.05 -50.77 0.26 Allowed 'General case' 0 N--CA 1.521 3.088 0 C-N-CA 122.687 0.395 . . . . 0.0 110.203 -179.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 65.57 124.8 0.02 OUTLIER 'General case' 0 N--CA 1.536 3.86 0 C-N-CA 124.519 1.128 . . . . 0.0 110.484 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -158.36 134.38 9.17 Favored 'General case' 0 N--CA 1.53 3.534 0 C-N-CA 122.703 0.401 . . . . 0.0 110.793 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 -144.45 136.07 25.75 Favored 'General case' 0 N--CA 1.526 3.345 0 C-N-CA 122.605 0.362 . . . . 0.0 111.32 -179.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.451 ' O ' HD23 ' A' ' 20' ' ' LEU . 3.6 t60 -98.08 118.45 34.73 Favored 'General case' 0 N--CA 1.523 3.188 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 179.127 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -113.58 77.72 1.08 Allowed 'General case' 0 N--CA 1.526 3.37 0 CA-C-O 121.978 0.895 . . . . 0.0 110.739 -178.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.47 ' O ' HD21 ' B' ' 551' ' ' LEU . 44.2 mt-10 -149.9 -68.74 0.2 Allowed 'General case' 0 N--CA 1.531 3.594 0 N-CA-C 106.908 -1.516 . . . . 0.0 106.908 178.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.711 ' N ' HD11 ' B' ' 551' ' ' LEU . 68.5 t-105 -57.23 -21.09 31.44 Favored 'General case' 0 N--CA 1.534 3.771 0 CA-C-O 118.073 -0.965 . . . . 0.0 111.76 175.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.563 ' N ' HD22 ' A' ' 20' ' ' LEU . 2.3 mm? -91.29 -30.6 16.5 Favored 'General case' 0 N--CA 1.529 3.476 0 CA-C-O 118.182 -0.913 . . . . 0.0 111.861 -177.07 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.9 mtt180 -64.12 -26.82 68.71 Favored 'General case' 0 N--CA 1.535 3.796 0 N-CA-C 106.122 -1.807 . . . . 0.0 106.122 172.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.465 ' O ' HD23 ' A' ' 26' ' ' LEU . 9.4 t80 -83.21 -32.74 26.36 Favored 'General case' 0 N--CA 1.506 2.361 0 CA-C-O 116.739 -1.6 . . . . 0.0 108.564 174.704 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.687 HG23 ' O ' ' A' ' 19' ' ' TRP . 61.3 t -76.25 -25.25 16.55 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.227 0 CA-C-N 121.682 2.037 . . . . 0.0 112.885 -177.933 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -77.97 -43.79 28.64 Favored 'General case' 0 N--CA 1.532 3.648 0 CA-C-N 120.454 1.479 . . . . 0.0 108.83 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.4 mp -71.43 -27.2 63.12 Favored 'General case' 0 N--CA 1.53 3.557 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 176.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.465 HD23 ' O ' ' A' ' 22' ' ' PHE . 1.2 mm? -67.57 -35.82 79.76 Favored 'General case' 0 N--CA 1.53 3.55 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 176.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.9 ttmt -68.66 -25.68 64.94 Favored 'General case' 0 N--CA 1.515 2.781 0 CA-C-O 118.074 -0.965 . . . . 0.0 110.931 177.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -70.39 -38.51 74.71 Favored 'General case' 0 N--CA 1.533 3.676 0 CA-C-N 119.435 1.016 . . . . 0.0 109.434 178.01 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.555 ' HB1' ' N ' ' A' ' 35' ' ' HIS . . . -89.59 -8.85 51.71 Favored 'General case' 0 N--CA 1.499 2.02 0 CA-C-O 118.371 -0.823 . . . . 0.0 110.762 178.441 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -79.01 -33.82 44.55 Favored 'General case' 0 N--CA 1.53 3.526 0 CA-C-N 120.136 1.335 . . . . 0.0 108.994 179.016 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -65.61 -43.74 88.69 Favored 'General case' 0 N--CA 1.535 3.818 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 66.9 m-80 -88.28 -88.7 0.14 Allowed 'General case' 0 N--CA 1.513 2.704 0 N-CA-C 106.341 -1.726 . . . . 0.0 106.341 176.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.8 p30 152.9 48.46 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.039 0 C-N-CA 127.318 2.247 . . . . 0.0 108.418 177.276 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.439 HD22 ' CD2' ' B' ' 596' ' ' LEU . 6.6 mt -109.99 14.06 23.15 Favored 'General case' 0 N--CA 1.528 3.435 0 C-N-CA 124.493 1.117 . . . . 0.0 110.456 -178.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.555 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 30.2 p-80 -81.43 3.65 23.81 Favored 'General case' 0 N--CA 1.518 2.939 0 C-N-CA 123.381 0.672 . . . . 0.0 109.352 175.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.766 ' HA ' HD23 ' A' ' 39' ' ' LEU . 22.9 mt -94.03 -51.46 0.26 Allowed Pre-proline 0 N--CA 1.507 2.382 0 CA-C-O 116.857 -1.544 . . . . 0.0 108.565 -175.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.457 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 8.2 Cg_exo -61.63 -32.61 87.36 Favored 'Trans proline' 0 C--N 1.397 3.101 0 N-CA-C 106.257 -2.247 . . . . 0.0 106.257 169.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.7 tt -60.25 -46.34 90.14 Favored 'General case' 0 N--CA 1.529 3.518 0 C-N-CA 124.598 1.159 . . . . 0.0 109.05 174.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.766 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.0 OUTLIER -74.35 -12.26 60.48 Favored 'General case' 0 N--CA 1.533 3.7 0 CA-C-O 118.526 -0.749 . . . . 0.0 111.199 179.664 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -87.84 -19.18 27.79 Favored 'General case' 0 N--CA 1.514 2.75 0 CA-C-O 117.282 -1.342 . . . . 0.0 111.273 178.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -113.93 -23.7 9.46 Favored 'General case' 0 N--CA 1.534 3.729 0 CA-C-N 120.591 1.541 . . . . 0.0 114.038 -178.301 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 23.6 ptp -129.23 27.76 5.32 Favored 'General case' 1 N--CA 1.546 4.33 0 CA-C-N 120.6 1.545 . . . . 0.0 111.46 178.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.461 HD22 ' HB2' ' A' ' 39' ' ' LEU . 0.7 OUTLIER -135.16 -68.25 0.53 Allowed 'General case' 0 N--CA 1.515 2.795 0 CA-C-O 117.922 -1.037 . . . . 0.0 109.233 177.923 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 25.5 p 121.47 160.59 0.0 OUTLIER Pre-proline 1 N--CA 1.571 5.624 0 C-N-CA 128.003 2.521 . . . . 0.0 109.8 -179.232 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -68.14 -28.62 34.21 Favored 'Trans proline' 0 C--N 1.394 2.942 0 C-N-CA 122.3 2.0 . . . . 0.0 109.297 175.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -66.95 -19.05 65.65 Favored 'General case' 0 N--CA 1.532 3.636 0 CA-C-O 118.407 -0.806 . . . . 0.0 110.462 176.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.448 ' HB3' HD23 ' A' ' 43' ' ' LEU . 7.7 mm-40 -75.7 -29.67 59.05 Favored 'General case' 0 N--CA 1.525 3.281 0 CA-C-O 117.853 -1.07 . . . . 0.0 109.656 178.364 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 12.7 ptt180 -91.35 -14.32 30.93 Favored 'General case' 0 N--CA 1.535 3.806 0 CA-C-N 119.39 0.996 . . . . 0.0 108.535 173.33 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -79.8 -22.81 42.64 Favored 'General case' 0 N--CA 1.518 2.953 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 173.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -93.96 -36.04 12.36 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 123.854 0.862 . . . . 0.0 109.156 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.495 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 18.1 tp -75.05 -25.5 58.71 Favored 'General case' 0 N--CA 1.533 3.699 0 N-CA-C 106.684 -1.598 . . . . 0.0 106.684 174.181 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.452 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -69.8 -70.91 1.08 Allowed Glycine 0 N--CA 1.503 3.164 0 C-N-CA 125.39 1.471 . . . . 0.0 111.492 177.615 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.5 m -71.83 -27.13 62.7 Favored 'General case' 0 N--CA 1.532 3.635 0 CA-C-O 118.008 -0.996 . . . . 0.0 113.009 -176.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 39.6 mtt180 -74.31 -45.46 47.27 Favored 'General case' 0 N--CA 1.524 3.251 0 CA-C-N 120.12 1.327 . . . . 0.0 108.195 178.118 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 30.9 t -64.89 -18.12 23.03 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.002 0 O-C-N 120.636 -1.29 . . . . 0.0 109.164 174.457 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.31 -50.73 20.55 Favored 'General case' 0 N--CA 1.531 3.602 0 CA-C-N 119.734 1.152 . . . . 0.0 111.571 177.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.462 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -70.75 -22.57 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.823 0 CA-C-N 120.779 1.627 . . . . 0.0 111.826 -178.55 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -87.54 -51.49 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.986 0 CA-C-N 120.257 1.389 . . . . 0.0 107.688 -179.014 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -61.13 -22.03 64.3 Favored 'General case' 0 N--CA 1.531 3.594 0 CA-C-O 118.782 -0.627 . . . . 0.0 110.576 177.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -95.27 -24.05 16.95 Favored 'General case' 0 N--CA 1.52 3.046 0 CA-C-O 118.089 -0.958 . . . . 0.0 110.8 178.008 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.3 tp -77.01 -57.29 3.93 Favored 'General case' 0 N--CA 1.535 3.787 0 CA-C-N 119.662 1.119 . . . . 0.0 108.484 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 42.5 mt -45.97 -29.82 1.58 Allowed 'General case' 1 N--CA 1.544 4.262 0 C-N-CA 124.775 1.23 . . . . 0.0 112.858 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.89 -53.23 5.23 Favored 'General case' 0 N--CA 1.519 3.02 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.11 80.29 0.82 Allowed Glycine 0 N--CA 1.512 3.704 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 179.134 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -138.41 -59.4 0.63 Allowed 'General case' 0 N--CA 1.526 3.327 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 87.7 mtp -149.51 76.13 1.3 Allowed 'General case' 0 N--CA 1.525 3.304 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.491 ' HA ' HD22 ' A' ' 71' ' ' LEU . 5.6 t -142.02 3.64 1.61 Allowed 'General case' 0 N--CA 1.524 3.271 0 N-CA-C 114.245 1.202 . . . . 0.0 114.245 -176.141 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -116.21 -55.29 2.41 Favored 'General case' 0 N--CA 1.526 3.333 0 CA-C-N 120.018 1.281 . . . . 0.0 112.124 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -110.63 -57.23 2.25 Favored 'General case' 0 N--CA 1.527 3.424 0 C-N-CA 123.198 0.599 . . . . 0.0 111.233 -176.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -74.11 -4.85 38.16 Favored 'General case' 0 N--CA 1.518 2.968 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.638 HD23 HG21 ' A' ' 82' ' ' ILE . 60.8 tp -76.71 -48.32 19.19 Favored 'General case' 0 N--CA 1.525 3.293 0 CA-C-N 119.91 1.232 . . . . 0.0 111.446 -178.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -35.65 -40.48 0.17 Allowed 'General case' 1 N--CA 1.541 4.102 0 N-CA-C 115.514 1.672 . . . . 0.0 115.514 -175.903 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -78.03 -40.31 39.24 Favored 'General case' 0 N--CA 1.529 3.524 0 CA-C-N 118.126 0.421 . . . . 0.0 110.811 -178.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -51.97 -35.19 45.44 Favored 'General case' 0 N--CA 1.531 3.576 0 C-N-CA 124.174 0.99 . . . . 0.0 113.149 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.3 pp -132.98 -44.94 0.86 Allowed 'General case' 0 N--CA 1.533 3.712 0 CA-C-N 118.76 0.709 . . . . 0.0 111.588 -179.192 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 104.93 73.96 0.93 Allowed Glycine 1 N--CA 1.528 4.803 0 CA-C-N 118.975 0.807 . . . . 0.0 112.099 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.08 -12.01 6.41 Favored 'General case' 0 N--CA 1.531 3.621 0 CA-C-N 117.886 0.843 . . . . 0.0 112.831 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 86.59 167.12 43.29 Favored Glycine 1 N--CA 1.532 5.09 0 CA-C-N 119.634 1.106 . . . . 0.0 111.128 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.548 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.5 OUTLIER -87.05 -20.81 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.337 0 CA-C-N 119.483 1.641 . . . . 0.0 109.107 179.069 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.769 ' HB2' ' H62' ' E' ' 15' ' ' ' DA' . . . -67.05 -30.87 71.06 Favored 'General case' 0 N--CA 1.525 3.317 0 CA-C-N 120.145 1.338 . . . . 0.0 111.995 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.5 p -83.53 -43.17 16.03 Favored 'General case' 1 N--CA 1.55 4.534 0 CA-C-N 120.249 1.386 . . . . 0.0 111.16 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.638 HG21 HD23 ' A' ' 71' ' ' LEU . 14.9 pt -70.8 -18.56 20.99 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.031 0 CA-C-O 117.958 -1.02 . . . . 0.0 112.98 -177.655 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 59.1 p -109.68 -31.91 7.29 Favored 'General case' 0 N--CA 1.516 2.871 0 CA-C-N 119.656 1.116 . . . . 0.0 110.688 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.2 ptt180 -73.22 -25.55 60.79 Favored 'General case' 0 N--CA 1.535 3.821 0 CA-C-N 119.475 1.034 . . . . 0.0 108.435 175.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -62.79 -31.35 79.97 Favored Glycine 1 N--CA 1.522 4.413 0 N-CA-C 108.991 -1.644 . . . . 0.0 108.991 175.155 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 18.3 m -63.1 -41.54 99.4 Favored 'General case' 0 N--CA 1.538 3.943 0 CA-C-N 118.004 0.902 . . . . 0.0 109.335 176.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -55.25 -28.01 50.41 Favored 'General case' 1 N--CA 1.547 4.423 0 C-N-CA 123.941 0.896 . . . . 0.0 111.942 178.797 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.434 ' HB3' ' HA ' ' B' ' 541' ' ' LEU . 39.4 m -65.81 -40.42 91.86 Favored 'General case' 0 N--CA 1.534 3.739 0 C-N-CA 123.193 0.597 . . . . 0.0 111.049 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.7 mt -58.92 -41.48 87.39 Favored 'General case' 0 N--CA 1.534 3.74 0 C-N-CA 124.291 1.036 . . . . 0.0 111.021 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.49 -21.02 65.18 Favored 'General case' 1 N--CA 1.54 4.025 0 CA-C-O 118.458 -0.782 . . . . 0.0 112.61 -179.636 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.59 -42.41 11.42 Favored 'General case' 0 N--CA 1.517 2.896 0 CA-C-N 118.915 0.78 . . . . 0.0 111.367 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.54 158.19 8.58 Favored Pre-proline 1 N--CA 1.542 4.165 0 CA-C-O 118.308 -0.853 . . . . 0.0 112.857 -179.616 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -84.66 170.2 10.33 Favored 'Trans proline' 0 C--N 1.377 2.048 0 C-N-CA 122.215 1.944 . . . . 0.0 110.401 178.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.462 ' HA ' ' HB3' ' A' ' 97' ' ' ARG . 2.9 t -90.83 -25.36 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.074 0 CA-C-O 117.912 -1.042 . . . . 0.0 111.543 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -61.91 -43.85 98.0 Favored 'General case' 0 N--CA 1.516 2.851 0 CA-C-N 119.966 1.257 . . . . 0.0 110.135 -179.055 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.5 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.3 mp -99.07 -16.09 18.78 Favored 'General case' 0 N--CA 1.511 2.588 0 C-N-CA 123.344 0.658 . . . . 0.0 111.704 178.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.462 ' HB3' ' HA ' ' A' ' 94' ' ' VAL . 0.2 OUTLIER -68.12 -26.25 65.71 Favored 'General case' 1 N--CA 1.541 4.084 0 N-CA-C 103.809 -2.663 . . . . 0.0 103.809 169.174 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -57.5 -40.1 77.92 Favored 'General case' 0 N--CA 1.516 2.874 0 C-N-CA 123.688 0.795 . . . . 0.0 109.519 174.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.635 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 57.2 t90 -63.93 -34.98 79.2 Favored 'General case' 0 N--CA 1.527 3.419 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 177.282 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.57 -38.73 60.52 Favored 'General case' 0 N--CA 1.536 3.835 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 176.227 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -67.61 -38.61 84.19 Favored 'General case' 1 N--CA 1.545 4.286 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 175.677 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 1.0 OUTLIER -59.31 -22.7 61.63 Favored 'General case' 1 N--CA 1.549 4.475 0 C-N-CA 123.633 0.773 . . . . 0.0 110.391 175.732 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.538 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.3 OUTLIER -122.58 5.25 5.64 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.259 0 C-N-CA 123.468 0.707 . . . . 0.0 112.682 -177.336 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.85 -55.89 2.34 Favored 'General case' 0 N--CA 1.516 2.863 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 175.726 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 5.4 tt -57.45 -47.99 80.35 Favored 'General case' 0 N--CA 1.534 3.762 0 C-N-CA 125.181 1.392 . . . . 0.0 110.802 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 41.6 tttm -91.71 -64.55 1.1 Allowed 'General case' 0 N--CA 1.524 3.27 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 51.0 m . . . . . 1 N--CA 1.54 4.058 0 C-N-CA 124.568 1.147 . . . . 0.0 111.461 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 . . . . . 0 N--CA 1.505 2.279 0 CA-C-O 119.509 -0.282 . . . . 0.0 110.285 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 53.3 p -156.17 123.35 2.71 Favored Pre-proline 0 N--CA 1.522 3.152 0 CA-C-O 117.05 -1.452 . . . . 0.0 110.364 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_endo -69.12 146.28 63.64 Favored 'Trans proline' 0 C--N 1.394 2.935 0 C-N-CA 122.513 2.142 . . . . 0.0 110.945 179.242 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -74.23 -64.57 0.99 Allowed 'General case' 0 N--CA 1.534 3.737 0 CA-C-O 119.091 -0.48 . . . . 0.0 110.496 -178.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 66.9 m -133.22 125.65 29.86 Favored 'General case' 0 N--CA 1.523 3.189 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -159.05 -48.43 0.06 Allowed 'General case' 0 N--CA 1.525 3.291 0 C-N-CA 122.444 0.298 . . . . 0.0 110.917 -178.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -75.21 142.62 43.42 Favored 'General case' 0 N--CA 1.526 3.358 0 O-C-N 123.296 0.373 . . . . 0.0 111.434 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 48.6 mmm 79.23 -71.64 0.09 Allowed 'General case' 0 N--CA 1.538 3.967 0 C-N-CA 125.563 1.545 . . . . 0.0 111.341 179.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -124.48 138.9 54.31 Favored 'General case' 0 N--CA 1.525 3.307 0 CA-C-N 118.882 0.765 . . . . 0.0 111.699 -178.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -104.32 -49.14 3.65 Favored 'General case' 0 N--CA 1.524 3.266 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -99.6 134.81 41.94 Favored 'General case' 0 N--CA 1.525 3.325 0 C-N-CA 123.286 0.635 . . . . 0.0 109.36 179.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 40.0 ttt180 -95.78 128.28 42.52 Favored 'General case' 0 N--CA 1.523 3.183 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 82.9 m-70 -97.95 120.98 39.31 Favored 'General case' 0 N--CA 1.523 3.205 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -115.12 -40.64 3.44 Favored 'General case' 0 N--CA 1.52 3.026 0 CA-C-O 118.353 -0.832 . . . . 0.0 112.66 -177.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -119.38 -82.37 0.64 Allowed 'General case' 0 N--CA 1.532 3.633 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -175.285 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 519' ' ' TRP . . . . . 0.678 ' CE2' HD22 ' A' ' 39' ' ' LEU . 76.2 t-105 -36.74 -29.32 0.02 OUTLIER 'General case' 1 N--CA 1.548 4.468 0 N-CA-C 116.131 1.9 . . . . 0.0 116.131 -174.72 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 520' ' ' LEU . . . . . 0.596 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.1 mm? -98.6 -31.0 12.17 Favored 'General case' 0 N--CA 1.537 3.915 0 CA-C-O 117.98 -1.009 . . . . 0.0 113.497 -172.543 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 -62.72 -25.59 68.26 Favored 'General case' 1 N--CA 1.544 4.231 0 N-CA-C 105.639 -1.986 . . . . 0.0 105.639 171.429 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 522' ' ' PHE . . . . . 0.537 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.9 m-85 -75.29 -43.19 52.49 Favored 'General case' 0 N--CA 1.511 2.618 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 173.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 523' ' ' VAL . . . . . 0.436 HG23 ' O ' ' B' ' 519' ' ' TRP . 74.4 t -63.6 -18.56 22.37 Favored 'Isoleucine or valine' 1 N--CA 1.563 5.224 0 CA-C-O 117.999 -1.0 . . . . 0.0 111.334 177.518 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -74.66 -52.7 10.96 Favored 'General case' 0 N--CA 1.531 3.621 0 CA-C-N 119.996 1.271 . . . . 0.0 107.82 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 4.8 mp -63.33 -26.18 68.64 Favored 'General case' 0 N--CA 1.537 3.893 0 CA-C-O 119.134 -0.46 . . . . 0.0 110.165 175.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 526' ' ' LEU . . . . . 0.51 HD23 ' O ' ' B' ' 522' ' ' PHE . 3.1 mm? -67.52 -39.34 85.11 Favored 'General case' 0 N--CA 1.519 2.991 0 CA-C-O 118.206 -0.902 . . . . 0.0 108.602 178.068 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 527' ' ' LYS . . . . . 0.436 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 13.7 mttt -69.17 -19.8 64.0 Favored 'General case' 0 N--CA 1.525 3.31 0 CA-C-O 118.078 -0.963 . . . . 0.0 111.262 177.661 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -75.25 -37.35 61.06 Favored 'General case' 0 N--CA 1.529 3.524 0 CA-C-N 119.629 1.104 . . . . 0.0 109.056 176.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 529' ' ' ALA . . . . . 0.635 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -92.81 -8.63 43.06 Favored 'General case' 0 N--CA 1.504 2.238 0 CA-C-O 118.537 -0.744 . . . . 0.0 110.475 178.248 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 530' ' ' TYR . . . . . 0.436 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.5 OUTLIER -81.53 -29.1 33.64 Favored 'General case' 0 N--CA 1.532 3.673 0 CA-C-N 119.953 1.252 . . . . 0.0 109.272 179.841 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -68.69 -43.35 76.26 Favored 'General case' 0 N--CA 1.531 3.613 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 176.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 41.5 m-80 -90.54 -91.85 0.14 Allowed 'General case' 0 N--CA 1.516 2.853 0 N-CA-C 106.625 -1.62 . . . . 0.0 106.625 176.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 3.0 p30 155.1 54.47 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.868 0 C-N-CA 127.474 2.31 . . . . 0.0 107.397 177.25 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 534' ' ' LEU . . . . . 0.5 HD22 ' CD2' ' A' ' 96' ' ' LEU . 7.4 mt -114.64 11.6 16.99 Favored 'General case' 0 N--CA 1.53 3.531 0 C-N-CA 124.029 0.932 . . . . 0.0 111.197 -177.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 535' ' ' HIS . . . . . 0.585 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 42.2 p-80 -81.15 0.27 37.07 Favored 'General case' 0 N--CA 1.515 2.805 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 175.142 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 536' ' ' LEU . . . . . 0.443 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 35.4 mt -93.92 -51.52 0.26 Allowed Pre-proline 0 N--CA 1.506 2.37 0 CA-C-O 116.381 -1.771 . . . . 0.0 109.175 -176.166 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 537' ' ' PRO . . . . . 0.443 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 2.7 Cg_exo -64.28 -33.93 57.59 Favored 'Trans proline' 0 C--N 1.395 3.009 0 N-CA-C 107.104 -1.922 . . . . 0.0 107.104 171.227 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 538' ' ' LEU . . . . . 0.411 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 1.2 tm? -61.94 -41.99 98.59 Favored 'General case' 0 N--CA 1.529 3.487 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 175.24 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 13.7 mt -70.86 -22.43 62.3 Favored 'General case' 0 N--CA 1.537 3.909 0 CA-C-O 118.419 -0.8 . . . . 0.0 111.084 177.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -76.29 -8.52 57.26 Favored 'General case' 0 N--CA 1.526 3.375 0 CA-C-N 118.934 0.788 . . . . 0.0 110.228 176.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 541' ' ' LEU . . . . . 0.612 HD13 ' N ' ' B' ' 542' ' ' MET . 0.0 OUTLIER -106.12 -46.85 3.97 Favored 'General case' 0 N--CA 1.511 2.595 0 C-N-CA 124.247 1.019 . . . . 0.0 110.238 -178.512 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 542' ' ' MET . . . . . 0.612 ' N ' HD13 ' B' ' 541' ' ' LEU . 8.2 ptt? -94.41 -21.7 18.77 Favored 'General case' 0 N--CA 1.536 3.854 0 CA-C-O 116.85 -1.548 . . . . 0.0 114.966 -175.756 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 543' ' ' LEU . . . . . 0.644 ' O ' HG23 ' B' ' 544' ' ' THR . 3.1 mp -119.09 -106.97 0.38 Allowed 'General case' 0 N--CA 1.534 3.752 0 CA-C-N 121.464 1.938 . . . . 0.0 113.539 -176.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 544' ' ' THR . . . . . 0.644 HG23 ' O ' ' B' ' 543' ' ' LEU . 7.6 p 179.13 165.78 0.69 Allowed Pre-proline 1 N--CA 1.56 5.05 0 CA-C-N 121.381 1.901 . . . . 0.0 110.788 -176.838 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -69.37 -33.98 16.88 Favored 'Trans proline' 0 CA--C 1.574 2.512 0 C-N-CA 122.427 2.085 . . . . 0.0 109.031 172.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -59.94 -18.86 48.36 Favored 'General case' 0 N--CA 1.533 3.718 0 CA-C-O 118.078 -0.963 . . . . 0.0 111.633 177.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -76.74 -44.86 31.47 Favored 'General case' 0 N--CA 1.525 3.315 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 177.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 548' ' ' ARG . . . . . 0.523 ' HA ' HD12 ' B' ' 551' ' ' LEU . 31.0 ptt180 -81.4 -1.85 47.19 Favored 'General case' 0 N--CA 1.533 3.707 0 CA-C-N 118.627 0.649 . . . . 0.0 110.95 176.21 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -84.53 -47.53 10.5 Favored 'General case' 0 N--CA 1.524 3.275 0 N-CA-C 105.07 -2.196 . . . . 0.0 105.07 174.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -75.63 -17.14 60.1 Favored 'General case' 0 N--CA 1.509 2.499 0 CA-C-O 117.414 -1.279 . . . . 0.0 111.448 177.495 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 551' ' ' LEU . . . . . 0.711 HD11 ' N ' ' A' ' 19' ' ' TRP . 0.0 OUTLIER -74.91 -39.71 61.28 Favored 'General case' 0 N--CA 1.53 3.557 0 N-CA-C 106.35 -1.722 . . . . 0.0 106.35 175.139 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 552' ' ' GLY . . . . . 0.683 ' N ' HD13 ' B' ' 551' ' ' LEU . . . -62.79 -58.71 10.99 Favored Glycine 0 N--CA 1.495 2.577 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 -177.33 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 553' ' ' THR . . . . . 0.537 ' O ' HG23 ' B' ' 557' ' ' ILE . 2.8 m -71.73 -34.59 69.69 Favored 'General case' 0 N--CA 1.537 3.904 0 CA-C-O 118.168 -0.92 . . . . 0.0 112.604 -178.031 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -68.25 -58.15 4.87 Favored 'General case' 1 N--CA 1.541 4.082 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 178.344 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 47.8 t -58.09 -18.9 11.77 Favored 'Isoleucine or valine' 1 N--CA 1.549 4.48 0 CA-C-O 117.621 -1.18 . . . . 0.0 110.264 175.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 13.6 mtt-85 -84.88 -32.74 23.02 Favored 'General case' 0 N--CA 1.52 3.062 0 CA-C-O 117.077 -1.439 . . . . 0.0 111.729 178.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 557' ' ' ILE . . . . . 0.537 HG23 ' O ' ' B' ' 553' ' ' THR . 0.0 OUTLIER -77.2 -20.92 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.182 0 CA-C-N 122.049 2.204 . . . . 0.0 109.728 177.722 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 558' ' ' VAL . . . . . 0.476 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.0 OUTLIER -89.44 -50.33 13.26 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.911 0 N-CA-C 106.954 -1.499 . . . . 0.0 106.954 -179.205 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -60.69 -24.78 65.89 Favored 'General case' 0 N--CA 1.531 3.607 0 CA-C-O 119.004 -0.522 . . . . 0.0 109.822 177.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -96.97 -23.74 16.15 Favored 'General case' 0 N--CA 1.522 3.13 0 CA-C-O 117.831 -1.08 . . . . 0.0 111.306 178.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 27.6 tp -75.75 -51.92 11.6 Favored 'General case' 1 N--CA 1.542 4.129 0 CA-C-N 120.108 1.322 . . . . 0.0 108.306 179.63 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 40.5 mt -48.24 -27.55 2.53 Favored 'General case' 1 N--CA 1.543 4.195 0 C-N-CA 124.375 1.07 . . . . 0.0 112.3 179.389 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.69 -51.03 13.65 Favored 'General case' 0 N--CA 1.53 3.54 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 178.348 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 62.78 54.91 30.15 Favored Glycine 1 N--CA 1.521 4.324 0 C-N-CA 123.975 0.797 . . . . 0.0 114.228 175.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -115.73 -56.15 2.36 Favored 'General case' 0 N--CA 1.517 2.877 0 N-CA-C 106.657 -1.608 . . . . 0.0 106.657 177.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 52.1 ttp -139.64 76.06 1.54 Allowed 'General case' 0 N--CA 1.524 3.225 0 N-CA-C 104.271 -2.492 . . . . 0.0 104.271 177.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 567' ' ' SER . . . . . 0.446 ' HA ' ' HB2' ' B' ' 571' ' ' LEU . 29.6 m -135.53 -3.28 2.38 Favored 'General case' 0 N--CA 1.522 3.173 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -173.534 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -98.03 -84.66 0.38 Allowed 'General case' 0 N--CA 1.52 3.029 0 CA-C-N 119.809 1.186 . . . . 0.0 110.654 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 3.9 mtt-85 -75.67 -55.91 5.2 Favored 'General case' 0 N--CA 1.527 3.386 0 CA-C-N 119.857 1.208 . . . . 0.0 111.851 -178.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -70.98 -2.4 15.17 Favored 'General case' 0 N--CA 1.523 3.21 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -174.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 571' ' ' LEU . . . . . 0.814 HD23 HD11 ' B' ' 582' ' ' ILE . 34.0 tp -85.41 -47.23 10.17 Favored 'General case' 0 N--CA 1.533 3.699 0 CA-C-N 120.664 1.575 . . . . 0.0 111.773 -178.36 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.79 -35.88 0.55 Allowed 'General case' 1 N--CA 1.557 4.888 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -179.444 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -71.49 -39.16 71.03 Favored 'General case' 0 N--CA 1.536 3.874 0 CA-C-N 118.806 0.73 . . . . 0.0 111.02 -178.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -53.91 -59.99 3.91 Favored 'General case' 0 N--CA 1.53 3.531 0 C-N-CA 123.976 0.911 . . . . 0.0 111.743 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 5.5 mp -93.81 -64.64 1.06 Allowed 'General case' 0 N--CA 1.519 3.018 0 C-N-CA 123.224 0.61 . . . . 0.0 110.012 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 124.78 46.54 0.24 Allowed Glycine 1 N--CA 1.518 4.158 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -178.632 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -119.32 115.73 24.76 Favored 'General case' 0 N--CA 1.517 2.876 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -39.45 171.48 0.01 OUTLIER Glycine 1 N--CA 1.541 5.674 0 C-N-CA 125.493 1.52 . . . . 0.0 116.168 -177.514 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 579' ' ' ILE . . . . . 0.665 HD13 ' CG2' ' B' ' 582' ' ' ILE . 0.6 OUTLIER -80.24 -16.37 12.8 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.386 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.504 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 580' ' ' ALA . . . . . 0.969 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -68.85 -39.45 79.9 Favored 'General case' 0 N--CA 1.527 3.379 0 CA-C-N 119.502 1.046 . . . . 0.0 109.967 176.616 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.5 p -77.76 -38.79 46.11 Favored 'General case' 0 N--CA 1.535 3.776 0 CA-C-N 118.888 0.767 . . . . 0.0 111.502 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 582' ' ' ILE . . . . . 0.814 HD11 HD23 ' B' ' 571' ' ' LEU . 2.1 tt -67.27 -35.34 73.63 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.185 0 CA-C-O 118.849 -0.596 . . . . 0.0 112.411 -175.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 82.0 p -102.27 -25.1 13.8 Favored 'General case' 0 N--CA 1.515 2.78 0 CA-C-O 117.904 -1.046 . . . . 0.0 111.573 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -73.12 -24.86 60.66 Favored 'General case' 0 N--CA 1.538 3.953 0 CA-C-N 119.981 1.264 . . . . 0.0 108.544 174.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -62.71 -36.1 92.82 Favored Glycine 1 N--CA 1.521 4.35 0 N-CA-C 107.325 -2.31 . . . . 0.0 107.325 173.504 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 1.7 m -60.65 -39.74 89.41 Favored 'General case' 1 N--CA 1.541 4.106 0 C-N-CA 123.94 0.896 . . . . 0.0 110.32 176.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -59.7 -32.65 70.71 Favored 'General case' 1 N--CA 1.548 4.445 0 C-N-CA 123.539 0.736 . . . . 0.0 111.683 -179.702 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 4.8 m -65.29 -37.62 87.73 Favored 'General case' 0 N--CA 1.535 3.817 0 C-N-CA 123.039 0.536 . . . . 0.0 110.867 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 29.8 mt -58.31 -45.23 88.4 Favored 'General case' 0 N--CA 1.529 3.52 0 C-N-CA 124.094 0.958 . . . . 0.0 111.519 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -14.82 63.27 Favored 'General case' 0 N--CA 1.538 3.934 0 CA-C-O 118.04 -0.981 . . . . 0.0 112.926 -178.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -88.52 -43.55 11.33 Favored 'General case' 0 N--CA 1.521 3.11 0 CA-C-N 119.534 1.061 . . . . 0.0 110.849 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -57.12 163.83 2.85 Favored Pre-proline 1 N--CA 1.542 4.161 0 C-N-CA 123.647 0.779 . . . . 0.0 112.934 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 593' ' ' PRO . . . . . 0.43 ' O ' ' HB2' ' B' ' 597' ' ' ARG . 45.5 Cg_endo -80.51 173.32 12.45 Favored 'Trans proline' 0 C--N 1.381 2.26 0 C-N-CA 121.777 1.651 . . . . 0.0 110.54 178.671 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -94.73 -25.89 4.53 Favored 'Isoleucine or valine' 0 N--CA 1.522 3.173 0 CA-C-O 117.875 -1.059 . . . . 0.0 111.579 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -62.83 -41.16 99.22 Favored 'General case' 0 N--CA 1.517 2.893 0 CA-C-N 120.02 1.282 . . . . 0.0 110.246 -179.194 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 596' ' ' LEU . . . . . 0.439 ' CD2' HD22 ' A' ' 34' ' ' LEU . 7.0 mp -98.45 -15.37 19.65 Favored 'General case' 0 N--CA 1.512 2.639 0 CA-C-O 118.687 -0.673 . . . . 0.0 111.878 178.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 597' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' B' ' 593' ' ' PRO . 0.0 OUTLIER -65.18 -34.37 78.22 Favored 'General case' 1 N--CA 1.544 4.231 0 N-CA-C 103.338 -2.838 . . . . 0.0 103.338 168.632 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -52.76 -40.47 63.16 Favored 'General case' 0 N--CA 1.516 2.872 0 C-N-CA 124.328 1.051 . . . . 0.0 111.001 174.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 599' ' ' TRP . . . . . 0.504 ' O ' HG22 ' B' ' 603' ' ' VAL . 52.3 t90 -64.68 -37.38 87.38 Favored 'General case' 0 N--CA 1.532 3.64 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 177.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -51.71 -36.86 48.45 Favored 'General case' 1 N--CA 1.541 4.106 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 176.554 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -70.51 -39.55 74.03 Favored 'General case' 0 N--CA 1.537 3.88 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 175.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 602' ' ' GLU . . . . . 0.426 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.9 OUTLIER -57.43 -24.35 55.08 Favored 'General case' 1 N--CA 1.546 4.372 0 C-N-CA 124.045 0.938 . . . . 0.0 111.505 176.41 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' B' B ' 603' ' ' VAL . . . . . 0.504 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.0 OUTLIER -107.22 -6.3 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.358 0 CA-C-O 117.862 -1.066 . . . . 0.0 113.526 -175.322 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 6.7 mp -104.88 -61.12 1.51 Allowed 'General case' 0 N--CA 1.525 3.307 0 N-CA-C 106.314 -1.736 . . . . 0.0 106.314 174.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 5.4 tp -45.36 -32.71 2.18 Favored 'General case' 0 N--CA 1.535 3.81 0 C-N-CA 125.507 1.523 . . . . 0.0 113.55 -179.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt 66.69 96.72 0.06 Allowed 'General case' 0 N--CA 1.529 3.525 0 C-N-CA 124.428 1.091 . . . . 0.0 109.904 -179.194 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 6.3 t . . . . . 0 N--CA 1.523 3.179 0 CA-C-O 118.548 -0.739 . . . . 0.0 109.855 -179.53 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 898' ' ' TRP . . . . . 0.512 ' HB2' HG23 ' B' ' 544' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.082 0 CA-C-O 118.355 -0.831 . . . . 0.0 108.832 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.504 2.272 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.42 -9.813 3 O4'-C1'-N19 119.323 14.404 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.412 -10.592 4 O4'-C1'-N19 120.299 15.623 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.202 4 O4'-C1'-N19 119.119 14.149 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . 0.528 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 6 C3'--C2' 1.417 -10.098 5 O4'-C1'-N19 120.116 15.395 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' E' E ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.791 5 O4'-C1'-N19 118.578 13.472 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.404 -11.365 3 O4'-C1'-N19 118.351 13.189 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' E' E ' 7' ' ' ' DA' . . . . . 0.719 H2'' " H5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.398 -11.963 4 C4'-C3'-C2' 112.378 9.178 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' E' E ' 8' ' ' ' DG' . . . . . 0.719 " H5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.417 -10.095 4 O4'-C1'-N19 119.643 14.804 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.578 11.288 4 O4'-C1'-N19 119.041 14.052 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.402 -11.553 4 O4'-C1'-N19 119.324 14.406 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.406 -11.229 5 O4'-C1'-N19 121.157 16.696 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.446 4 O4'-C1'-N19 120.581 15.977 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 4 O3'--C3' 1.555 9.562 5 O4'-C1'-N19 123.677 19.846 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' E' E ' 14' ' ' ' DT' . . . . . 0.521 ' C7 ' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.415 -10.278 4 O4'-C1'-N19 119.371 14.464 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' E' E ' 15' ' ' ' DA' . . . . . 0.665 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.416 -10.244 6 O4'-C1'-N19 119.101 14.127 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.415 -10.326 5 O4'-C1'-N19 119.889 15.111 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.464 5 O4'-C1'-N19 119.265 14.331 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.696 3 O4'-C1'-N19 120.27 15.588 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.376 5 O4'-C1'-N19 119.71 14.887 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.598 6.967 4 O4'-C1'-N19 119.223 14.279 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.499 4 C4'-C3'-C2' 116.874 13.674 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.405 -11.259 3 O4'-C1'-N19 119.618 14.772 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.312 5 O4'-C1'-N19 119.901 15.126 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' F' F ' 4' ' ' ' DA' . . . . . 0.611 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 5 C3'--C2' 1.429 -8.933 4 O4'-C1'-N19 119.362 14.452 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' F' F ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.569 10.625 3 O4'-C1'-N19 118.344 13.181 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.832 4 O4'-C1'-N19 119.362 14.452 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.415 -11.277 4 C4'-C3'-C2' 112.584 9.384 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.409 -10.864 4 O4'-C1'-N19 119.46 14.575 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.412 -10.615 3 C4'-C3'-C2' 117.343 14.143 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.81 3 O4'-C1'-N19 119.664 14.829 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.668 4 O4'-C1'-N19 120.747 16.184 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.6 2 O4'-C1'-N19 119.118 14.148 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.445 4 O4'-C1'-N19 119.286 14.358 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' F' F ' 14' ' ' ' DT' . . . . . 0.895 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.416 -10.221 3 C4'-C3'-C2' 116.879 13.679 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' F' F ' 15' ' ' ' DA' . . . . . 0.962 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.415 -10.333 6 O4'-C1'-N19 119.537 14.671 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.418 -9.989 5 O4'-C1'-N19 119.017 14.021 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.627 3 O4'-C1'-N19 118.952 13.939 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.433 4 O4'-C1'-N19 120.363 15.704 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.515 5 O4'-C1'-N19 120.042 15.302 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.515 7.296 3 O4'-C1'-N19 120.02 15.276 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 . . . . . 0 N--CA 1.502 2.138 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 25.4 m -146.39 129.99 8.35 Favored Pre-proline 0 N--CA 1.522 3.16 0 CA-C-O 117.49 -1.243 . . . . 0.0 110.062 -179.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -74.53 143.08 30.31 Favored 'Trans proline' 0 C--N 1.387 2.556 0 C-N-CA 122.565 2.177 . . . . 0.0 111.927 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -131.28 115.93 16.95 Favored 'General case' 0 N--CA 1.521 3.12 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 177.356 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.8 p -91.92 131.26 37.37 Favored 'General case' 0 N--CA 1.528 3.457 0 C-N-CA 122.694 0.398 . . . . 0.0 110.663 -178.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -115.54 121.41 42.56 Favored 'General case' 0 N--CA 1.516 2.857 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -154.65 133.49 12.22 Favored 'General case' 0 N--CA 1.521 3.121 0 C-N-CA 122.457 0.303 . . . . 0.0 110.875 -178.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 4.5 mpp? -125.63 125.82 43.73 Favored 'General case' 0 N--CA 1.516 2.847 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -121.52 121.18 36.91 Favored 'General case' 0 N--CA 1.518 2.972 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 179.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -162.28 147.71 12.77 Favored 'General case' 0 N--CA 1.53 3.568 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -178.367 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -81.79 132.82 35.29 Favored 'General case' 0 N--CA 1.523 3.209 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 -94.44 132.85 38.66 Favored 'General case' 0 N--CA 1.524 3.225 0 C-N-CA 122.939 0.495 . . . . 0.0 110.842 -178.498 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.0 t-80 -116.57 115.23 25.35 Favored 'General case' 0 N--CA 1.519 3.024 0 N-CA-C 105.484 -2.043 . . . . 0.0 105.484 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -84.67 119.72 25.57 Favored 'General case' 0 N--CA 1.52 3.026 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -176.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.542 ' O ' HD21 ' B' ' 551' ' ' LEU . 47.1 mt-10 -149.24 -70.27 0.2 Allowed 'General case' 0 N--CA 1.523 3.181 0 N-CA-C 105.441 -2.059 . . . . 0.0 105.441 177.38 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.768 ' O ' HG23 ' A' ' 23' ' ' VAL . 75.1 t-105 -59.99 -20.09 55.82 Favored 'General case' 0 N--CA 1.537 3.909 0 CA-C-O 117.824 -1.084 . . . . 0.0 110.973 174.414 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.546 ' N ' HD22 ' A' ' 20' ' ' LEU . 1.8 mm? -92.25 -31.42 15.42 Favored 'General case' 0 N--CA 1.52 3.039 0 C-N-CA 124.114 0.966 . . . . 0.0 110.765 -177.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.7 mtt180 -60.83 -27.48 68.11 Favored 'General case' 0 N--CA 1.534 3.743 0 N-CA-C 106.395 -1.706 . . . . 0.0 106.395 172.073 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.513 ' HB2' HD23 ' B' ' 551' ' ' LEU . 20.9 t80 -88.53 -31.55 18.63 Favored 'General case' 0 CA--C 1.595 2.695 0 CA-C-O 116.645 -1.645 . . . . 0.0 109.332 175.088 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.768 HG23 ' O ' ' A' ' 19' ' ' TRP . 93.3 t -74.54 -62.38 1.34 Allowed 'Isoleucine or valine' 1 N--CA 1.565 5.285 0 CA-C-N 122.215 2.28 . . . . 0.0 110.425 -178.597 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -52.91 -36.18 59.16 Favored 'General case' 1 N--CA 1.548 4.452 0 CA-C-N 119.106 0.866 . . . . 0.0 111.62 -178.156 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.94 -35.32 66.96 Favored 'General case' 0 N--CA 1.533 3.699 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 177.358 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.03 -40.84 95.12 Favored 'General case' 0 N--CA 1.529 3.477 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 176.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.439 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 22.3 tttt -56.47 -30.46 62.96 Favored 'General case' 0 N--CA 1.531 3.609 0 C-N-CA 123.216 0.606 . . . . 0.0 111.743 179.101 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -71.67 -42.33 67.63 Favored 'General case' 0 N--CA 1.529 3.511 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.097 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.603 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -87.81 3.35 48.57 Favored 'General case' 0 N--CA 1.517 2.889 0 O-C-N 123.176 0.297 . . . . 0.0 110.295 177.235 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.439 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -87.54 -45.65 10.27 Favored 'General case' 0 N--CA 1.524 3.236 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 -179.917 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -58.21 -39.72 79.74 Favored 'General case' 1 N--CA 1.541 4.088 0 C-N-CA 123.292 0.637 . . . . 0.0 109.3 178.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 65.5 m-80 -92.63 -83.21 0.31 Allowed 'General case' 0 N--CA 1.512 2.669 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 177.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 p30 145.51 44.16 0.0 OUTLIER 'General case' 1 N--CA 1.562 5.157 0 C-N-CA 128.444 2.698 . . . . 0.0 107.879 178.673 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.43 HD22 ' CD2' ' B' ' 596' ' ' LEU . 13.3 mt -98.22 12.02 35.96 Favored 'General case' 0 N--CA 1.53 3.541 0 O-C-N 121.368 -0.832 . . . . 0.0 110.693 -179.591 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.555 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -89.86 16.39 8.21 Favored 'General case' 0 N--CA 1.515 2.799 0 C-N-CA 123.984 0.913 . . . . 0.0 109.071 174.894 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.503 HD21 HD11 ' B' ' 520' ' ' LEU . 23.6 mt -98.96 -51.93 0.2 Allowed Pre-proline 0 N--CA 1.503 2.198 0 C-N-CA 125.335 1.454 . . . . 0.0 107.581 -178.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.484 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 6.1 Cg_exo -70.03 -33.43 15.57 Favored 'Trans proline' 0 C--N 1.393 2.869 0 N-CA-C 107.098 -1.924 . . . . 0.0 107.098 170.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.5 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.1 OUTLIER -65.79 -42.08 91.2 Favored 'General case' 0 N--CA 1.517 2.903 0 CA-C-O 117.93 -1.033 . . . . 0.0 108.495 177.357 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.518 HD22 ' CE2' ' B' ' 519' ' ' TRP 0.268 0.1 OUTLIER -77.42 -11.08 59.8 Favored 'General case' 1 N--CA 1.552 4.649 0 CA-C-N 120.316 1.416 . . . . 0.0 110.934 176.628 . . . . . . . . 5 4 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -91.59 9.77 30.79 Favored 'General case' 0 N--CA 1.524 3.228 0 CA-C-N 119.057 0.844 . . . . 0.0 110.038 176.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.647 HD13 ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -125.57 -50.08 1.63 Allowed 'General case' 0 N--CA 1.522 3.166 0 CA-C-N 119.407 1.003 . . . . 0.0 109.686 -178.872 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.647 ' N ' HD13 ' A' ' 41' ' ' LEU . 7.9 ptp -93.95 -14.0 26.44 Favored 'General case' 1 N--CA 1.543 4.222 0 CA-C-O 118.273 -0.87 . . . . 0.0 113.298 -177.661 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.464 ' O ' HG23 ' A' ' 44' ' ' THR . 3.6 mp -110.88 -83.38 0.57 Allowed 'General case' 0 N--CA 1.502 2.167 0 CA-C-O 117.934 -1.031 . . . . 0.0 110.911 -177.25 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.76 HG23 ' HB2' ' B' ' 998' ' ' TRP . 0.9 OUTLIER 150.52 166.09 0.0 OUTLIER Pre-proline 1 N--CA 1.564 5.233 0 C-N-CA 126.144 1.778 . . . . 0.0 109.1 -178.445 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -68.86 -33.86 19.35 Favored 'Trans proline' 0 CA--C 1.574 2.515 0 C-N-CA 122.304 2.003 . . . . 0.0 108.399 173.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -62.66 -19.69 64.08 Favored 'General case' 0 N--CA 1.529 3.476 0 CA-C-O 118.058 -0.972 . . . . 0.0 111.15 177.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -73.2 -32.6 64.9 Favored 'General case' 0 N--CA 1.523 3.203 0 CA-C-O 117.684 -1.15 . . . . 0.0 109.969 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.8 ptt180 -89.5 -14.27 35.62 Favored 'General case' 0 N--CA 1.538 3.956 0 CA-C-N 119.689 1.131 . . . . 0.0 108.779 173.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -79.52 -19.35 49.81 Favored 'General case' 0 N--CA 1.516 2.847 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 172.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -95.46 -38.06 10.63 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 123.932 0.893 . . . . 0.0 109.467 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.483 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 23.3 tp -75.26 -21.77 58.31 Favored 'General case' 0 N--CA 1.534 3.753 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 173.111 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.452 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -69.08 -71.34 0.99 Allowed Glycine 0 N--CA 1.497 2.704 0 C-N-CA 125.104 1.335 . . . . 0.0 110.553 176.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.6 m -70.33 -28.44 65.16 Favored 'General case' 0 N--CA 1.537 3.893 0 CA-C-O 117.842 -1.075 . . . . 0.0 112.991 -177.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -69.47 -51.7 33.57 Favored 'General case' 0 N--CA 1.534 3.751 0 CA-C-N 120.007 1.276 . . . . 0.0 107.848 178.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 33.2 t -61.78 -19.31 21.0 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.241 0 CA-C-O 117.683 -1.151 . . . . 0.0 109.793 175.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.5 mtp180 -77.39 -43.94 30.97 Favored 'General case' 0 N--CA 1.526 3.355 0 CA-C-N 120.371 1.441 . . . . 0.0 112.299 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.422 HD13 ' N ' ' A' ' 58' ' ' VAL . 0.0 OUTLIER -73.03 -21.69 19.33 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.75 0 CA-C-N 121.719 2.054 . . . . 0.0 111.011 179.508 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.473 HG11 HD11 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -89.15 -52.18 11.25 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.024 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 -178.855 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -59.61 -23.06 62.66 Favored 'General case' 0 N--CA 1.529 3.509 0 CA-C-O 119.087 -0.482 . . . . 0.0 109.984 177.281 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -96.34 -22.52 17.14 Favored 'General case' 0 N--CA 1.526 3.357 0 CA-C-O 117.861 -1.066 . . . . 0.0 110.97 177.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.3 mt -75.3 -54.66 6.7 Favored 'General case' 1 N--CA 1.544 4.235 0 CA-C-N 119.999 1.272 . . . . 0.0 107.903 178.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.3 -36.34 4.02 Favored 'General case' 1 N--CA 1.545 4.278 0 C-N-CA 125.346 1.458 . . . . 0.0 112.003 179.727 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.9 mmm180 -81.85 -52.6 6.93 Favored 'General case' 0 N--CA 1.527 3.397 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.06 59.73 3.31 Favored Glycine 1 N--CA 1.517 4.081 0 CA-C-O 119.349 -0.695 . . . . 0.0 111.795 178.098 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -116.05 -54.52 2.48 Favored 'General case' 0 N--CA 1.524 3.234 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 178.17 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 10.7 ptp -149.39 77.64 1.35 Allowed 'General case' 0 N--CA 1.526 3.351 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 178.326 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.41 ' HA ' HD22 ' A' ' 71' ' ' LEU . 5.6 t -128.97 -8.54 4.9 Favored 'General case' 0 N--CA 1.528 3.429 0 N-CA-C 114.066 1.136 . . . . 0.0 114.066 -176.161 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -114.97 -59.24 2.04 Favored 'General case' 0 N--CA 1.528 3.468 0 CA-C-N 120.056 1.298 . . . . 0.0 111.955 -178.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 3.2 mmt-85 -94.68 -55.12 3.24 Favored 'General case' 0 N--CA 1.528 3.432 0 CA-C-N 118.093 0.406 . . . . 0.0 111.46 -177.193 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -76.87 -9.3 58.59 Favored 'General case' 0 N--CA 1.524 3.273 0 N-CA-C 114.05 1.129 . . . . 0.0 114.05 -177.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.55 HD23 HG21 ' A' ' 82' ' ' ILE . 36.4 tp -77.66 -49.65 14.08 Favored 'General case' 0 N--CA 1.526 3.37 0 CA-C-N 119.973 1.26 . . . . 0.0 112.299 -177.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.45 -34.07 15.75 Favored 'General case' 0 N--CA 1.534 3.747 0 N-CA-C 114.306 1.225 . . . . 0.0 114.306 -176.135 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -68.34 -33.54 74.47 Favored 'General case' 0 N--CA 1.535 3.805 0 CA-C-O 119.051 -0.5 . . . . 0.0 111.709 -178.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -52.54 -46.42 66.76 Favored 'General case' 0 N--CA 1.531 3.611 0 C-N-CA 124.275 1.03 . . . . 0.0 112.584 -178.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.407 HD23 ' N ' ' A' ' 75' ' ' LEU . 1.2 pt? -138.16 -40.56 0.53 Allowed 'General case' 0 N--CA 1.527 3.388 0 CA-C-O 118.63 -0.7 . . . . 0.0 111.852 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 107.87 79.21 1.16 Allowed Glycine 1 N--CA 1.524 4.517 0 CA-C-N 119.185 0.902 . . . . 0.0 111.712 178.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -112.47 -9.78 13.78 Favored 'General case' 0 N--CA 1.526 3.367 0 C-N-CA 123.626 0.77 . . . . 0.0 111.269 177.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 87.81 162.88 38.47 Favored Glycine 0 N--CA 1.513 3.78 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 -178.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.611 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.3 OUTLIER -85.33 -23.31 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.522 3.17 0 CA-C-N 118.825 1.313 . . . . 0.0 108.387 178.625 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.665 ' HB2' ' H62' ' E' ' 15' ' ' ' DA' . . . -64.32 -29.21 70.29 Favored 'General case' 0 N--CA 1.515 2.776 0 CA-C-O 116.921 -1.514 . . . . 0.0 111.509 179.27 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.8 p -83.08 -46.91 12.25 Favored 'General case' 1 N--CA 1.545 4.296 0 CA-C-N 120.809 1.64 . . . . 0.0 110.545 178.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.55 HG21 HD23 ' A' ' 71' ' ' LEU . 15.9 pt -68.36 -16.3 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.99 0 CA-C-O 117.879 -1.058 . . . . 0.0 113.114 -177.74 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 62.7 p -111.19 -29.88 7.67 Favored 'General case' 0 N--CA 1.516 2.861 0 CA-C-N 120.022 1.283 . . . . 0.0 110.721 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -74.96 -21.76 58.97 Favored 'General case' 0 N--CA 1.53 3.564 0 CA-C-N 119.528 1.058 . . . . 0.0 108.309 174.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.07 -29.65 74.81 Favored Glycine 0 N--CA 1.516 3.983 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 176.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.2 t -64.37 -39.55 94.1 Favored 'General case' 0 N--CA 1.539 3.978 0 CA-C-N 118.402 1.101 . . . . 0.0 109.326 176.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -62.04 -19.1 62.52 Favored 'General case' 1 N--CA 1.543 4.187 0 CA-C-O 118.41 -0.805 . . . . 0.0 112.367 179.075 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 14.3 m -72.04 -39.93 68.74 Favored 'General case' 0 N--CA 1.535 3.79 0 CA-C-N 119.297 0.953 . . . . 0.0 110.288 179.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 54.9 mt -56.47 -49.28 75.12 Favored 'General case' 0 N--CA 1.525 3.285 0 C-N-CA 124.324 1.05 . . . . 0.0 112.525 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.66 -11.94 59.36 Favored 'General case' 1 N--CA 1.54 4.071 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -179.421 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.03 -44.72 12.79 Favored 'General case' 0 N--CA 1.519 2.997 0 CA-C-N 119.537 1.062 . . . . 0.0 110.974 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.39 161.98 5.01 Favored Pre-proline 1 N--CA 1.546 4.344 0 CA-C-O 118.249 -0.882 . . . . 0.0 112.663 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.429 ' O ' ' HB2' ' A' ' 97' ' ' ARG . 39.1 Cg_endo -78.22 174.61 12.19 Favored 'Trans proline' 0 C--N 1.38 2.21 0 C-N-CA 121.758 1.639 . . . . 0.0 110.43 178.43 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -94.56 -28.08 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.077 0 CA-C-O 117.302 -1.332 . . . . 0.0 111.721 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -64.24 -39.6 94.29 Favored 'General case' 0 N--CA 1.517 2.903 0 CA-C-N 120.37 1.441 . . . . 0.0 110.904 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.474 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.2 mp -98.9 -17.55 18.32 Favored 'General case' 0 N--CA 1.513 2.721 0 C-N-CA 123.291 0.636 . . . . 0.0 111.751 178.668 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.429 ' HB2' ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -65.35 -32.85 74.71 Favored 'General case' 1 N--CA 1.545 4.3 0 N-CA-C 103.047 -2.946 . . . . 0.0 103.047 168.459 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -55.18 -40.28 70.53 Favored 'General case' 0 N--CA 1.515 2.808 0 C-N-CA 124.371 1.068 . . . . 0.0 110.686 174.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.615 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 54.4 t90 -62.65 -35.49 79.79 Favored 'General case' 0 N--CA 1.536 3.855 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 177.721 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -52.25 -39.1 59.91 Favored 'General case' 1 N--CA 1.542 4.147 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 175.905 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -68.83 -37.25 79.04 Favored 'General case' 1 N--CA 1.542 4.129 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 175.734 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.425 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 1.2 mm-40 -60.79 -23.39 64.99 Favored 'General case' 1 N--CA 1.546 4.362 0 C-N-CA 123.542 0.737 . . . . 0.0 110.609 175.965 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.511 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -115.49 -3.19 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.179 0 CA-C-O 118.375 -0.821 . . . . 0.0 111.921 -177.268 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.25 -56.24 2.53 Favored 'General case' 0 N--CA 1.516 2.842 0 N-CA-C 106.121 -1.807 . . . . 0.0 106.121 175.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.2 tt -66.68 -42.75 86.03 Favored 'General case' 0 N--CA 1.535 3.777 0 C-N-CA 124.95 1.3 . . . . 0.0 110.014 178.423 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 23.6 mtmt 91.87 -45.86 0.01 OUTLIER 'General case' 1 N--CA 1.549 4.478 0 C-N-CA 126.375 1.87 . . . . 0.0 110.682 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 60.5 p . . . . . 0 N--CA 1.535 3.816 0 C-N-CA 125.128 1.371 . . . . 0.0 111.861 -179.573 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 . . . . . 0 N--CA 1.501 2.105 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 6.9 t 63.57 102.48 0.04 OUTLIER Pre-proline 0 N--CA 1.535 3.82 0 C-N-CA 124.361 1.064 . . . . 0.0 109.849 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -79.84 146.06 18.31 Favored 'Trans proline' 0 C--N 1.388 2.655 0 C-N-CA 122.817 2.344 . . . . 0.0 112.15 -178.241 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -118.08 -51.27 2.45 Favored 'General case' 0 N--CA 1.523 3.179 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 177.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 75.6 m -119.1 137.07 53.83 Favored 'General case' 0 N--CA 1.524 3.251 0 C-N-CA 123.545 0.738 . . . . 0.0 110.222 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -81.47 -36.26 29.52 Favored 'General case' 0 N--CA 1.528 3.462 0 CA-C-O 118.944 -0.551 . . . . 0.0 111.14 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . 68.21 159.23 0.16 Allowed 'General case' 1 N--CA 1.543 4.19 0 C-N-CA 124.121 0.968 . . . . 0.0 112.294 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 7.9 tpt -98.52 142.24 30.36 Favored 'General case' 0 N--CA 1.534 3.759 0 C-N-CA 123.434 0.694 . . . . 0.0 110.162 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -155.54 -43.65 0.08 Allowed 'General case' 0 N--CA 1.526 3.364 0 CA-C-O 118.921 -0.562 . . . . 0.0 112.375 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -104.5 148.39 26.52 Favored 'General case' 0 N--CA 1.538 3.927 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -75.07 132.43 41.27 Favored 'General case' 0 N--CA 1.533 3.678 0 C-N-CA 123.008 0.523 . . . . 0.0 110.531 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -93.53 -46.96 7.06 Favored 'General case' 0 N--CA 1.527 3.412 0 CA-C-O 119.163 -0.446 . . . . 0.0 109.895 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 24.6 t60 -101.99 120.1 39.87 Favored 'General case' 0 N--CA 1.523 3.208 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -93.13 126.48 38.25 Favored 'General case' 0 N--CA 1.528 3.475 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -122.28 -84.35 0.66 Allowed 'General case' 0 N--CA 1.524 3.228 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.019 -179.082 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 519' ' ' TRP . . . . . 0.539 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 73.6 t-105 -44.65 -27.27 0.46 Allowed 'General case' 1 N--CA 1.55 4.57 0 CA-C-N 119.961 1.255 . . . . 0.0 113.291 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 520' ' ' LEU . . . . . 0.608 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.2 mm? -99.3 -28.08 13.48 Favored 'General case' 0 N--CA 1.529 3.491 0 CA-C-O 117.645 -1.169 . . . . 0.0 113.273 -173.339 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 18.8 ttm180 -61.33 -26.11 67.59 Favored 'General case' 1 N--CA 1.544 4.228 0 N-CA-C 105.38 -2.081 . . . . 0.0 105.38 171.278 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 522' ' ' PHE . . . . . 0.539 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.8 m-85 -77.05 -43.8 33.16 Favored 'General case' 0 N--CA 1.507 2.423 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 174.311 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 523' ' ' VAL . . . . . 0.522 HG23 ' O ' ' B' ' 519' ' ' TRP . 99.2 t -71.57 -17.45 19.56 Favored 'Isoleucine or valine' 1 N--CA 1.571 5.604 0 CA-C-O 117.755 -1.116 . . . . 0.0 113.203 -178.899 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -79.34 -48.64 13.72 Favored 'General case' 0 N--CA 1.534 3.772 0 CA-C-N 120.631 1.56 . . . . 0.0 108.45 -178.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 5.1 mp -76.95 -18.77 58.04 Favored 'General case' 0 N--CA 1.525 3.301 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 175.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 526' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' B' ' 522' ' ' PHE . 0.2 OUTLIER -69.43 -34.4 74.39 Favored 'General case' 0 N--CA 1.519 2.989 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 173.779 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 52.5 tttt -64.37 -27.7 69.19 Favored 'General case' 0 N--CA 1.519 3.003 0 CA-C-O 118.569 -0.729 . . . . 0.0 110.543 176.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -64.67 -41.62 95.96 Favored 'General case' 0 N--CA 1.536 3.873 0 CA-C-N 118.981 0.809 . . . . 0.0 109.492 177.336 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 529' ' ' ALA . . . . . 0.615 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -83.33 -13.34 55.28 Favored 'General case' 0 N--CA 1.505 2.308 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.894 178.028 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -76.54 -31.79 57.82 Favored 'General case' 0 N--CA 1.539 3.991 0 CA-C-N 120.401 1.455 . . . . 0.0 109.62 179.393 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -64.79 -44.66 89.24 Favored 'General case' 0 N--CA 1.536 3.872 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 178.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -89.63 -90.01 0.15 Allowed 'General case' 0 N--CA 1.515 2.782 0 N-CA-C 105.779 -1.934 . . . . 0.0 105.779 176.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.3 p30 155.56 48.9 0.0 OUTLIER 'General case' 1 N--CA 1.559 4.979 0 C-N-CA 127.447 2.299 . . . . 0.0 108.021 176.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 534' ' ' LEU . . . . . 0.474 HD22 ' CD2' ' A' ' 96' ' ' LEU . 9.4 mt -105.38 12.6 31.41 Favored 'General case' 0 N--CA 1.52 3.041 0 C-N-CA 124.531 1.132 . . . . 0.0 110.257 -178.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 535' ' ' HIS . . . . . 0.555 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 30.9 p-80 -85.17 5.57 29.45 Favored 'General case' 0 N--CA 1.51 2.565 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 175.425 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 536' ' ' LEU . . . . . 0.473 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 31.3 mt -97.03 -51.33 0.22 Allowed Pre-proline 0 N--CA 1.501 2.11 0 CA-C-O 116.362 -1.78 . . . . 0.0 108.45 -175.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 537' ' ' PRO . . . . . 0.473 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 6.3 Cg_exo -68.44 -36.47 15.38 Favored 'Trans proline' 0 C--N 1.394 2.925 0 N-CA-C 106.999 -1.962 . . . . 0.0 106.999 171.397 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 538' ' ' LEU . . . . . 0.51 HD11 ' HE1' ' B' ' 542' ' ' MET . 0.8 OUTLIER -59.87 -45.11 93.52 Favored 'General case' 0 N--CA 1.526 3.326 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 176.382 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 39.9 mt -73.43 -20.89 60.61 Favored 'General case' 0 N--CA 1.535 3.802 0 CA-C-O 118.224 -0.893 . . . . 0.0 111.456 179.25 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -74.2 -23.33 59.18 Favored 'General case' 0 N--CA 1.532 3.638 0 CA-C-N 119.772 1.169 . . . . 0.0 110.049 176.278 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 541' ' ' LEU . . . . . 0.563 HD13 ' N ' ' B' ' 542' ' ' MET . 0.1 OUTLIER -86.1 -51.83 6.07 Favored 'General case' 0 N--CA 1.514 2.757 0 C-N-CA 123.82 0.848 . . . . 0.0 109.649 -179.098 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 542' ' ' MET . . . . . 0.563 ' N ' HD13 ' B' ' 541' ' ' LEU . 8.8 ptt? -99.49 17.17 21.01 Favored 'General case' 0 N--CA 1.53 3.531 0 CA-C-O 118.024 -0.989 . . . . 0.0 113.588 -177.44 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -134.34 -98.85 0.25 Allowed 'General case' 0 N--CA 1.535 3.798 0 CA-C-N 120.467 1.485 . . . . 0.0 113.31 178.291 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 544' ' ' THR . . . . . 0.76 HG23 ' HB2' ' A' ' 898' ' ' TRP . 0.6 OUTLIER 158.17 175.11 0.02 OUTLIER Pre-proline 1 N--CA 1.586 6.331 0 CA-C-N 120.985 1.72 . . . . 0.0 109.511 -177.187 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -63.18 -23.81 72.85 Favored 'Trans proline' 0 N--CA 1.525 3.364 0 C-N-CA 122.135 1.89 . . . . 0.0 110.544 174.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -54.03 -22.45 10.69 Favored 'General case' 1 N--CA 1.55 4.53 0 C-N-CA 123.894 0.877 . . . . 0.0 110.751 176.067 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -45.71 -76.23 0.03 OUTLIER 'General case' 0 N--CA 1.519 3.001 0 C-N-CA 126.333 1.853 . . . . 0.0 112.19 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 548' ' ' ARG . . . . . 0.515 ' HA ' HD12 ' B' ' 551' ' ' LEU . 28.7 ptt180 -93.77 -0.6 55.82 Favored 'General case' 0 N--CA 1.526 3.356 0 N-CA-C 113.634 0.975 . . . . 0.0 113.634 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -75.69 -52.46 10.44 Favored 'General case' 1 N--CA 1.544 4.243 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 173.259 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -73.88 -22.05 59.86 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 117.016 -1.469 . . . . 0.0 111.656 177.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 551' ' ' LEU . . . . . 0.673 HD13 ' N ' ' B' ' 552' ' ' GLY . 0.0 OUTLIER -74.22 -40.24 62.56 Favored 'General case' 0 N--CA 1.533 3.701 0 CA-C-N 121.039 1.745 . . . . 0.0 107.67 176.242 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 552' ' ' GLY . . . . . 0.673 ' N ' HD13 ' B' ' 551' ' ' LEU . . . -63.46 -47.77 84.34 Favored Glycine 0 N--CA 1.507 3.378 0 N-CA-C 110.803 -0.919 . . . . 0.0 110.803 -177.221 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.2 m -79.52 -39.56 31.69 Favored 'General case' 0 N--CA 1.534 3.754 0 CA-C-N 118.244 1.022 . . . . 0.0 112.086 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.2 -49.05 71.22 Favored 'General case' 0 N--CA 1.539 3.994 0 CA-C-N 119.511 1.05 . . . . 0.0 108.982 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 46.2 t -67.74 -19.82 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.761 0 CA-C-O 117.484 -1.246 . . . . 0.0 109.697 177.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 34.1 mtt180 -82.97 -33.49 26.65 Favored 'General case' 0 N--CA 1.521 3.101 0 CA-C-O 116.413 -1.756 . . . . 0.0 112.574 178.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 557' ' ' ILE . . . . . 0.464 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -78.19 -22.12 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.484 0 CA-C-N 122.984 2.629 . . . . 0.0 109.573 178.221 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 558' ' ' VAL . . . . . 0.464 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.0 OUTLIER -85.75 -52.97 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.738 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 179.826 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -60.87 -28.29 68.75 Favored 'General case' 0 N--CA 1.53 3.53 0 CA-C-O 118.653 -0.689 . . . . 0.0 110.659 178.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -86.52 -26.73 24.4 Favored 'General case' 0 N--CA 1.529 3.514 0 CA-C-N 118.667 0.667 . . . . 0.0 109.592 176.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 15.9 tp -65.69 -44.07 87.33 Favored 'General case' 1 N--CA 1.54 4.046 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.741 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 21.4 mt -59.65 -21.66 60.8 Favored 'General case' 0 N--CA 1.533 3.685 0 C-N-CA 123.752 0.821 . . . . 0.0 111.719 178.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 14.2 mmm180 -77.83 -53.44 7.49 Favored 'General case' 0 N--CA 1.524 3.235 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 69.04 77.1 0.42 Allowed Glycine 1 N--CA 1.523 4.458 0 CA-C-O 119.195 -0.781 . . . . 0.0 111.197 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -162.51 -52.69 0.04 OUTLIER 'General case' 0 N--CA 1.529 3.512 0 CA-C-N 117.834 0.817 . . . . 0.0 110.36 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 75.3 mtm -136.03 62.82 1.61 Allowed 'General case' 0 N--CA 1.521 3.108 0 N-CA-C 106.106 -1.813 . . . . 0.0 106.106 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 57.9 m -136.42 9.62 3.18 Favored 'General case' 0 N--CA 1.518 2.949 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.718 -176.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -112.15 -64.31 1.31 Allowed 'General case' 0 N--CA 1.517 2.907 0 CA-C-N 119.259 0.936 . . . . 0.0 110.404 -179.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -110.03 -43.53 3.96 Favored 'General case' 0 N--CA 1.519 3.01 0 C-N-CA 123.166 0.586 . . . . 0.0 110.271 -178.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -70.07 -13.12 62.06 Favored 'General case' 0 N--CA 1.514 2.767 0 CA-C-O 117.89 -1.052 . . . . 0.0 113.551 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 571' ' ' LEU . . . . . 0.853 HD23 HD11 ' B' ' 582' ' ' ILE . 18.2 tp -82.4 -51.46 7.83 Favored 'General case' 0 N--CA 1.527 3.411 0 CA-C-N 120.245 1.384 . . . . 0.0 110.615 -179.004 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -44.56 -30.51 0.91 Allowed 'General case' 1 N--CA 1.55 4.563 0 CA-C-N 119.125 0.875 . . . . 0.0 113.308 179.956 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -67.21 -43.59 81.71 Favored 'General case' 0 N--CA 1.535 3.806 0 C-N-CA 122.882 0.473 . . . . 0.0 110.795 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -47.68 -50.55 24.57 Favored 'General case' 0 N--CA 1.534 3.741 0 C-N-CA 124.734 1.214 . . . . 0.0 113.449 -178.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 2.0 pp -135.97 -43.86 0.65 Allowed 'General case' 0 N--CA 1.537 3.885 0 CA-C-O 118.938 -0.554 . . . . 0.0 111.604 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 113.85 82.37 1.1 Allowed Glycine 1 N--CA 1.523 4.479 0 N-CA-C 110.305 -1.118 . . . . 0.0 110.305 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -103.2 -43.04 5.57 Favored 'General case' 0 N--CA 1.526 3.352 0 C-N-CA 123.426 0.691 . . . . 0.0 109.594 178.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 108.61 157.94 18.99 Favored Glycine 0 N--CA 1.515 3.913 0 N-CA-C 109.734 -1.346 . . . . 0.0 109.734 -179.074 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 579' ' ' ILE . . . . . 0.528 HG21 ' N6 ' ' E' ' 4' ' ' ' DA' . 0.8 OUTLIER -82.74 -15.82 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.898 0 CA-C-N 119.235 1.518 . . . . 0.0 108.265 177.701 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 580' ' ' ALA . . . . . 0.962 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -69.4 -42.62 74.87 Favored 'General case' 0 N--CA 1.525 3.318 0 CA-C-N 120.047 1.294 . . . . 0.0 109.149 176.247 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.2 p -75.94 -38.68 57.35 Favored 'General case' 1 N--CA 1.542 4.142 0 CA-C-N 119.127 0.876 . . . . 0.0 112.365 179.31 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 582' ' ' ILE . . . . . 0.853 HD11 HD23 ' B' ' 571' ' ' LEU . 0.8 OUTLIER -67.66 -37.19 78.23 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.356 0 C-N-CA 123.347 0.659 . . . . 0.0 112.35 -175.112 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 75.6 p -101.07 -24.79 14.23 Favored 'General case' 0 N--CA 1.511 2.608 0 CA-C-O 117.897 -1.049 . . . . 0.0 111.685 -179.412 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 13.7 ptt180 -74.59 -23.69 58.78 Favored 'General case' 0 N--CA 1.526 3.365 0 CA-C-N 119.936 1.244 . . . . 0.0 109.004 175.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -63.02 -35.03 91.54 Favored Glycine 1 N--CA 1.528 4.781 0 N-CA-C 107.871 -2.092 . . . . 0.0 107.871 173.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 19.4 m -65.35 -34.52 78.52 Favored 'General case' 1 N--CA 1.541 4.104 0 C-N-CA 123.136 0.575 . . . . 0.0 110.403 176.55 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -62.85 -35.09 78.83 Favored 'General case' 1 N--CA 1.547 4.408 0 C-N-CA 123.354 0.662 . . . . 0.0 110.274 178.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.84 -35.26 76.1 Favored 'General case' 0 N--CA 1.534 3.758 0 C-N-CA 123.773 0.829 . . . . 0.0 111.133 179.337 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 24.1 mt -58.25 -42.47 86.46 Favored 'General case' 0 N--CA 1.531 3.575 0 C-N-CA 123.724 0.81 . . . . 0.0 110.731 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 3.1 mptt -60.29 -29.41 68.81 Favored 'General case' 1 N--CA 1.543 4.21 0 C-N-CA 123.205 0.602 . . . . 0.0 111.89 179.148 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -71.8 -40.88 68.87 Favored 'General case' 0 N--CA 1.517 2.884 0 CA-C-O 119.226 -0.416 . . . . 0.0 110.241 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -70.82 159.0 86.77 Favored Pre-proline 0 N--CA 1.527 3.41 0 CA-C-O 118.5 -0.762 . . . . 0.0 111.439 178.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -82.07 178.88 5.99 Favored 'Trans proline' 0 C--N 1.376 2.015 0 C-N-CA 122.013 1.809 . . . . 0.0 111.731 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.8 t -92.36 -26.97 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.906 0 CA-C-O 117.558 -1.211 . . . . 0.0 110.272 179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -65.35 -38.14 89.18 Favored 'General case' 0 N--CA 1.515 2.819 0 CA-C-N 119.938 1.244 . . . . 0.0 110.195 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 596' ' ' LEU . . . . . 0.43 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.8 mp -97.95 -20.92 17.14 Favored 'General case' 0 N--CA 1.513 2.676 0 C-N-CA 123.443 0.697 . . . . 0.0 110.973 178.754 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -27.42 66.83 Favored 'General case' 0 N--CA 1.536 3.854 0 N-CA-C 103.389 -2.819 . . . . 0.0 103.389 168.627 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.16 -39.88 79.98 Favored 'General case' 0 N--CA 1.523 3.224 0 C-N-CA 124.345 1.058 . . . . 0.0 109.742 173.401 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 599' ' ' TRP . . . . . 0.603 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 45.7 t90 -61.86 -35.72 79.14 Favored 'General case' 0 N--CA 1.526 3.374 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 178.034 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.81 -36.26 47.27 Favored 'General case' 1 N--CA 1.541 4.092 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 176.781 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -73.38 -37.28 66.07 Favored 'General case' 0 N--CA 1.533 3.716 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 175.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 602' ' ' GLU . . . . . 0.445 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.2 OUTLIER -59.65 -22.16 61.5 Favored 'General case' 1 N--CA 1.544 4.261 0 CA-C-O 118.675 -0.679 . . . . 0.0 110.912 175.513 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' B' B ' 603' ' ' VAL . . . . . 0.519 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.0 OUTLIER -112.93 3.15 8.32 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.763 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -176.548 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 75.6 mt -114.43 -60.26 1.91 Allowed 'General case' 0 N--CA 1.519 3.017 0 N-CA-C 106.395 -1.705 . . . . 0.0 106.395 175.25 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 4.1 mp -62.12 -64.28 0.98 Allowed 'General case' 0 N--CA 1.536 3.841 0 C-N-CA 124.467 1.107 . . . . 0.0 111.768 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 61.9 mttm -63.82 -45.85 87.76 Favored 'General case' 0 N--CA 1.534 3.752 0 C-N-CA 122.926 0.49 . . . . 0.0 111.333 -177.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 73.3 m . . . . . 0 N--CA 1.525 3.306 0 CA-C-O 118.654 -0.689 . . . . 0.0 110.418 -179.718 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 898' ' ' TRP . . . . . 0.76 ' HB2' HG23 ' B' ' 544' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.001 0 CA-C-O 117.328 -1.32 . . . . 0.0 109.03 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 998' ' ' TRP . . . . . 0.76 ' HB2' HG23 ' A' ' 44' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.956 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.421 -9.745 3 O4'-C1'-N19 119.034 14.042 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.559 4 O4'-C1'-N19 120.862 16.328 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -10.002 3 O4'-C1'-N19 119.661 14.826 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . 0.417 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 6 C3'--C2' 1.418 -9.967 4 O4'-C1'-N19 119.061 14.076 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' E' E ' 5' ' ' ' DC' . . . . . 0.416 ' H41' ' HA ' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.411 -10.663 3 O4'-C1'-N19 119.488 14.61 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.409 -10.921 5 O4'-C1'-N19 119.27 14.338 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' E' E ' 7' ' ' ' DA' . . . . . 0.635 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.396 -12.157 3 C4'-C3'-C2' 113.03 9.83 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' E' E ' 8' ' ' ' DG' . . . . . 0.635 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 O3'--C3' 1.56 9.931 4 O4'-C1'-N19 120.021 15.276 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.566 10.372 4 O4'-C1'-N19 119.817 15.022 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.408 -11.008 5 O4'-C1'-N19 120.168 15.46 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.278 2 O4'-C1'-N19 120.647 16.059 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.768 5 O4'-C1'-N19 119.014 14.017 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' E' E ' 13' ' ' ' DC' . . . . . 0.5 H2'' " O5'" ' E' ' 14' ' ' ' DT' . . . . . . . . 6 O3'--C3' 1.551 9.206 3 O4'-C1'-N19 119.586 14.733 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' E' E ' 14' ' ' ' DT' . . . . . 0.693 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.402 -11.606 6 O4'-C1'-N19 119.534 14.667 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' E' E ' 15' ' ' ' DA' . . . . . 0.748 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 5 C3'--C2' 1.423 -9.516 3 O4'-C1'-N19 119.828 15.035 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.427 -9.114 4 O4'-C1'-N19 119.437 14.546 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.072 6 O4'-C1'-N19 119.169 14.211 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.293 4 O4'-C1'-N19 119.818 15.023 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.12 4 O4'-C1'-N19 119.935 15.169 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.598 6.987 4 O4'-C1'-N19 119.446 14.557 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.395 3 O4'-C1'-N19 119.551 14.689 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.407 -11.096 3 O4'-C1'-N19 119.582 14.727 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.455 5 O4'-C1'-N19 120.268 15.586 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' F' F ' 4' ' ' ' DA' . . . . . 0.552 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.424 -9.447 4 O4'-C1'-N19 119.458 14.572 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' F' F ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.177 4 O4'-C1'-N19 118.688 13.61 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.407 -11.146 3 O4'-C1'-N19 120.112 15.39 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.408 -11.952 4 N19-C1'-C2' 130.914 10.446 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.42 -9.751 3 O4'-C1'-N19 119.692 14.865 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.565 10.297 3 C4'-C3'-C2' 117.038 13.838 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.407 -11.091 4 O4'-C1'-N19 118.644 13.555 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.414 -10.377 5 O4'-C1'-N19 120.31 15.637 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -10.028 5 O4'-C1'-N19 119.367 14.459 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.426 -9.173 4 O4'-C1'-N19 118.995 13.994 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' F' F ' 14' ' ' ' DT' . . . . . 0.61 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.416 -10.207 3 O4'-C1'-N19 119.327 14.409 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' F' F ' 15' ' ' ' DA' . . . . . 0.833 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.414 -10.354 6 O4'-C1'-N19 119.899 15.124 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.417 -10.077 4 O4'-C1'-N19 119.347 14.433 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.618 3 O4'-C1'-N19 119.513 14.641 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.058 4 O4'-C1'-N19 120.607 16.009 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.355 4 O4'-C1'-N19 119.371 14.464 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.513 7.116 4 O4'-C1'-N19 119.909 15.136 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 . . . . . 0 N--CA 1.505 2.318 0 CA-C-O 119.628 -0.225 . . . . 0.0 110.488 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 52.7 p -154.02 124.55 3.43 Favored Pre-proline 0 N--CA 1.524 3.26 0 CA-C-O 117.135 -1.412 . . . . 0.0 110.156 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -76.27 132.23 13.59 Favored 'Trans proline' 0 C--N 1.389 2.708 0 C-N-CA 122.648 2.232 . . . . 0.0 109.871 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -89.64 137.73 32.08 Favored 'General case' 0 N--CA 1.531 3.577 0 C-N-CA 122.486 0.314 . . . . 0.0 110.796 -179.36 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 50.5 p -127.99 129.7 47.17 Favored 'General case' 0 N--CA 1.522 3.13 0 C-N-CA 123.563 0.745 . . . . 0.0 109.767 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -101.43 131.65 47.42 Favored 'General case' 0 N--CA 1.522 3.161 0 C-N-CA 122.974 0.51 . . . . 0.0 110.196 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -156.23 -51.94 0.08 Allowed 'General case' 0 N--CA 1.522 3.163 0 C-N-CA 122.673 0.389 . . . . 0.0 110.284 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.44 -34.82 63.3 Favored 'General case' 0 N--CA 1.531 3.591 0 CA-C-O 118.805 -0.617 . . . . 0.0 111.18 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -95.37 123.23 38.79 Favored 'General case' 0 N--CA 1.517 2.893 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -112.9 122.64 48.24 Favored 'General case' 0 N--CA 1.516 2.849 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -138.1 152.1 48.44 Favored 'General case' 0 N--CA 1.528 3.429 0 C-N-CA 122.81 0.444 . . . . 0.0 111.02 -178.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? 61.83 119.14 0.01 OUTLIER 'General case' 0 N--CA 1.533 3.695 0 C-N-CA 124.629 1.171 . . . . 0.0 111.638 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 56.34 103.67 0.01 OUTLIER 'General case' 0 N--CA 1.531 3.589 0 C-N-CA 124.561 1.144 . . . . 0.0 111.648 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -111.46 63.59 0.61 Allowed 'General case' 0 N--CA 1.516 2.849 0 N-CA-C 106.697 -1.594 . . . . 0.0 106.697 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -132.08 -92.46 0.39 Allowed 'General case' 0 N--CA 1.514 2.74 0 CA-C-O 118.205 -0.902 . . . . 0.0 109.265 -178.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.681 ' CZ3' HD22 ' B' ' 551' ' ' LEU . 72.6 t-105 -48.45 -38.49 19.96 Favored 'General case' 0 N--CA 1.534 3.728 0 CA-C-N 119.862 1.21 . . . . 0.0 112.148 179.349 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.505 ' N ' HD22 ' A' ' 20' ' ' LEU . 2.6 mm? -87.37 -27.11 22.99 Favored 'General case' 0 N--CA 1.524 3.239 0 CA-C-O 117.369 -1.3 . . . . 0.0 112.891 -174.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.71 -28.4 68.63 Favored 'General case' 1 N--CA 1.54 4.059 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 173.272 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.488 ' HB2' HG21 ' B' ' 555' ' ' VAL . 0.1 OUTLIER -79.6 -39.44 31.65 Favored 'General case' 0 N--CA 1.5 2.046 0 CA-C-O 116.366 -1.778 . . . . 0.0 108.075 173.585 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 19' ' ' TRP . 86.7 t -68.22 -21.28 26.45 Favored 'Isoleucine or valine' 1 N--CA 1.568 5.456 0 CA-C-N 121.138 1.79 . . . . 0.0 112.569 -177.631 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -78.19 -53.02 7.81 Favored 'General case' 0 N--CA 1.534 3.741 0 CA-C-N 120.112 1.324 . . . . 0.0 107.51 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.6 mp -70.03 -15.94 63.08 Favored 'General case' 0 N--CA 1.529 3.492 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 175.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.473 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -72.34 -37.8 68.77 Favored 'General case' 0 N--CA 1.513 2.694 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 176.305 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.677 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 11.0 tptp -69.16 -15.02 63.31 Favored 'General case' 0 N--CA 1.515 2.804 0 CA-C-O 117.924 -1.036 . . . . 0.0 111.483 176.171 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -74.16 -41.28 61.75 Favored 'General case' 0 N--CA 1.533 3.681 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 175.003 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.601 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -87.62 -7.1 57.91 Favored 'General case' 0 N--CA 1.505 2.301 0 CA-C-O 118.671 -0.681 . . . . 0.0 110.364 177.216 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.677 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -82.99 -33.34 26.62 Favored 'General case' 0 N--CA 1.537 3.92 0 CA-C-N 120.071 1.305 . . . . 0.0 109.073 179.532 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -65.56 -40.12 92.47 Favored 'General case' 0 N--CA 1.532 3.649 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 176.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -90.94 -90.61 0.15 Allowed 'General case' 0 N--CA 1.514 2.736 0 N-CA-C 106.143 -1.799 . . . . 0.0 106.143 176.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 152.93 50.73 0.0 OUTLIER 'General case' 1 N--CA 1.558 4.93 0 C-N-CA 127.629 2.372 . . . . 0.0 108.474 176.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.483 HD22 ' CD2' ' B' ' 596' ' ' LEU . 5.7 mt -112.16 13.29 20.54 Favored 'General case' 0 N--CA 1.527 3.389 0 C-N-CA 124.312 1.045 . . . . 0.0 109.855 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.497 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 43.6 p-80 -83.07 3.61 29.74 Favored 'General case' 0 N--CA 1.506 2.341 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 175.566 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.803 ' HA ' HD23 ' A' ' 39' ' ' LEU . 21.2 mt -94.92 -50.95 0.25 Allowed Pre-proline 0 N--CA 1.509 2.503 0 CA-C-O 116.957 -1.497 . . . . 0.0 108.971 -175.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.472 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 3.9 Cg_exo -65.41 -30.87 52.8 Favored 'Trans proline' 0 C--N 1.396 3.036 0 N-CA-C 106.563 -2.13 . . . . 0.0 106.563 170.523 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.497 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.2 OUTLIER -67.32 -37.83 83.96 Favored 'General case' 0 N--CA 1.52 3.068 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 175.88 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.803 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -73.99 -15.98 61.08 Favored 'General case' 1 N--CA 1.543 4.186 0 CA-C-N 119.549 1.068 . . . . 0.0 110.407 175.956 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -82.58 -17.91 43.18 Favored 'General case' 0 N--CA 1.523 3.218 0 CA-C-N 119.651 1.114 . . . . 0.0 110.151 177.013 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 pp -99.83 -44.91 5.9 Favored 'General case' 0 N--CA 1.531 3.578 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -177.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 12.8 ptp -109.94 2.04 19.49 Favored 'General case' 1 N--CA 1.551 4.579 0 CA-C-N 118.962 0.801 . . . . 0.0 112.637 -175.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.0 mt -115.89 -65.39 1.19 Allowed 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 117.729 -1.129 . . . . 0.0 110.416 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 35.4 p 119.45 159.66 0.0 OUTLIER Pre-proline 1 N--CA 1.573 5.705 0 C-N-CA 128.32 2.648 . . . . 0.0 109.542 -178.77 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -67.24 -30.97 36.74 Favored 'Trans proline' 0 C--N 1.39 2.761 0 C-N-CA 122.026 1.817 . . . . 0.0 109.276 175.157 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -65.63 -26.42 67.81 Favored 'General case' 0 N--CA 1.531 3.604 0 CA-C-O 118.476 -0.773 . . . . 0.0 109.77 176.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -69.64 -33.35 72.5 Favored 'General case' 0 N--CA 1.524 3.275 0 CA-C-O 117.584 -1.198 . . . . 0.0 109.579 178.074 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 25.3 ptt180 -83.97 -18.12 38.27 Favored 'General case' 0 N--CA 1.53 3.533 0 CA-C-N 119.653 1.115 . . . . 0.0 108.906 174.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -75.23 -21.77 58.38 Favored 'General case' 0 N--CA 1.521 3.116 0 N-CA-C 107.2 -1.408 . . . . 0.0 107.2 173.456 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.474 ' HB1' ' CZ ' ' A' ' 54' ' ' ARG . . . -92.91 -35.22 13.45 Favored 'General case' 0 N--CA 1.506 2.368 0 CA-C-O 118.124 -0.941 . . . . 0.0 109.05 179.028 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.465 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 25.7 tp -71.99 -21.81 61.52 Favored 'General case' 0 N--CA 1.536 3.873 0 N-CA-C 106.232 -1.766 . . . . 0.0 106.232 172.637 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.47 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -68.91 -75.55 0.52 Allowed Glycine 0 C--N 1.374 2.648 0 C-N-CA 125.585 1.564 . . . . 0.0 110.684 177.068 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.4 m -66.97 -26.08 66.64 Favored 'General case' 0 N--CA 1.534 3.757 0 CA-C-O 117.774 -1.108 . . . . 0.0 113.389 -177.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.474 ' CZ ' ' HB1' ' A' ' 50' ' ' ALA . 29.2 mtm180 -72.53 -47.06 51.37 Favored 'General case' 0 N--CA 1.532 3.637 0 CA-C-N 120.105 1.321 . . . . 0.0 108.329 178.417 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.6 t -66.77 -18.41 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.978 0 CA-C-N 119.638 1.108 . . . . 0.0 108.839 174.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.3 mtp180 -73.49 -46.81 45.81 Favored 'General case' 0 N--CA 1.528 3.454 0 CA-C-O 117.16 -1.4 . . . . 0.0 111.792 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.531 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -75.24 -23.54 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.733 0 CA-C-N 121.626 2.012 . . . . 0.0 111.304 -179.049 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.67 HG11 HD11 ' B' ' 541' ' ' LEU . 0.0 OUTLIER -83.46 -47.32 18.16 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.261 0 CA-C-N 120.374 1.443 . . . . 0.0 107.59 -179.529 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -63.88 -29.39 70.58 Favored 'General case' 0 N--CA 1.528 3.446 0 N-CA-C 109.435 -0.579 . . . . 0.0 109.435 177.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -88.28 -17.99 29.52 Favored 'General case' 0 N--CA 1.524 3.237 0 CA-C-O 118.084 -0.96 . . . . 0.0 110.549 177.433 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.7 mt -79.93 -40.97 26.99 Favored 'General case' 0 N--CA 1.531 3.58 0 CA-C-N 119.439 1.018 . . . . 0.0 108.342 178.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.2 tt -50.05 -36.94 31.06 Favored 'General case' 1 N--CA 1.543 4.184 0 C-N-CA 124.402 1.081 . . . . 0.0 110.537 178.46 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -80.07 -59.79 2.58 Favored 'General case' 0 N--CA 1.524 3.271 0 N-CA-C 106.824 -1.546 . . . . 0.0 106.824 177.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 57.11 67.59 2.14 Favored Glycine 1 N--CA 1.524 4.506 0 C-N-CA 124.222 0.915 . . . . 0.0 113.264 176.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -130.06 -52.17 1.12 Allowed 'General case' 0 N--CA 1.517 2.921 0 CA-C-N 117.765 0.782 . . . . 0.0 109.027 179.019 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 73.4 mtp -141.86 15.82 2.12 Favored 'General case' 0 N--CA 1.527 3.387 0 C-N-CA 122.895 0.478 . . . . 0.0 111.761 -179.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 5.1 t -115.67 37.37 3.62 Favored 'General case' 0 N--CA 1.531 3.603 0 CA-C-N 119.517 1.053 . . . . 0.0 111.581 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -114.92 -47.07 2.89 Favored 'General case' 0 N--CA 1.518 2.928 0 C-N-CA 124.381 1.072 . . . . 0.0 109.26 178.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -105.21 -55.6 2.3 Favored 'General case' 0 N--CA 1.526 3.342 0 C-N-CA 123.745 0.818 . . . . 0.0 109.555 -179.301 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -69.29 -9.2 52.15 Favored 'General case' 0 N--CA 1.52 3.055 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -178.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.705 HD23 HG21 ' A' ' 82' ' ' ILE . 22.1 tp -69.0 -46.99 66.59 Favored 'General case' 0 N--CA 1.528 3.43 0 CA-C-N 119.526 1.057 . . . . 0.0 111.229 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -41.42 -41.42 2.02 Favored 'General case' 1 N--CA 1.549 4.519 0 N-CA-C 114.555 1.316 . . . . 0.0 114.555 -178.093 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -68.32 -36.14 78.85 Favored 'General case' 0 N--CA 1.538 3.943 0 C-N-CA 122.859 0.464 . . . . 0.0 111.94 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -47.61 -55.99 8.15 Favored 'General case' 0 N--CA 1.535 3.814 0 C-N-CA 124.838 1.255 . . . . 0.0 113.383 -178.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -128.81 -38.87 1.64 Allowed 'General case' 0 N--CA 1.532 3.663 0 CA-C-O 118.621 -0.705 . . . . 0.0 111.68 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 125.3 78.98 0.34 Allowed Glycine 1 N--CA 1.522 4.38 0 CA-C-N 119.181 0.9 . . . . 0.0 111.539 178.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.56 104.99 4.11 Favored 'General case' 0 N--CA 1.523 3.204 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 177.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -38.69 168.37 0.01 OUTLIER Glycine 1 N--CA 1.536 5.309 0 C-N-CA 125.576 1.56 . . . . 0.0 116.021 -176.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.552 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.5 OUTLIER -80.68 -20.37 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.981 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 177.754 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.748 ' HB2' ' H62' ' E' ' 15' ' ' ' DA' . . . -63.2 -32.49 73.9 Favored 'General case' 0 N--CA 1.522 3.171 0 CA-C-O 117.797 -1.097 . . . . 0.0 110.158 177.33 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 5.3 p -80.97 -50.17 10.04 Favored 'General case' 0 N--CA 1.536 3.873 0 CA-C-N 119.614 1.097 . . . . 0.0 111.962 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.705 HG21 HD23 ' A' ' 71' ' ' LEU . 0.3 OUTLIER -65.83 -20.73 27.83 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.239 0 CA-C-O 117.831 -1.081 . . . . 0.0 112.888 -178.004 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 46.1 p -107.96 -25.68 11.06 Favored 'General case' 0 N--CA 1.514 2.763 0 CA-C-N 119.794 1.179 . . . . 0.0 111.904 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 14.4 ptt180 -79.28 -21.92 45.4 Favored 'General case' 0 N--CA 1.532 3.633 0 CA-C-N 119.722 1.147 . . . . 0.0 108.3 174.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.14 -32.67 69.13 Favored Glycine 0 N--CA 1.513 3.808 0 N-CA-C 110.259 -1.137 . . . . 0.0 110.259 177.266 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 51.5 p -67.88 -35.34 78.33 Favored 'General case' 1 N--CA 1.541 4.082 0 CA-C-N 118.579 1.189 . . . . 0.0 111.084 179.052 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -61.28 -30.53 70.53 Favored 'General case' 1 N--CA 1.541 4.114 0 C-N-CA 123.31 0.644 . . . . 0.0 110.962 179.037 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.3 m -69.0 -38.91 79.56 Favored 'General case' 0 N--CA 1.534 3.746 0 C-N-CA 123.422 0.689 . . . . 0.0 110.46 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 15.5 mt -59.54 -40.43 87.22 Favored 'General case' 0 N--CA 1.528 3.465 0 C-N-CA 124.02 0.928 . . . . 0.0 111.506 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.08 -19.72 54.6 Favored 'General case' 1 N--CA 1.541 4.112 0 CA-C-O 118.309 -0.853 . . . . 0.0 112.682 -179.322 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -96.27 -35.82 11.12 Favored 'General case' 0 N--CA 1.517 2.92 0 CA-C-N 119.179 0.9 . . . . 0.0 111.907 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -48.1 160.77 0.4 Allowed Pre-proline 1 N--CA 1.55 4.568 0 CA-C-O 118.253 -0.88 . . . . 0.0 113.259 -179.126 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -81.77 150.11 16.34 Favored 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 121.996 1.798 . . . . 0.0 109.946 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -84.11 -25.12 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.865 0 CA-C-O 117.817 -1.087 . . . . 0.0 111.24 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -62.83 -39.48 94.48 Favored 'General case' 0 N--CA 1.518 2.967 0 CA-C-N 120.16 1.346 . . . . 0.0 109.881 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.528 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.4 mp -98.08 -16.35 19.62 Favored 'General case' 0 N--CA 1.513 2.723 0 C-N-CA 123.836 0.854 . . . . 0.0 111.438 178.092 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -34.93 79.09 Favored 'General case' 1 N--CA 1.544 4.252 0 N-CA-C 103.458 -2.793 . . . . 0.0 103.458 169.348 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -56.17 -39.9 73.08 Favored 'General case' 0 N--CA 1.508 2.432 0 C-N-CA 124.401 1.08 . . . . 0.0 111.144 175.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.593 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 63.8 t90 -63.39 -34.67 78.23 Favored 'General case' 0 N--CA 1.53 3.548 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 177.696 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.16 -40.85 64.64 Favored 'General case' 0 N--CA 1.539 3.992 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 175.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -67.5 -36.79 81.76 Favored 'General case' 1 N--CA 1.54 4.045 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 175.581 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.476 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 3.0 mt-10 -60.75 -22.8 64.41 Favored 'General case' 1 N--CA 1.542 4.149 0 C-N-CA 123.635 0.774 . . . . 0.0 110.737 176.645 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -121.81 6.67 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.366 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -177.104 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.36 -55.4 2.52 Favored 'General case' 0 N--CA 1.513 2.715 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 176.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.9 tp -61.52 -41.53 97.46 Favored 'General case' 0 N--CA 1.529 3.489 0 C-N-CA 124.861 1.264 . . . . 0.0 111.68 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt 77.18 100.58 0.07 Allowed 'General case' 0 N--CA 1.533 3.685 0 C-N-CA 124.779 1.232 . . . . 0.0 108.401 -178.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 6.5 t . . . . . 0 N--CA 1.524 3.257 0 CA-C-O 118.476 -0.773 . . . . 0.0 110.227 -179.205 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 . . . . . 0 N--CA 1.5 2.034 0 N-CA-C 109.541 -0.541 . . . . 0.0 109.541 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 72.4 m -136.6 124.19 14.53 Favored Pre-proline 0 N--CA 1.518 2.935 0 CA-C-O 117.508 -1.234 . . . . 0.0 109.665 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -81.55 4.69 6.81 Favored 'Trans proline' 0 CA--C 1.586 3.092 0 C-N-CA 122.352 2.035 . . . . 0.0 112.31 179.014 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -93.3 -52.95 4.3 Favored 'General case' 0 N--CA 1.53 3.573 0 CA-C-N 119.717 1.144 . . . . 0.0 110.251 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 7.8 t -118.64 132.17 56.18 Favored 'General case' 0 N--CA 1.524 3.269 0 C-N-CA 123.064 0.546 . . . . 0.0 110.544 -179.164 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -155.24 142.95 19.8 Favored 'General case' 0 N--CA 1.527 3.398 0 C-N-CA 123.184 0.594 . . . . 0.0 110.876 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -154.62 149.79 27.0 Favored 'General case' 0 N--CA 1.525 3.314 0 N-CA-C 112.443 0.535 . . . . 0.0 112.443 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 3.9 mtt -94.5 126.07 39.55 Favored 'General case' 0 N--CA 1.524 3.229 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 178.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -151.1 -49.28 0.12 Allowed 'General case' 0 N--CA 1.52 3.052 0 CA-C-O 119.101 -0.476 . . . . 0.0 111.864 -178.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -93.1 -56.43 2.97 Favored 'General case' 0 N--CA 1.525 3.315 0 CA-C-N 118.112 0.415 . . . . 0.0 110.608 -178.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 65.5 mt-30 -102.55 128.75 49.07 Favored 'General case' 0 N--CA 1.528 3.456 0 C-N-CA 122.7 0.4 . . . . 0.0 110.091 -178.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 38.9 ttt180 -159.24 -53.72 0.06 Allowed 'General case' 0 N--CA 1.524 3.271 0 CA-C-O 119.247 -0.406 . . . . 0.0 110.95 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -78.59 168.97 18.98 Favored 'General case' 0 N--CA 1.535 3.783 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -178.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -79.24 145.43 33.58 Favored 'General case' 0 N--CA 1.53 3.564 0 C-N-CA 122.89 0.476 . . . . 0.0 110.914 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -100.38 -69.03 0.78 Allowed 'General case' 0 N--CA 1.524 3.242 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 519' ' ' TRP . . . . . 0.704 ' CE2' HD22 ' A' ' 39' ' ' LEU . 72.1 t-105 -42.69 -29.27 0.29 Allowed 'General case' 1 N--CA 1.546 4.354 0 C-N-CA 124.373 1.069 . . . . 0.0 113.509 179.676 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 520' ' ' LEU . . . . . 0.571 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.4 mm? -94.34 -29.15 15.17 Favored 'General case' 0 N--CA 1.529 3.476 0 CA-C-O 117.769 -1.11 . . . . 0.0 113.863 -172.403 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 37.0 mtm180 -64.26 -23.77 67.42 Favored 'General case' 0 N--CA 1.533 3.686 0 N-CA-C 106.266 -1.753 . . . . 0.0 106.266 171.541 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 522' ' ' PHE . . . . . 0.545 ' O ' HD23 ' B' ' 526' ' ' LEU . 1.9 m-85 -77.61 -38.74 47.46 Favored 'General case' 0 N--CA 1.514 2.739 0 N-CA-C 106.7 -1.593 . . . . 0.0 106.7 173.323 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.75 -24.31 34.08 Favored 'Isoleucine or valine' 1 N--CA 1.551 4.622 0 CA-C-O 116.924 -1.512 . . . . 0.0 112.627 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -77.48 -42.14 36.88 Favored 'General case' 1 N--CA 1.542 4.136 0 CA-C-N 121.463 1.938 . . . . 0.0 108.443 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 525' ' ' LEU . . . . . 0.411 HD12 ' HB ' ' A' ' 103' ' ' VAL . 0.8 OUTLIER -68.79 -28.99 67.26 Favored 'General case' 1 N--CA 1.539 4.003 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 175.473 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' B' B ' 526' ' ' LEU . . . . . 0.545 HD23 ' O ' ' B' ' 522' ' ' PHE . 2.7 mm? -72.25 -32.78 66.99 Favored 'General case' 0 N--CA 1.524 3.243 0 CA-C-O 118.511 -0.757 . . . . 0.0 109.459 177.719 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 31.1 ttmt -71.6 -28.88 64.11 Favored 'General case' 0 N--CA 1.517 2.901 0 CA-C-O 118.388 -0.815 . . . . 0.0 110.641 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -71.71 -35.94 70.37 Favored 'General case' 0 N--CA 1.533 3.702 0 CA-C-N 119.052 0.842 . . . . 0.0 108.98 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 529' ' ' ALA . . . . . 0.593 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -89.44 -9.38 50.4 Favored 'General case' 0 CA--C 1.578 2.028 0 CA-C-O 118.358 -0.829 . . . . 0.0 110.209 178.132 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -82.07 -34.41 29.42 Favored 'General case' 0 N--CA 1.533 3.678 0 CA-C-N 120.411 1.459 . . . . 0.0 108.574 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -61.69 -41.0 96.99 Favored 'General case' 0 N--CA 1.538 3.926 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 177.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 66.2 m-80 -95.42 -88.9 0.25 Allowed 'General case' 0 N--CA 1.514 2.736 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 176.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.8 p30 153.54 49.74 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.062 0 C-N-CA 127.764 2.426 . . . . 0.0 108.228 177.169 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 534' ' ' LEU . . . . . 0.528 HD22 ' CD2' ' A' ' 96' ' ' LEU . 10.0 mt -101.73 2.05 38.09 Favored 'General case' 0 N--CA 1.529 3.523 0 C-N-CA 124.561 1.144 . . . . 0.0 111.197 -179.175 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 535' ' ' HIS . . . . . 0.582 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 56.7 p-80 -80.64 0.48 34.06 Favored 'General case' 0 N--CA 1.511 2.617 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 174.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 536' ' ' LEU . . . . . . . . . . . . . 46.7 mt -93.38 -49.62 0.28 Allowed Pre-proline 0 N--CA 1.509 2.48 0 CA-C-O 116.673 -1.632 . . . . 0.0 109.492 -176.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 537' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -63.16 -36.42 58.13 Favored 'Trans proline' 0 C--N 1.397 3.11 0 N-CA-C 106.539 -2.139 . . . . 0.0 106.539 171.272 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.28 -49.8 74.93 Favored 'General case' 0 N--CA 1.531 3.594 0 C-N-CA 124.21 1.004 . . . . 0.0 109.19 174.767 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 13.2 mt -66.17 -21.54 66.33 Favored 'General case' 1 N--CA 1.54 4.04 0 CA-C-O 118.086 -0.959 . . . . 0.0 112.599 -178.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 21.9 t30 -70.77 -12.31 61.47 Favored 'General case' 0 N--CA 1.534 3.752 0 CA-C-N 119.297 0.953 . . . . 0.0 111.514 178.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 541' ' ' LEU . . . . . 0.67 HD11 HG11 ' A' ' 58' ' ' VAL . 0.0 OUTLIER -117.29 -37.4 3.53 Favored 'General case' 0 N--CA 1.52 3.059 0 CA-C-N 119.212 0.914 . . . . 0.0 110.344 -178.662 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 542' ' ' MET . . . . . 0.659 ' N ' HD13 ' B' ' 541' ' ' LEU . 6.7 ptt? -96.95 9.77 41.02 Favored 'General case' 1 N--CA 1.544 4.234 0 CA-C-N 119.618 1.099 . . . . 0.0 112.796 -179.001 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 543' ' ' LEU . . . . . 0.473 ' O ' HG23 ' B' ' 544' ' ' THR . 1.5 tp -132.05 -93.42 0.37 Allowed 'General case' 0 N--CA 1.53 3.547 0 CA-C-N 119.898 1.226 . . . . 0.0 111.995 178.69 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 544' ' ' THR . . . . . 0.577 HG23 ' HB2' ' A' ' 898' ' ' TRP . 1.2 p 147.3 135.7 0.0 OUTLIER Pre-proline 1 N--CA 1.566 5.352 0 C-N-CA 127.101 2.161 . . . . 0.0 107.511 -178.875 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -60.15 -33.98 94.61 Favored 'Trans proline' 0 N--CA 1.519 3.01 0 C-N-CA 122.734 2.289 . . . . 0.0 112.137 178.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -64.47 -34.73 78.89 Favored 'General case' 0 N--CA 1.536 3.864 0 CA-C-O 118.856 -0.592 . . . . 0.0 111.651 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -75.5 -29.78 59.62 Favored 'General case' 0 N--CA 1.524 3.259 0 CA-C-O 117.46 -1.257 . . . . 0.0 111.133 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 548' ' ' ARG . . . . . 0.476 ' HB2' ' HB2' ' A' ' 19' ' ' TRP . 32.9 ptt180 -76.3 -24.44 54.37 Favored 'General case' 0 N--CA 1.532 3.627 0 CA-C-N 120.238 1.381 . . . . 0.0 109.152 175.302 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -64.29 -43.25 95.35 Favored 'General case' 0 N--CA 1.536 3.855 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 173.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -73.02 -21.66 60.78 Favored 'General case' 0 N--CA 1.517 2.904 0 CA-C-O 117.104 -1.427 . . . . 0.0 110.649 176.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 551' ' ' LEU . . . . . 0.681 HD22 ' CZ3' ' A' ' 19' ' ' TRP . 10.9 tp -75.29 -23.39 57.38 Favored 'General case' 0 N--CA 1.521 3.095 0 CA-C-N 120.287 1.403 . . . . 0.0 107.909 174.711 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -73.71 -59.57 4.02 Favored Glycine 0 N--CA 1.499 2.889 0 N-CA-C 108.67 -1.772 . . . . 0.0 108.67 178.381 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 1.7 t -65.17 -26.13 68.03 Favored 'General case' 0 N--CA 1.535 3.813 0 CA-C-N 117.95 0.875 . . . . 0.0 111.363 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 45.7 mtt180 -62.2 -52.99 61.56 Favored 'General case' 1 N--CA 1.543 4.195 0 N-CA-C 107.063 -1.458 . . . . 0.0 107.063 176.227 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 555' ' ' VAL . . . . . 0.488 HG21 ' HB2' ' A' ' 22' ' ' PHE . 18.0 t -71.96 -14.91 17.78 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.547 0 CA-C-O 118.15 -0.929 . . . . 0.0 110.553 178.787 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 76.1 mtt-85 -77.56 -46.76 21.29 Favored 'General case' 0 N--CA 1.527 3.382 0 CA-C-N 119.88 1.218 . . . . 0.0 110.725 178.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 557' ' ' ILE . . . . . 0.561 ' O ' HD13 ' B' ' 561' ' ' LEU . 0.0 OUTLIER -72.15 -23.98 22.1 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.669 0 CA-C-N 119.622 1.101 . . . . 0.0 110.524 -177.712 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 558' ' ' VAL . . . . . 0.469 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -87.1 -53.21 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.871 0 CA-C-N 119.943 1.247 . . . . 0.0 107.698 179.941 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -58.56 -24.64 61.21 Favored 'General case' 0 N--CA 1.533 3.675 0 CA-C-O 118.516 -0.754 . . . . 0.0 110.969 178.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -91.25 -27.34 18.51 Favored 'General case' 0 N--CA 1.525 3.282 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.385 178.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 561' ' ' LEU . . . . . 0.561 HD13 ' O ' ' B' ' 557' ' ' ILE . 1.9 mp -69.57 -43.93 71.87 Favored 'General case' 1 N--CA 1.541 4.108 0 CA-C-N 119.409 1.004 . . . . 0.0 109.156 178.775 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 42.7 mt -58.29 -21.62 49.6 Favored 'General case' 0 N--CA 1.537 3.897 0 C-N-CA 123.762 0.825 . . . . 0.0 112.226 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 12.3 mmm180 -80.23 -47.94 13.85 Favored 'General case' 0 N--CA 1.53 3.567 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 67.08 38.57 92.53 Favored Glycine 1 N--CA 1.525 4.613 0 CA-C-O 118.783 -1.009 . . . . 0.0 113.647 177.315 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -97.76 -57.36 2.25 Favored 'General case' 0 N--CA 1.517 2.908 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 178.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 16.3 ptt? -170.52 79.52 0.09 Allowed 'General case' 0 N--CA 1.536 3.839 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 178.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 75.7 m -137.4 3.67 2.59 Favored 'General case' 0 N--CA 1.516 2.826 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -176.367 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -88.88 -76.51 0.4 Allowed 'General case' 0 N--CA 1.524 3.247 0 CA-C-N 119.981 1.264 . . . . 0.0 111.583 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.97 -33.85 17.08 Favored 'General case' 0 N--CA 1.532 3.675 0 CA-C-N 118.995 0.816 . . . . 0.0 112.879 -177.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -83.49 -3.5 57.67 Favored 'General case' 0 N--CA 1.522 3.138 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -178.204 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 571' ' ' LEU . . . . . 0.684 HD23 HD11 ' B' ' 582' ' ' ILE . 24.2 tp -82.5 -45.47 14.66 Favored 'General case' 0 N--CA 1.53 3.532 0 CA-C-N 119.744 1.156 . . . . 0.0 111.507 -178.761 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -41.43 -32.4 0.32 Allowed 'General case' 1 N--CA 1.55 4.536 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -177.796 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -73.51 -40.34 64.14 Favored 'General case' 0 N--CA 1.532 3.647 0 CA-C-N 118.454 0.57 . . . . 0.0 111.393 -177.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -51.69 -61.56 2.18 Favored 'General case' 0 N--CA 1.53 3.53 0 C-N-CA 123.989 0.916 . . . . 0.0 113.191 -178.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -114.77 -50.98 2.76 Favored 'General case' 0 N--CA 1.536 3.827 0 CA-C-N 118.718 0.69 . . . . 0.0 110.934 -179.098 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 130.91 80.3 0.21 Allowed Glycine 1 N--CA 1.518 4.154 0 N-CA-C 109.988 -1.245 . . . . 0.0 109.988 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -136.6 99.77 4.16 Favored 'General case' 0 N--CA 1.52 3.041 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 178.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -41.32 168.24 0.01 OUTLIER Glycine 1 N--CA 1.541 5.653 0 C-N-CA 124.952 1.263 . . . . 0.0 115.319 -176.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 579' ' ' ILE . . . . . 0.636 HD13 ' CG2' ' B' ' 582' ' ' ILE . 0.6 OUTLIER -80.51 -22.37 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.108 0 CA-C-N 118.273 1.036 . . . . 0.0 108.453 178.625 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 580' ' ' ALA . . . . . 0.833 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -67.08 -39.86 86.87 Favored 'General case' 0 N--CA 1.53 3.561 0 CA-C-N 119.619 1.099 . . . . 0.0 110.139 177.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.33 -39.14 33.51 Favored 'General case' 1 N--CA 1.544 4.248 0 CA-C-N 118.759 0.709 . . . . 0.0 112.027 -179.832 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 582' ' ' ILE . . . . . 0.684 HD11 HD23 ' B' ' 571' ' ' LEU . 2.0 tt -65.53 -36.99 78.95 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.502 0 C-N-CA 123.502 0.721 . . . . 0.0 111.597 -176.2 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 69.9 p -96.92 -31.75 12.4 Favored 'General case' 0 N--CA 1.512 2.672 0 CA-C-O 118.175 -0.917 . . . . 0.0 111.132 -178.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 20.9 ptt180 -70.17 -21.39 63.06 Favored 'General case' 0 N--CA 1.535 3.789 0 CA-C-N 119.613 1.097 . . . . 0.0 109.424 175.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -68.1 -35.36 83.41 Favored Glycine 1 N--CA 1.519 4.21 0 N-CA-C 108.046 -2.022 . . . . 0.0 108.046 174.714 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 5.5 t -61.77 -41.27 97.48 Favored 'General case' 1 N--CA 1.54 4.028 0 CA-C-N 117.701 0.75 . . . . 0.0 110.226 177.094 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -59.65 -23.2 62.84 Favored 'General case' 1 N--CA 1.541 4.099 0 C-N-CA 123.528 0.731 . . . . 0.0 112.157 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 75.3 m -62.12 -46.68 87.96 Favored 'General case' 0 N--CA 1.535 3.797 0 C-N-CA 123.535 0.734 . . . . 0.0 110.828 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 52.3 mt -59.96 -49.41 77.77 Favored 'General case' 0 N--CA 1.524 3.256 0 C-N-CA 124.206 1.002 . . . . 0.0 111.505 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -54.63 -26.31 32.18 Favored 'General case' 1 N--CA 1.547 4.397 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -178.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -86.76 -43.44 12.54 Favored 'General case' 0 N--CA 1.515 2.823 0 CA-C-N 118.395 0.543 . . . . 0.0 110.328 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -57.72 161.8 5.86 Favored Pre-proline 1 N--CA 1.54 4.066 0 CA-C-O 118.247 -0.882 . . . . 0.0 112.545 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -80.08 162.38 23.23 Favored 'Trans proline' 0 C--N 1.378 2.13 0 C-N-CA 121.918 1.745 . . . . 0.0 110.779 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -83.72 -25.87 7.6 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.894 0 CA-C-O 117.471 -1.252 . . . . 0.0 112.077 -178.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -63.6 -41.2 98.35 Favored 'General case' 0 N--CA 1.519 2.993 0 CA-C-N 120.428 1.467 . . . . 0.0 110.398 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 596' ' ' LEU . . . . . 0.483 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.8 mp -98.83 -14.82 19.49 Favored 'General case' 0 N--CA 1.514 2.745 0 C-N-CA 123.557 0.743 . . . . 0.0 111.636 178.454 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -32.42 74.06 Favored 'General case' 1 N--CA 1.542 4.171 0 N-CA-C 102.807 -3.034 . . . . 0.0 102.807 166.8 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -57.12 -36.34 70.54 Favored 'General case' 0 N--CA 1.517 2.875 0 C-N-CA 124.885 1.274 . . . . 0.0 110.796 175.004 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 599' ' ' TRP . . . . . 0.601 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 44.2 t90 -61.13 -36.12 78.9 Favored 'General case' 0 N--CA 1.536 3.872 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 177.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 10.3 mp -56.58 -38.94 72.67 Favored 'General case' 1 N--CA 1.544 4.255 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 176.537 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -68.39 -29.88 68.68 Favored 'General case' 0 N--CA 1.537 3.885 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 175.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 602' ' ' GLU . . . . . 0.419 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.6 OUTLIER -69.14 -26.63 64.98 Favored 'General case' 1 N--CA 1.542 4.142 0 C-N-CA 124.411 1.084 . . . . 0.0 110.595 176.622 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' B' B ' 603' ' ' VAL . . . . . 0.546 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.0 OUTLIER -103.87 -14.33 8.56 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.639 0 CA-C-O 117.85 -1.071 . . . . 0.0 112.262 -175.962 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 7.0 mp -92.13 -57.53 2.68 Favored 'General case' 0 N--CA 1.522 3.156 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 173.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 6.1 mp -93.31 -99.85 0.14 Allowed 'General case' 0 N--CA 1.521 3.105 0 CA-C-O 117.693 -1.146 . . . . 0.0 108.159 177.632 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt 178.17 -50.39 0.01 OUTLIER 'General case' 1 N--CA 1.544 4.229 0 CA-C-N 120.487 1.494 . . . . 0.0 109.588 178.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 68.4 m . . . . . 0 N--CA 1.527 3.393 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.065 -179.472 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 898' ' ' TRP . . . . . 0.577 ' HB2' HG23 ' B' ' 544' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.135 0 CA-C-O 117.879 -1.058 . . . . 0.0 109.356 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.509 2.478 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.424 -9.396 4 C4'-C3'-C2' 116.749 13.549 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.42 -9.834 3 O4'-C1'-N19 120.098 15.372 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.425 -9.284 4 O4'-C1'-N19 119.103 14.128 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . 0.512 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 5 C3'--C2' 1.421 -9.718 4 O4'-C1'-N19 120.381 15.726 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' E' E ' 5' ' ' ' DC' . . . . . 0.468 ' H41' ' HA ' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.411 -10.687 5 O4'-C1'-N19 118.823 13.779 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.401 -11.733 5 O4'-C1'-N19 119.234 14.293 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' E' E ' 7' ' ' ' DA' . . . . . 0.535 H2'' " H5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.396 -12.219 3 C4'-C3'-C2' 112.975 9.775 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' E' E ' 8' ' ' ' DG' . . . . . 0.535 " H5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 O3'--C3' 1.563 10.149 3 O4'-C1'-N19 119.407 14.508 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.407 -11.137 4 O4'-C1'-N19 118.228 13.035 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.471 3 C4'-C3'-C2' 116.811 13.611 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.412 -10.616 4 O4'-C1'-N19 118.86 13.825 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.407 -11.149 5 O4'-C1'-N19 119.47 14.587 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' E' E ' 13' ' ' ' DC' . . . . . 0.512 H2'' " O5'" ' E' ' 14' ' ' ' DT' . . . . . . . . 6 O3'--C3' 1.55 9.173 3 O4'-C1'-N19 119.869 15.087 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' E' E ' 14' ' ' ' DT' . . . . . 0.661 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.405 -11.256 6 O4'-C1'-N19 119.866 15.082 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' E' E ' 15' ' ' ' DA' . . . . . 0.811 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.413 -10.495 4 O4'-C1'-N19 120.223 15.529 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' E' E ' 16' ' ' ' DG' . . . . . 0.413 ' O6 ' HG22 ' A' ' 79' ' ' ILE . . . . . . . . 5 C3'--C2' 1.416 -10.168 4 O4'-C1'-N19 120.087 15.359 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.566 10.369 4 O4'-C1'-N19 120.291 15.614 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.567 5 O4'-C1'-N19 120.299 15.624 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.496 5 O4'-C1'-N19 120.593 15.992 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.51 6.903 4 O4'-C1'-N19 119.186 14.232 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.565 10.308 2 O4'-C1'-N19 119.716 14.895 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.573 10.958 5 O4'-C1'-N19 119.363 14.453 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.275 5 O4'-C1'-N19 120.39 15.737 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' F' F ' 4' ' ' ' DA' . . . . . 0.613 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.416 -10.216 5 O4'-C1'-N19 119.779 14.974 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' F' F ' 5' ' ' ' DC' . . . . . 0.547 ' H41' ' HA ' ' A' ' 80' ' ' ALA . . . . . . . . 5 O3'--C3' 1.573 10.923 4 O4'-C1'-N19 118.451 13.313 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.407 -11.062 4 O4'-C1'-N19 119.253 14.316 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.412 -11.613 4 N19-C1'-C2' 129.516 9.572 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.392 4 O4'-C1'-N19 119.46 14.575 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -10.956 4 O4'-C1'-N19 120.477 15.847 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.406 -11.249 4 O4'-C1'-N19 119.042 14.053 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.176 4 O4'-C1'-N19 119.873 15.092 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.42 -9.835 2 O4'-C1'-N19 119.506 14.633 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.204 4 O4'-C1'-N19 119.283 14.353 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' F' F ' 14' ' ' ' DT' . . . . . 0.614 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 O3'--C3' 1.566 10.413 3 O4'-C1'-N19 119.201 14.251 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' F' F ' 15' ' ' ' DA' . . . . . 0.848 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.415 -10.265 6 O4'-C1'-N19 119.294 14.368 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.415 -10.273 6 O4'-C1'-N19 120.203 15.504 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.949 4 O4'-C1'-N19 118.983 13.979 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.563 4 O4'-C1'-N19 119.92 15.15 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.746 4 O4'-C1'-N19 119.97 15.213 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 O4'--C1' 1.514 7.199 4 O4'-C1'-N19 119.046 14.058 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 . . . . . 0 N--CA 1.5 2.074 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 58.0 m -105.49 112.36 64.76 Favored Pre-proline 0 N--CA 1.515 2.786 0 CA-C-O 117.862 -1.066 . . . . 0.0 108.813 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -66.73 -35.45 28.09 Favored 'Trans proline' 0 C--N 1.391 2.807 0 C-N-CA 122.17 1.913 . . . . 0.0 111.373 178.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -104.81 133.41 49.67 Favored 'General case' 0 N--CA 1.526 3.364 0 C-N-CA 123.575 0.75 . . . . 0.0 109.994 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 37.4 p -134.79 -52.76 0.8 Allowed 'General case' 0 N--CA 1.527 3.404 0 C-N-CA 123.363 0.665 . . . . 0.0 109.3 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -132.28 155.93 47.45 Favored 'General case' 0 N--CA 1.524 3.271 0 C-N-CA 123.308 0.643 . . . . 0.0 111.074 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.25 134.75 42.66 Favored 'General case' 0 N--CA 1.532 3.653 0 C-N-CA 122.732 0.413 . . . . 0.0 110.764 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 25.9 ttm -115.18 133.92 55.61 Favored 'General case' 0 N--CA 1.525 3.319 0 C-N-CA 123.074 0.55 . . . . 0.0 110.592 -179.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 59.94 158.39 0.03 OUTLIER 'General case' 1 N--CA 1.539 4.016 0 C-N-CA 124.553 1.141 . . . . 0.0 113.356 178.621 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -115.01 138.56 50.72 Favored 'General case' 0 N--CA 1.524 3.247 0 C-N-CA 123.476 0.71 . . . . 0.0 109.858 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -91.81 115.45 28.07 Favored 'General case' 0 N--CA 1.52 3.04 0 N-CA-C 107.52 -1.289 . . . . 0.0 107.52 178.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 78.1 mtm180 -106.75 125.52 51.11 Favored 'General case' 0 N--CA 1.521 3.106 0 C-N-CA 122.8 0.44 . . . . 0.0 109.86 -178.062 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 23.1 m-70 -115.35 98.2 6.61 Favored 'General case' 0 N--CA 1.52 3.029 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 179.029 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -112.62 -38.91 4.47 Favored 'General case' 0 N--CA 1.522 3.171 0 CA-C-O 118.699 -0.667 . . . . 0.0 112.174 -176.498 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -124.37 -88.21 0.61 Allowed 'General case' 0 N--CA 1.527 3.408 0 CA-C-N 118.496 0.589 . . . . 0.0 112.289 -176.267 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.535 ' CZ3' HD22 ' B' ' 551' ' ' LEU . 73.0 t-105 -51.18 -43.97 61.43 Favored 'General case' 1 N--CA 1.54 4.074 0 CA-C-N 119.193 0.906 . . . . 0.0 111.215 -178.548 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.473 ' N ' HD22 ' A' ' 20' ' ' LEU . 3.0 mm? -83.77 -23.29 31.58 Favored 'General case' 0 N--CA 1.517 2.893 0 CA-C-O 117.542 -1.218 . . . . 0.0 111.695 -176.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -58.4 -28.74 65.49 Favored 'General case' 0 N--CA 1.536 3.868 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 173.327 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.583 ' CG ' HD21 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -85.5 -36.14 20.73 Favored 'General case' 0 N--CA 1.504 2.232 0 CA-C-O 115.766 -2.064 . . . . 0.0 109.347 174.068 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 48.6 t -71.24 -27.47 29.42 Favored 'Isoleucine or valine' 1 N--CA 1.576 5.833 0 CA-C-N 121.762 2.074 . . . . 0.0 112.754 -175.276 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -77.39 -50.1 13.48 Favored 'General case' 0 N--CA 1.533 3.718 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 179.066 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.416 HD11 ' HB ' ' B' ' 603' ' ' VAL . 0.6 OUTLIER -62.65 -25.45 68.13 Favored 'General case' 0 N--CA 1.539 3.996 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 174.996 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.428 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -70.06 -38.66 75.84 Favored 'General case' 0 N--CA 1.517 2.885 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 178.093 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.1 tttt -64.36 -22.57 67.0 Favored 'General case' 0 N--CA 1.527 3.388 0 CA-C-O 118.452 -0.785 . . . . 0.0 111.049 177.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -72.27 -39.66 68.19 Favored 'General case' 0 N--CA 1.53 3.564 0 CA-C-N 119.003 0.82 . . . . 0.0 108.868 176.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.633 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -91.05 -6.33 54.02 Favored 'General case' 0 N--CA 1.506 2.332 0 CA-C-O 118.573 -0.727 . . . . 0.0 110.793 177.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.04 -33.86 26.38 Favored 'General case' 0 N--CA 1.533 3.69 0 CA-C-N 120.41 1.459 . . . . 0.0 109.005 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -65.11 -42.66 93.77 Favored 'General case' 0 N--CA 1.531 3.604 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 176.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 63.3 m-80 -86.87 -89.35 0.12 Allowed 'General case' 0 N--CA 1.516 2.864 0 N-CA-C 106.563 -1.643 . . . . 0.0 106.563 176.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 150.54 52.47 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.909 0 C-N-CA 128.013 2.525 . . . . 0.0 107.959 177.4 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.467 HD22 ' CD2' ' B' ' 596' ' ' LEU . 6.9 mt -114.62 11.88 17.07 Favored 'General case' 0 N--CA 1.527 3.384 0 C-N-CA 124.698 1.199 . . . . 0.0 110.245 -178.702 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.52 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 46.8 p-80 -80.61 0.85 32.28 Favored 'General case' 0 N--CA 1.51 2.556 0 C-N-CA 123.505 0.722 . . . . 0.0 109.225 175.634 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.765 ' HA ' HD23 ' A' ' 39' ' ' LEU . 22.4 mt -93.06 -50.82 0.27 Allowed Pre-proline 0 N--CA 1.511 2.592 0 CA-C-O 116.971 -1.49 . . . . 0.0 109.207 -175.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.456 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 7.6 Cg_exo -61.34 -35.16 85.46 Favored 'Trans proline' 0 C--N 1.396 3.068 0 N-CA-C 106.425 -2.183 . . . . 0.0 106.425 170.519 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.432 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 2.1 tm? -64.76 -39.21 93.24 Favored 'General case' 0 N--CA 1.512 2.645 0 C-N-CA 124.057 0.943 . . . . 0.0 109.974 176.523 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.765 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -72.08 -22.53 61.35 Favored 'General case' 1 N--CA 1.546 4.372 0 CA-C-N 119.533 1.06 . . . . 0.0 111.791 -179.862 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -96.31 21.82 8.56 Favored 'General case' 1 N--CA 1.539 4.003 0 CA-C-N 119.926 1.239 . . . . 0.0 110.049 176.454 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.614 HD13 ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -127.08 -45.63 1.55 Allowed 'General case' 0 N--CA 1.519 2.993 0 CA-C-O 118.056 -0.973 . . . . 0.0 109.361 179.763 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.614 ' N ' HD13 ' A' ' 41' ' ' LEU . 9.9 ptt? -116.86 11.01 14.32 Favored 'General case' 1 N--CA 1.551 4.618 0 CA-C-N 119.711 1.142 . . . . 0.0 112.32 179.521 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.7 mp -122.86 -94.05 0.5 Allowed 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 177.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 157.31 169.28 0.02 OUTLIER Pre-proline 1 N--CA 1.566 5.358 0 C-N-CA 125.476 1.511 . . . . 0.0 110.041 178.894 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -69.0 -37.73 10.56 Favored 'Trans proline' 0 C--N 1.39 2.735 0 C-N-CA 122.066 1.844 . . . . 0.0 107.586 172.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -66.19 -18.57 65.43 Favored 'General case' 0 N--CA 1.527 3.395 0 CA-C-O 117.942 -1.027 . . . . 0.0 110.895 176.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -71.09 -37.57 72.41 Favored 'General case' 0 N--CA 1.529 3.478 0 CA-C-N 119.613 1.097 . . . . 0.0 108.613 178.112 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -84.91 -15.89 42.96 Favored 'General case' 0 N--CA 1.531 3.582 0 CA-C-O 118.117 -0.944 . . . . 0.0 109.826 175.009 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -73.07 -29.43 62.95 Favored 'General case' 0 N--CA 1.525 3.291 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 173.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.561 ' HB1' ' NH1' ' A' ' 54' ' ' ARG . . . -88.01 -36.28 17.1 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-O 117.918 -1.039 . . . . 0.0 109.725 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.46 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 23.1 tp -69.75 -22.8 63.33 Favored 'General case' 0 N--CA 1.537 3.879 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 173.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.439 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -67.47 -73.36 0.67 Allowed Glycine 0 N--CA 1.496 2.7 0 C-N-CA 125.294 1.426 . . . . 0.0 111.277 177.479 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.9 m -72.06 -24.56 61.54 Favored 'General case' 0 N--CA 1.536 3.86 0 CA-C-O 118.144 -0.932 . . . . 0.0 112.785 -177.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.561 ' NH1' ' HB1' ' A' ' 50' ' ' ALA . 76.9 mtm-85 -68.15 -50.27 55.63 Favored 'General case' 0 N--CA 1.531 3.593 0 CA-C-N 120.074 1.306 . . . . 0.0 107.628 177.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 51' ' ' LEU . 11.5 t -65.98 -17.9 23.06 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.823 0 CA-C-O 118.217 -0.897 . . . . 0.0 109.88 177.022 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.7 mtt-85 -69.08 -56.92 6.24 Favored 'General case' 0 N--CA 1.529 3.515 0 CA-C-N 119.741 1.155 . . . . 0.0 111.444 177.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.421 HG22 HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -68.9 -25.63 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.757 0 CA-C-N 119.825 1.193 . . . . 0.0 112.087 -177.076 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -83.71 -53.54 11.02 Favored 'Isoleucine or valine' 1 N--CA 1.549 4.517 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 -179.653 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -61.6 -18.73 60.58 Favored 'General case' 0 N--CA 1.527 3.392 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.063 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -96.56 -23.26 16.61 Favored 'General case' 0 N--CA 1.526 3.344 0 CA-C-O 118.174 -0.917 . . . . 0.0 110.305 176.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.6 mt -75.76 -51.74 11.99 Favored 'General case' 0 N--CA 1.534 3.758 0 CA-C-N 119.535 1.062 . . . . 0.0 108.979 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 36.1 mt -54.32 -26.4 29.4 Favored 'General case' 0 N--CA 1.538 3.953 0 C-N-CA 124.163 0.985 . . . . 0.0 113.293 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 30.1 mmm180 -77.86 -45.68 23.58 Favored 'General case' 0 N--CA 1.531 3.584 0 CA-C-N 118.755 0.707 . . . . 0.0 111.278 -178.083 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.15 56.51 2.41 Favored Glycine 0 N--CA 1.515 3.96 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -98.71 -40.27 8.24 Favored 'General case' 0 N--CA 1.526 3.364 0 CA-C-O 118.713 -0.66 . . . . 0.0 110.074 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 76.8 mtp 121.18 69.0 0.0 OUTLIER 'General case' 1 N--CA 1.544 4.264 0 C-N-CA 128.075 2.55 . . . . 0.0 104.997 -178.669 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.419 ' HB3' HD22 ' A' ' 71' ' ' LEU . 23.4 m -117.8 38.48 3.62 Favored 'General case' 0 N--CA 1.52 3.03 0 CA-C-N 115.109 -0.951 . . . . 0.0 110.771 -177.306 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -113.16 -46.38 3.09 Favored 'General case' 0 N--CA 1.521 3.107 0 C-N-CA 123.751 0.82 . . . . 0.0 110.194 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -104.49 -56.59 2.16 Favored 'General case' 0 N--CA 1.528 3.429 0 C-N-CA 123.547 0.739 . . . . 0.0 110.968 -178.144 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -75.28 -0.18 18.73 Favored 'General case' 0 N--CA 1.519 2.983 0 N-CA-C 114.063 1.135 . . . . 0.0 114.063 -176.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.582 HD23 HG21 ' A' ' 82' ' ' ILE . 24.6 tp -85.35 -47.06 10.38 Favored 'General case' 0 N--CA 1.527 3.392 0 CA-C-N 119.906 1.23 . . . . 0.0 112.458 -178.745 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -42.65 -30.58 0.38 Allowed 'General case' 1 N--CA 1.552 4.635 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 -176.739 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -71.86 -41.13 68.44 Favored 'General case' 0 N--CA 1.535 3.793 0 CA-C-N 118.829 0.74 . . . . 0.0 111.234 -178.487 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -47.57 -53.35 14.83 Favored 'General case' 0 N--CA 1.533 3.702 0 C-N-CA 125.078 1.351 . . . . 0.0 113.438 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.1 pp -125.06 -39.67 2.22 Favored 'General case' 0 N--CA 1.536 3.85 0 CA-C-O 118.717 -0.659 . . . . 0.0 111.938 -178.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 112.72 64.78 0.47 Allowed Glycine 1 N--CA 1.523 4.487 0 CA-C-N 118.976 0.807 . . . . 0.0 111.621 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -127.48 108.95 11.26 Favored 'General case' 0 N--CA 1.523 3.211 0 N-CA-C 106.047 -1.835 . . . . 0.0 106.047 176.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -34.65 165.37 0.01 OUTLIER Glycine 1 N--CA 1.536 5.356 0 C-N-CA 125.863 1.696 . . . . 0.0 116.658 -176.171 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.613 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.3 OUTLIER -78.64 -23.67 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.903 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 177.89 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.811 ' HB2' ' H62' ' E' ' 15' ' ' ' DA' . . . -61.85 -34.37 75.85 Favored 'General case' 0 N--CA 1.521 3.076 0 CA-C-O 117.689 -1.148 . . . . 0.0 109.835 177.345 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 17.8 p -74.89 -56.62 4.57 Favored 'General case' 0 N--CA 1.53 3.568 0 CA-C-N 119.342 0.974 . . . . 0.0 111.965 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.582 HG21 HD23 ' A' ' 71' ' ' LEU . 0.5 OUTLIER -62.06 -24.54 34.88 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.173 0 CA-C-O 118.174 -0.917 . . . . 0.0 113.469 -176.829 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 71.9 p -101.07 -26.27 13.76 Favored 'General case' 0 N--CA 1.51 2.567 0 CA-C-O 117.955 -1.021 . . . . 0.0 110.913 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 26.2 ptt180 -75.77 -22.83 56.07 Favored 'General case' 0 N--CA 1.535 3.806 0 CA-C-N 119.82 1.191 . . . . 0.0 108.545 174.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -68.15 -32.22 76.09 Favored Glycine 0 N--CA 1.516 3.979 0 N-CA-C 109.043 -1.623 . . . . 0.0 109.043 175.154 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 6.6 t -63.68 -31.5 72.69 Favored 'General case' 0 N--CA 1.536 3.869 0 CA-C-N 118.18 0.99 . . . . 0.0 110.117 177.063 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -59.65 -33.41 71.5 Favored 'General case' 1 N--CA 1.545 4.291 0 C-N-CA 123.604 0.762 . . . . 0.0 110.311 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.15 -31.98 73.44 Favored 'General case' 0 N--CA 1.538 3.932 0 C-N-CA 123.791 0.837 . . . . 0.0 111.3 179.564 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 38.8 mt -57.26 -44.21 83.7 Favored 'General case' 0 N--CA 1.531 3.619 0 C-N-CA 123.759 0.824 . . . . 0.0 111.232 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -65.99 -20.29 66.14 Favored 'General case' 0 N--CA 1.537 3.921 0 CA-C-O 118.193 -0.908 . . . . 0.0 112.901 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.57 -32.06 18.32 Favored 'General case' 0 N--CA 1.523 3.183 0 CA-C-N 119.323 0.965 . . . . 0.0 113.133 -178.197 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.87 153.23 88.84 Favored Pre-proline 1 N--CA 1.54 4.07 0 CA-C-O 118.087 -0.959 . . . . 0.0 113.527 -178.218 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -87.41 171.59 6.29 Favored 'Trans proline' 0 C--N 1.387 2.576 0 C-N-CA 122.695 2.263 . . . . 0.0 111.084 177.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.4 t -87.76 -27.22 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.306 0 CA-C-O 117.803 -1.094 . . . . 0.0 111.216 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -62.14 -41.4 98.23 Favored 'General case' 0 N--CA 1.518 2.942 0 CA-C-N 120.187 1.358 . . . . 0.0 109.598 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.508 ' CD2' HD22 ' B' ' 534' ' ' LEU . 6.8 mp -98.84 -9.96 23.59 Favored 'General case' 0 N--CA 1.507 2.417 0 C-N-CA 123.569 0.748 . . . . 0.0 111.666 178.357 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -35.99 82.75 Favored 'General case' 1 N--CA 1.545 4.298 0 N-CA-C 102.528 -3.138 . . . . 0.0 102.528 166.894 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -52.6 -35.25 53.95 Favored 'General case' 0 N--CA 1.52 3.036 0 C-N-CA 124.316 1.047 . . . . 0.0 111.499 175.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.614 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 43.1 t90 -67.68 -39.26 84.49 Favored 'General case' 0 N--CA 1.53 3.563 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 177.13 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.403 ' O ' HD13 ' A' ' 104' ' ' LEU . 10.4 mp -55.61 -30.13 60.35 Favored 'General case' 0 N--CA 1.536 3.853 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 176.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -74.3 -37.79 63.55 Favored 'General case' 0 N--CA 1.532 3.652 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 175.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.59 -21.4 65.59 Favored 'General case' 0 N--CA 1.535 3.797 0 CA-C-O 118.325 -0.845 . . . . 0.0 111.581 177.338 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.5 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -119.73 -8.14 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.838 0 CA-C-O 117.884 -1.055 . . . . 0.0 113.247 -176.131 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.403 HD13 ' O ' ' A' ' 100' ' ' LEU . 8.2 mp -105.68 -51.31 3.02 Favored 'General case' 0 N--CA 1.531 3.602 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 176.192 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.0 tt -65.02 -47.62 76.79 Favored 'General case' 0 N--CA 1.536 3.855 0 C-N-CA 124.141 0.976 . . . . 0.0 110.381 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 37.8 tttm -67.2 -49.31 65.07 Favored 'General case' 0 N--CA 1.533 3.686 0 C-N-CA 122.997 0.519 . . . . 0.0 111.551 -178.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 7.0 t . . . . . 0 N--CA 1.526 3.353 0 CA-C-O 118.09 -0.957 . . . . 0.0 110.035 -179.432 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 . . . . . 0 N--CA 1.511 2.579 0 CA-C-O 118.523 -0.751 . . . . 0.0 111.801 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 73.7 m -69.73 135.39 88.0 Favored Pre-proline 0 N--CA 1.532 3.65 0 CA-C-O 117.51 -1.233 . . . . 0.0 110.468 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -75.09 -41.53 0.63 Allowed 'Trans proline' 0 C--N 1.384 2.43 0 C-N-CA 122.822 2.348 . . . . 0.0 112.211 -178.029 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 84.74 -67.59 0.04 OUTLIER 'General case' 0 N--CA 1.538 3.934 0 C-N-CA 125.976 1.71 . . . . 0.0 107.651 -176.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 50.8 m 63.32 140.99 0.02 OUTLIER 'General case' 0 N--CA 1.535 3.784 0 C-N-CA 124.806 1.242 . . . . 0.0 112.034 178.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -120.87 -51.54 2.13 Favored 'General case' 0 N--CA 1.521 3.123 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -146.72 -51.45 0.21 Allowed 'General case' 0 N--CA 1.52 3.063 0 C-N-CA 122.954 0.502 . . . . 0.0 110.082 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 21.6 mtp -95.02 120.96 36.12 Favored 'General case' 0 N--CA 1.52 3.033 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -137.28 -52.49 0.67 Allowed 'General case' 0 N--CA 1.521 3.091 0 C-N-CA 123.156 0.582 . . . . 0.0 109.547 -179.508 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -100.04 -56.56 2.34 Favored 'General case' 0 N--CA 1.52 3.039 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.234 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -168.24 -88.78 0.01 OUTLIER 'General case' 0 N--CA 1.536 3.84 0 CA-C-O 118.461 -0.781 . . . . 0.0 111.076 179.446 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 16.8 tpp180 65.59 116.59 0.03 OUTLIER 'General case' 0 N--CA 1.536 3.846 0 CA-C-N 119.714 1.143 . . . . 0.0 109.487 -178.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -102.79 134.89 45.44 Favored 'General case' 0 N--CA 1.527 3.4 0 C-N-CA 123.225 0.61 . . . . 0.0 110.704 -178.15 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -112.46 134.87 53.76 Favored 'General case' 0 N--CA 1.529 3.498 0 C-N-CA 123.36 0.664 . . . . 0.0 109.94 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -127.37 -66.03 0.91 Allowed 'General case' 0 N--CA 1.524 3.259 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 519' ' ' TRP . . . . . 0.66 ' CE2' HD22 ' A' ' 39' ' ' LEU . 71.0 t-105 -42.81 -28.33 0.24 Allowed 'General case' 1 N--CA 1.552 4.639 0 C-N-CA 124.388 1.075 . . . . 0.0 113.685 -179.694 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 520' ' ' LEU . . . . . 0.573 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.2 mm? -96.09 -29.92 13.83 Favored 'General case' 0 N--CA 1.527 3.392 0 CA-C-O 117.895 -1.05 . . . . 0.0 113.449 -172.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 23.3 mtp180 -62.23 -26.17 68.23 Favored 'General case' 1 N--CA 1.54 4.055 0 N-CA-C 105.485 -2.043 . . . . 0.0 105.485 171.651 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 522' ' ' PHE . . . . . 0.521 ' O ' HD23 ' B' ' 526' ' ' LEU . 1.8 m-85 -78.11 -39.77 40.33 Favored 'General case' 0 N--CA 1.515 2.8 0 N-CA-C 107.397 -1.334 . . . . 0.0 107.397 174.253 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 37.1 t -66.55 -23.36 31.29 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.259 0 CA-C-N 119.96 1.254 . . . . 0.0 112.493 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -78.01 -52.01 9.45 Favored 'General case' 0 N--CA 1.532 3.654 0 CA-C-N 120.345 1.429 . . . . 0.0 108.19 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 1.2 tp -68.16 -23.04 64.83 Favored 'General case' 0 N--CA 1.53 3.528 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 176.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 526' ' ' LEU . . . . . 0.521 HD23 ' O ' ' B' ' 522' ' ' PHE . 1.7 mm? -71.23 -36.16 71.72 Favored 'General case' 0 N--CA 1.522 3.157 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 176.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 527' ' ' LYS . . . . . 0.462 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 27.3 ttmt -66.21 -21.69 66.32 Favored 'General case' 0 N--CA 1.516 2.872 0 CA-C-O 118.383 -0.818 . . . . 0.0 111.003 177.029 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -72.43 -39.41 67.87 Favored 'General case' 0 N--CA 1.53 3.566 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.211 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 529' ' ' ALA . . . . . 0.614 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -91.63 -7.83 48.94 Favored 'General case' 0 N--CA 1.506 2.362 0 CA-C-O 118.317 -0.849 . . . . 0.0 110.802 177.671 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 530' ' ' TYR . . . . . 0.462 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.6 OUTLIER -81.69 -33.06 31.41 Favored 'General case' 0 N--CA 1.531 3.596 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 177.513 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -54.61 -49.31 70.76 Favored 'General case' 0 N--CA 1.536 3.833 0 C-N-CA 124.557 1.143 . . . . 0.0 108.255 176.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -93.38 -85.12 0.28 Allowed 'General case' 0 N--CA 1.515 2.816 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 177.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.9 p30 153.53 45.83 0.0 OUTLIER 'General case' 1 N--CA 1.559 4.989 0 C-N-CA 127.707 2.403 . . . . 0.0 108.44 177.537 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 534' ' ' LEU . . . . . 0.508 HD22 ' CD2' ' A' ' 96' ' ' LEU . 6.3 mt -103.26 13.31 34.16 Favored 'General case' 0 N--CA 1.518 2.953 0 C-N-CA 124.854 1.262 . . . . 0.0 110.068 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 535' ' ' HIS . . . . . 0.579 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 37.1 p-80 -84.37 4.15 32.63 Favored 'General case' 0 N--CA 1.512 2.657 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 174.763 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 536' ' ' LEU . . . . . 0.455 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 26.9 mt -94.83 -50.79 0.25 Allowed Pre-proline 0 N--CA 1.502 2.128 0 CA-C-O 116.302 -1.809 . . . . 0.0 108.296 -176.205 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 537' ' ' PRO . . . . . 0.455 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 5.7 Cg_exo -67.18 -32.32 34.04 Favored 'Trans proline' 0 C--N 1.4 3.244 0 C-N-CA 122.109 1.873 . . . . 0.0 107.485 170.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 538' ' ' LEU . . . . . 0.466 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 0.3 OUTLIER -65.86 -40.21 91.47 Favored 'General case' 0 N--CA 1.528 3.448 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 174.812 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 7.7 mt -67.76 -23.14 65.2 Favored 'General case' 1 N--CA 1.54 4.067 0 CA-C-O 118.289 -0.863 . . . . 0.0 109.965 176.08 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -76.71 -29.03 56.09 Favored 'General case' 0 N--CA 1.523 3.202 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 177.191 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 5.5 tp -70.84 -43.99 67.36 Favored 'General case' 0 N--CA 1.532 3.63 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 177.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -96.96 47.95 1.05 Allowed 'General case' 0 CA--C 1.61 3.251 0 N-CA-C 101.44 -3.541 . . . . 0.0 101.44 171.183 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -29.34 -91.08 0.0 OUTLIER 'General case' 0 N--CA 1.534 3.766 0 C-N-CA 127.698 2.399 . . . . 0.0 116.246 -171.656 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 544' ' ' THR . . . . . 0.468 HG23 ' HB2' ' A' ' 898' ' ' TRP . 38.0 p 44.08 85.56 0.16 Allowed Pre-proline 0 N--CA 1.531 3.602 0 C-N-CA 124.988 1.315 . . . . 0.0 112.783 -178.181 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -67.43 -27.89 39.49 Favored 'Trans proline' 0 C--N 1.395 2.994 0 C-N-CA 122.417 2.078 . . . . 0.0 110.032 177.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -58.68 -17.45 22.68 Favored 'General case' 0 N--CA 1.538 3.939 0 CA-C-O 118.491 -0.766 . . . . 0.0 111.169 176.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -66.55 -49.69 65.62 Favored 'General case' 0 N--CA 1.527 3.423 0 CA-C-N 119.25 0.932 . . . . 0.0 108.819 178.273 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 24.4 ptt-85 -80.55 -11.62 59.63 Favored 'General case' 0 N--CA 1.522 3.165 0 CA-C-O 118.097 -0.954 . . . . 0.0 112.295 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -72.15 -53.58 12.3 Favored 'General case' 0 N--CA 1.534 3.729 0 N-CA-C 106.533 -1.655 . . . . 0.0 106.533 174.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -82.91 -12.33 57.45 Favored 'General case' 0 N--CA 1.508 2.459 0 CA-C-O 117.301 -1.333 . . . . 0.0 111.926 178.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 551' ' ' LEU . . . . . 0.583 HD21 ' CG ' ' A' ' 22' ' ' PHE . 18.8 tp -82.2 -31.6 30.28 Favored 'General case' 0 N--CA 1.528 3.443 0 CA-C-N 121.088 1.767 . . . . 0.0 107.69 175.173 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -72.3 -53.66 8.69 Favored Glycine 0 N--CA 1.496 2.69 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 178.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 5.3 m -71.03 -28.41 64.37 Favored 'General case' 0 N--CA 1.534 3.741 0 CA-C-O 117.96 -1.019 . . . . 0.0 111.973 -178.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -68.33 -55.24 12.76 Favored 'General case' 1 N--CA 1.543 4.205 0 N-CA-C 106.546 -1.65 . . . . 0.0 106.546 176.2 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 38.3 t -59.07 -18.61 14.02 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.999 0 CA-C-O 117.937 -1.03 . . . . 0.0 110.428 176.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 5.2 mmm180 -79.81 -44.11 21.18 Favored 'General case' 0 N--CA 1.526 3.356 0 CA-C-O 117.436 -1.269 . . . . 0.0 111.862 178.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 557' ' ' ILE . . . . . 0.456 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -72.72 -20.63 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.569 0 CA-C-N 121.365 1.893 . . . . 0.0 110.715 -179.941 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 558' ' ' VAL . . . . . 0.456 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -88.92 -51.04 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.871 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 -179.584 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -60.0 -23.58 63.77 Favored 'General case' 0 N--CA 1.53 3.569 0 CA-C-O 118.892 -0.575 . . . . 0.0 110.483 177.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -95.93 -23.15 17.0 Favored 'General case' 0 N--CA 1.523 3.191 0 CA-C-O 117.875 -1.059 . . . . 0.0 111.151 178.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 6.1 tp -80.84 -60.04 2.45 Favored 'General case' 0 N--CA 1.529 3.496 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 178.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 38.8 mt -39.11 -37.44 0.39 Allowed 'General case' 1 N--CA 1.549 4.482 0 C-N-CA 126.051 1.74 . . . . 0.0 112.415 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 29.6 mmm180 -83.47 -53.41 5.72 Favored 'General case' 0 N--CA 1.519 3.002 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 79.3 54.02 4.2 Favored Glycine 0 N--CA 1.509 3.537 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 178.002 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -83.15 -63.02 1.44 Allowed 'General case' 0 N--CA 1.518 2.954 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 178.235 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 19.0 ttm 176.75 85.29 0.01 OUTLIER 'General case' 1 N--CA 1.539 4.011 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 177.442 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 58.8 m -141.54 36.24 1.65 Allowed 'General case' 0 N--CA 1.518 2.944 0 C-N-CA 122.706 0.403 . . . . 0.0 111.463 -177.164 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -100.4 -47.75 4.8 Favored 'General case' 0 N--CA 1.522 3.157 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 177.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 1.9 mmt-85 -107.91 -31.79 7.85 Favored 'General case' 0 N--CA 1.522 3.159 0 C-N-CA 123.787 0.835 . . . . 0.0 112.059 -178.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -92.77 -13.23 29.53 Favored 'General case' 0 N--CA 1.519 2.994 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 -176.47 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 571' ' ' LEU . . . . . 0.784 HD23 HD11 ' B' ' 582' ' ' ILE . 14.5 tp -75.1 -45.7 39.45 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-N 120.644 1.566 . . . . 0.0 111.348 -177.523 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.79 -33.49 16.69 Favored 'General case' 1 N--CA 1.547 4.421 0 CA-C-N 119.71 1.141 . . . . 0.0 113.208 -179.913 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -64.97 -36.06 83.19 Favored 'General case' 1 N--CA 1.541 4.082 0 C-N-CA 122.93 0.492 . . . . 0.0 111.566 -178.707 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -49.2 -57.55 6.54 Favored 'General case' 0 N--CA 1.53 3.546 0 C-N-CA 124.573 1.149 . . . . 0.0 113.141 -178.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -132.96 -38.91 0.97 Allowed 'General case' 0 N--CA 1.534 3.726 0 CA-C-O 118.526 -0.75 . . . . 0.0 111.848 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 130.7 63.67 0.1 OUTLIER Glycine 1 N--CA 1.52 4.271 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 179.484 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -114.81 98.55 6.91 Favored 'General case' 0 N--CA 1.518 2.934 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -42.16 168.82 0.01 OUTLIER Glycine 1 N--CA 1.541 5.645 0 C-N-CA 125.012 1.292 . . . . 0.0 115.493 -176.496 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 579' ' ' ILE . . . . . 0.512 HG21 ' N6 ' ' E' ' 4' ' ' ' DA' . 1.9 mt -83.66 -14.19 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.335 0 CA-C-O 117.61 -1.186 . . . . 0.0 109.002 178.341 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 580' ' ' ALA . . . . . 0.848 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -69.86 -36.63 75.67 Favored 'General case' 0 N--CA 1.525 3.313 0 CA-C-N 120.091 1.314 . . . . 0.0 108.973 175.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.1 p -79.49 -36.54 38.51 Favored 'General case' 1 N--CA 1.541 4.109 0 CA-C-N 118.924 0.784 . . . . 0.0 111.825 178.608 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 582' ' ' ILE . . . . . 0.784 HD11 HD23 ' B' ' 571' ' ' LEU . 0.8 OUTLIER -69.66 -36.54 71.0 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.414 0 C-N-CA 123.379 0.672 . . . . 0.0 111.736 -175.643 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 81.4 p -99.57 -28.1 13.38 Favored 'General case' 0 N--CA 1.515 2.777 0 CA-C-O 117.974 -1.012 . . . . 0.0 111.396 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 11.1 ptt180 -75.94 -19.41 58.79 Favored 'General case' 0 N--CA 1.531 3.579 0 CA-C-N 120.081 1.309 . . . . 0.0 108.217 174.089 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -62.03 -36.42 92.87 Favored Glycine 1 N--CA 1.517 4.052 0 N-CA-C 108.645 -1.782 . . . . 0.0 108.645 175.515 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 84.3 p -63.3 -36.84 85.0 Favored 'General case' 0 N--CA 1.537 3.89 0 CA-C-N 117.976 0.888 . . . . 0.0 109.792 176.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -56.75 -32.47 65.62 Favored 'General case' 1 N--CA 1.546 4.361 0 C-N-CA 123.638 0.775 . . . . 0.0 111.535 179.094 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 8.7 m -61.39 -41.11 96.59 Favored 'General case' 1 N--CA 1.542 4.174 0 C-N-CA 123.39 0.676 . . . . 0.0 110.527 179.723 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 51.4 mt -58.93 -45.32 90.66 Favored 'General case' 0 N--CA 1.525 3.286 0 C-N-CA 123.907 0.883 . . . . 0.0 111.11 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? -62.0 -24.49 67.07 Favored 'General case' 1 N--CA 1.539 4.005 0 CA-C-O 118.549 -0.739 . . . . 0.0 112.038 179.501 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -78.16 -40.38 38.06 Favored 'General case' 0 N--CA 1.516 2.84 0 CA-C-N 118.729 0.695 . . . . 0.0 110.755 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -65.28 159.24 67.66 Favored Pre-proline 0 N--CA 1.537 3.918 0 CA-C-O 118.535 -0.745 . . . . 0.0 112.673 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -79.42 179.76 6.1 Favored 'Trans proline' 0 C--N 1.381 2.257 0 C-N-CA 122.105 1.87 . . . . 0.0 110.834 178.187 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.2 t -97.25 -27.03 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.083 0 CA-C-O 117.676 -1.154 . . . . 0.0 111.683 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -63.22 -40.52 97.69 Favored 'General case' 0 N--CA 1.515 2.804 0 CA-C-N 120.045 1.293 . . . . 0.0 110.559 -178.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 596' ' ' LEU . . . . . 0.467 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.9 mp -98.76 -15.84 19.17 Favored 'General case' 0 N--CA 1.51 2.56 0 C-N-CA 123.388 0.675 . . . . 0.0 111.76 178.461 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -29.98 69.44 Favored 'General case' 1 N--CA 1.54 4.058 0 N-CA-C 103.328 -2.841 . . . . 0.0 103.328 168.05 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -54.62 -38.24 66.58 Favored 'General case' 0 N--CA 1.52 3.043 0 C-N-CA 124.099 0.96 . . . . 0.0 110.039 174.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 599' ' ' TRP . . . . . 0.633 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 45.1 t90 -63.46 -38.11 89.88 Favored 'General case' 0 N--CA 1.534 3.729 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 176.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.6 -34.87 52.88 Favored 'General case' 1 N--CA 1.541 4.077 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 177.019 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -71.69 -38.32 70.6 Favored 'General case' 1 N--CA 1.54 4.073 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 175.287 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -60.11 -23.21 63.67 Favored 'General case' 1 N--CA 1.542 4.137 0 C-N-CA 123.857 0.863 . . . . 0.0 110.815 176.106 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 603' ' ' VAL . . . . . 0.534 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.1 OUTLIER -115.81 7.11 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.466 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -176.751 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 73.0 mt -118.88 -61.19 1.68 Allowed 'General case' 0 N--CA 1.529 3.519 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.41 -56.33 22.46 Favored 'General case' 0 N--CA 1.538 3.934 0 C-N-CA 124.691 1.197 . . . . 0.0 111.681 -178.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 70.9 tttt -98.78 -40.45 8.13 Favored 'General case' 0 N--CA 1.53 3.563 0 CA-C-O 118.656 -0.688 . . . . 0.0 110.797 -178.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 90.1 p . . . . . 0 N--CA 1.539 3.994 0 C-N-CA 124.943 1.297 . . . . 0.0 113.419 -179.223 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 898' ' ' TRP . . . . . 0.468 ' HB2' HG23 ' B' ' 544' ' ' THR . 10.4 t-105 . . . . . 0 N--CA 1.496 1.854 0 CA-C-O 118.554 -0.736 . . . . 0.0 110.212 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.505 2.311 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.758 5 O4'-C1'-N19 119.404 14.505 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.682 5 O4'-C1'-N19 120.032 15.29 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.618 2 O4'-C1'-N19 119.33 14.412 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . 0.814 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 5 C3'--C2' 1.419 -9.929 5 O4'-C1'-N19 119.488 14.609 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' E' E ' 5' ' ' ' DC' . . . . . 0.41 " H2'" ' H71' ' E' ' 6' ' ' ' DT' . . . . . . . . 5 O3'--C3' 1.568 10.562 4 C4'-C3'-C2' 117.048 13.848 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . 0.41 ' H71' " H2'" ' E' ' 5' ' ' ' DC' . . . . . . . . 6 C3'--C2' 1.401 -11.666 4 O4'-C1'-N19 119.795 14.994 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' E' E ' 7' ' ' ' DA' . . . . . 0.551 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 5 C3'--C2' 1.391 -12.72 5 N19-C1'-C2' 131.975 11.109 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' E' E ' 8' ' ' ' DG' . . . . . 0.551 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 5 C3'--C2' 1.413 -10.531 4 O4'-C1'-N19 118.088 12.86 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.414 -10.383 5 O4'-C1'-N19 120.143 15.429 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.71 6 O4'-C1'-N19 119.222 14.277 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.732 2 O4'-C1'-N19 119.311 14.389 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.626 3 O4'-C1'-N19 119.459 14.574 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.579 11.369 5 O4'-C1'-N19 118.859 13.824 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' E' E ' 14' ' ' ' DT' . . . . . 0.759 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.409 -10.886 5 O4'-C1'-N19 118.699 13.623 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' E' E ' 15' ' ' ' DA' . . . . . 1.036 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 5 C3'--C2' 1.426 -9.181 3 O4'-C1'-N19 119.567 14.709 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.429 4 O4'-C1'-N19 119.672 14.84 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.573 10.9 4 O4'-C1'-N19 119.618 14.772 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.418 4 O4'-C1'-N19 119.741 14.926 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.424 -9.435 3 O4'-C1'-N19 119.727 14.908 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.51 6.947 4 O4'-C1'-N19 119.524 14.655 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.566 10.414 3 C4'-C3'-C2' 116.95 13.75 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -11.035 3 O4'-C1'-N19 119.819 15.023 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.667 5 O4'-C1'-N19 118.776 13.72 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' F' F ' 4' ' ' ' DA' . . . . . 0.55 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.415 -10.35 2 O4'-C1'-N19 119.072 14.09 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' F' F ' 5' ' ' ' DC' . . . . . 0.576 ' H41' ' HA ' ' A' ' 80' ' ' ALA . . . . . . . . 6 O3'--C3' 1.574 10.967 4 O4'-C1'-N19 119.055 14.069 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.399 -11.922 6 O4'-C1'-N19 119.177 14.221 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.418 -9.999 3 C4'-C3'-C2' 113.739 10.539 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.411 -10.74 5 O4'-C1'-N19 119.898 15.123 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.394 5 O4'-C1'-N19 119.309 14.386 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.411 -10.686 3 O4'-C1'-N19 119.506 14.632 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.423 -9.529 4 O4'-C1'-N19 120.047 15.308 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.424 -9.44 4 O4'-C1'-N19 119.523 14.654 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.421 -9.676 4 O4'-C1'-N19 119.379 14.473 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' F' F ' 14' ' ' ' DT' . . . . . 0.642 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.407 -11.11 5 O4'-C1'-N19 118.788 13.735 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' F' F ' 15' ' ' ' DA' . . . . . 0.791 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.425 -9.25 3 O4'-C1'-N19 119.739 14.924 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.416 -10.24 5 O4'-C1'-N19 120.082 15.352 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.208 4 O4'-C1'-N19 119.251 14.314 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.156 4 O4'-C1'-N19 119.989 15.237 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.597 5 O4'-C1'-N19 119.149 14.187 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.508 6.793 3 O4'-C1'-N19 119.685 14.857 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 . . . . . 0 N--CA 1.509 2.483 0 CA-C-O 119.106 -0.473 . . . . 0.0 110.764 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.4 t -90.31 -49.12 0.37 Allowed Pre-proline 0 N--CA 1.53 3.533 0 CA-C-O 116.54 -1.695 . . . . 0.0 112.666 -179.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_endo -65.36 139.87 61.45 Favored 'Trans proline' 0 C--N 1.395 3.014 0 C-N-CA 122.51 2.14 . . . . 0.0 112.503 -178.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -120.71 126.2 49.59 Favored 'General case' 0 N--CA 1.522 3.142 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.8 t -141.51 142.9 33.57 Favored 'General case' 0 N--CA 1.526 3.352 0 C-N-CA 122.942 0.497 . . . . 0.0 110.736 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -138.1 132.53 32.19 Favored 'General case' 0 N--CA 1.516 2.87 0 C-N-CA 122.641 0.377 . . . . 0.0 111.029 -179.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 62.69 134.69 0.01 OUTLIER 'General case' 0 N--CA 1.532 3.636 0 C-N-CA 125.04 1.336 . . . . 0.0 113.17 178.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 16.1 ptt? -160.57 126.24 3.94 Favored 'General case' 0 N--CA 1.531 3.608 0 C-N-CA 123.358 0.663 . . . . 0.0 109.484 178.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -148.85 139.95 23.07 Favored 'General case' 0 N--CA 1.524 3.238 0 C-N-CA 122.385 0.274 . . . . 0.0 111.68 -178.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -146.54 -48.42 0.2 Allowed 'General case' 0 N--CA 1.526 3.329 0 C-N-CA 123.087 0.555 . . . . 0.0 109.986 179.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -129.95 131.19 45.87 Favored 'General case' 0 N--CA 1.521 3.11 0 C-N-CA 123.039 0.535 . . . . 0.0 109.807 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.0 mtp-105 -125.32 -57.71 1.47 Allowed 'General case' 0 N--CA 1.521 3.093 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 71.5 m80 -152.31 129.77 11.4 Favored 'General case' 0 N--CA 1.534 3.751 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -111.46 -79.91 0.58 Allowed 'General case' 0 N--CA 1.526 3.374 0 CA-C-O 118.881 -0.58 . . . . 0.0 110.449 -179.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -146.72 -64.86 0.29 Allowed 'General case' 0 N--CA 1.528 3.452 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 -179.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.5 ' HE1' HD22 ' B' ' 536' ' ' LEU . 29.7 t-105 -46.91 -40.55 14.35 Favored 'General case' 0 N--CA 1.533 3.681 0 C-N-CA 125.081 1.353 . . . . 0.0 110.888 176.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -88.41 -26.6 22.06 Favored 'General case' 0 N--CA 1.531 3.582 0 CA-C-O 118.154 -0.927 . . . . 0.0 111.251 -179.058 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.2 mtt-85 -56.17 -20.78 19.27 Favored 'General case' 0 N--CA 1.537 3.89 0 CA-C-N 119.618 1.099 . . . . 0.0 108.138 173.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.519 ' CZ ' HD21 ' A' ' 26' ' ' LEU . 57.4 t80 -96.3 -34.42 11.6 Favored 'General case' 0 N--CA 1.509 2.518 0 CA-C-O 116.799 -1.572 . . . . 0.0 109.2 171.8 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 64.5 t -70.69 -63.26 1.01 Allowed 'Isoleucine or valine' 1 N--CA 1.569 5.515 0 CA-C-N 121.713 2.052 . . . . 0.0 110.81 -177.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -55.6 -39.5 70.82 Favored 'General case' 1 N--CA 1.547 4.383 0 CA-C-N 119.006 0.821 . . . . 0.0 110.537 -179.493 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.84 -31.79 72.64 Favored 'General case' 1 N--CA 1.543 4.188 0 C-N-CA 123.081 0.552 . . . . 0.0 109.558 177.17 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.519 HD21 ' CZ ' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -65.97 -34.8 78.93 Favored 'General case' 0 N--CA 1.53 3.545 0 CA-C-O 118.747 -0.644 . . . . 0.0 109.741 177.421 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 54.0 tttt -67.83 -24.67 65.3 Favored 'General case' 0 N--CA 1.526 3.334 0 CA-C-O 118.589 -0.719 . . . . 0.0 111.132 177.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -69.61 -43.38 72.86 Favored 'General case' 1 N--CA 1.541 4.083 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 176.396 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.623 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -81.67 -9.6 59.61 Favored 'General case' 0 N--CA 1.501 2.115 0 CA-C-O 118.407 -0.806 . . . . 0.0 110.424 177.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.43 ' CE1' HD12 ' A' ' 26' ' ' LEU . 6.4 m-30 -78.74 -34.72 45.58 Favored 'General case' 0 N--CA 1.525 3.281 0 CA-C-N 120.234 1.379 . . . . 0.0 109.448 179.117 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 -62.42 -41.27 98.58 Favored 'General case' 0 N--CA 1.537 3.903 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -92.31 -86.95 0.23 Allowed 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 106.927 -1.509 . . . . 0.0 106.927 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.8 p30 148.59 51.98 0.0 OUTLIER 'General case' 1 N--CA 1.561 5.124 0 C-N-CA 128.387 2.675 . . . . 0.0 107.24 177.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.415 HD22 ' CD2' ' B' ' 596' ' ' LEU . 5.4 mt -111.14 11.7 21.9 Favored 'General case' 0 N--CA 1.526 3.371 0 C-N-CA 124.649 1.179 . . . . 0.0 110.858 -177.43 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.542 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 54.6 p-80 -84.09 3.84 32.95 Favored 'General case' 0 N--CA 1.507 2.398 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.765 ' HA ' HD23 ' A' ' 39' ' ' LEU . 20.0 mt -92.16 -50.75 0.29 Allowed Pre-proline 0 N--CA 1.505 2.276 0 CA-C-O 116.868 -1.539 . . . . 0.0 108.348 -176.108 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.459 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 7.3 Cg_exo -62.49 -36.24 66.72 Favored 'Trans proline' 0 C--N 1.395 2.979 0 N-CA-C 106.438 -2.178 . . . . 0.0 106.438 170.3 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.4 -44.02 79.89 Favored 'General case' 0 N--CA 1.528 3.428 0 C-N-CA 123.881 0.872 . . . . 0.0 110.439 175.363 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.765 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -75.68 -28.32 58.63 Favored 'General case' 1 N--CA 1.542 4.126 0 N-CA-C 113.96 1.096 . . . . 0.0 113.96 -176.176 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 30.1 p30 -88.39 6.1 39.02 Favored 'General case' 0 N--CA 1.536 3.853 0 CA-C-N 119.845 1.202 . . . . 0.0 112.36 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.493 ' O ' HD12 ' A' ' 41' ' ' LEU . 0.3 OUTLIER -119.85 -43.74 2.55 Favored 'General case' 0 N--CA 1.519 2.999 0 CA-C-N 118.942 0.792 . . . . 0.0 110.003 -179.511 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -35.76 74.59 Favored 'General case' 0 N--CA 1.534 3.726 0 CA-C-N 119.006 0.821 . . . . 0.0 111.924 -176.746 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.465 ' O ' HG23 ' A' ' 44' ' ' THR . 3.4 tt -135.3 -77.58 0.44 Allowed 'General case' 0 N--CA 1.504 2.271 0 CA-C-O 118.54 -0.743 . . . . 0.0 110.972 179.033 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.465 HG23 ' O ' ' A' ' 43' ' ' LEU . 6.1 p -167.24 172.91 3.3 Favored Pre-proline 1 N--CA 1.55 4.559 0 C-N-CA 124.012 0.925 . . . . 0.0 111.284 -177.707 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -68.68 -18.69 42.33 Favored 'Trans proline' 0 CA--C 1.588 3.207 0 C-N-CA 121.999 1.799 . . . . 0.0 108.761 172.049 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -63.09 -15.39 56.51 Favored 'General case' 0 N--CA 1.529 3.493 0 CA-C-O 118.303 -0.856 . . . . 0.0 111.196 176.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -67.02 -38.62 86.27 Favored 'General case' 0 N--CA 1.53 3.572 0 CA-C-N 119.344 0.975 . . . . 0.0 108.917 177.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 19.0 ptt180 -86.26 -14.29 44.24 Favored 'General case' 0 N--CA 1.533 3.696 0 CA-C-O 118.229 -0.891 . . . . 0.0 109.775 174.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -73.38 -27.59 61.56 Favored 'General case' 0 N--CA 1.533 3.679 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 173.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.22 -46.59 8.33 Favored 'General case' 0 N--CA 1.509 2.486 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.491 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 18.9 tp -64.01 -23.65 67.41 Favored 'General case' 1 N--CA 1.54 4.054 0 CA-C-N 120.0 1.273 . . . . 0.0 107.714 174.069 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.45 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -67.46 -77.53 0.32 Allowed Glycine 0 N--CA 1.504 3.231 0 C-N-CA 125.449 1.499 . . . . 0.0 111.845 176.669 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.8 m -69.82 -26.66 64.35 Favored 'General case' 0 N--CA 1.538 3.964 0 CA-C-O 118.328 -0.844 . . . . 0.0 113.005 -176.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -70.73 -47.77 58.0 Favored 'General case' 0 N--CA 1.533 3.71 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 178.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 22.7 t -65.8 -18.73 24.45 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.168 0 CA-C-N 120.008 1.277 . . . . 0.0 109.373 174.508 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.9 mtp180 -72.58 -46.83 52.38 Favored 'General case' 0 N--CA 1.529 3.515 0 CA-C-O 117.555 -1.212 . . . . 0.0 111.826 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.41 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -74.41 -24.39 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.609 0 CA-C-N 121.147 1.794 . . . . 0.0 111.359 -178.896 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.712 HG11 HD21 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -86.26 -52.46 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.999 0 CA-C-N 120.144 1.338 . . . . 0.0 107.984 -178.382 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -60.2 -30.53 69.43 Favored 'General case' 0 N--CA 1.529 3.522 0 C-N-CA 123.387 0.675 . . . . 0.0 109.796 178.237 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -76.6 -33.53 58.42 Favored 'General case' 0 N--CA 1.529 3.501 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 176.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.7 mp -75.8 -24.84 55.96 Favored 'General case' 0 N--CA 1.529 3.514 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 176.37 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 22.7 mt -76.99 -26.5 53.96 Favored 'General case' 0 N--CA 1.52 3.068 0 C-N-CA 123.774 0.83 . . . . 0.0 109.482 177.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? -77.38 -44.9 27.71 Favored 'General case' 0 N--CA 1.522 3.132 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 179.355 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.67 52.07 6.76 Favored Glycine 1 N--CA 1.516 4.029 0 CA-C-O 119.239 -0.756 . . . . 0.0 111.607 177.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -95.19 -42.04 8.77 Favored 'General case' 0 N--CA 1.523 3.223 0 CA-C-N 117.888 0.844 . . . . 0.0 109.519 178.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 5.0 ttt 119.95 82.14 0.0 OUTLIER 'General case' 1 N--CA 1.545 4.288 0 C-N-CA 127.61 2.364 . . . . 0.0 105.309 -179.319 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 19.8 m -139.39 49.13 1.83 Allowed 'General case' 0 N--CA 1.514 2.751 0 CA-C-O 122.036 0.922 . . . . 0.0 110.135 -177.126 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -110.83 -49.13 3.06 Favored 'General case' 0 N--CA 1.52 3.057 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 178.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -91.35 -46.63 7.92 Favored 'General case' 0 N--CA 1.522 3.147 0 C-N-CA 123.776 0.83 . . . . 0.0 109.076 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -76.46 -10.47 59.42 Favored 'General case' 0 N--CA 1.518 2.941 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -179.063 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 43.0 tp -83.72 -50.94 7.67 Favored 'General case' 0 N--CA 1.531 3.587 0 CA-C-O 117.591 -1.195 . . . . 0.0 113.325 -177.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -37.9 -36.6 0.2 Allowed 'General case' 1 N--CA 1.549 4.506 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 -176.354 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -66.02 -38.32 88.14 Favored 'General case' 1 N--CA 1.542 4.139 0 CA-C-N 118.569 0.622 . . . . 0.0 111.847 -177.752 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -50.65 -34.09 24.97 Favored 'General case' 0 N--CA 1.532 3.66 0 C-N-CA 124.427 1.091 . . . . 0.0 113.675 -178.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 pp -151.01 -44.52 0.12 Allowed 'General case' 0 N--CA 1.53 3.558 0 CA-C-N 119.045 0.839 . . . . 0.0 112.108 -179.476 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 114.47 81.68 1.01 Allowed Glycine 1 N--CA 1.517 4.053 0 N-CA-C 110.895 -0.882 . . . . 0.0 110.895 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -106.14 -50.65 3.12 Favored 'General case' 0 N--CA 1.522 3.165 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 177.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 119.2 158.58 10.73 Favored Glycine 1 N--CA 1.516 4.001 0 N-CA-C 110.112 -1.195 . . . . 0.0 110.112 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.55 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.5 OUTLIER -81.01 -18.53 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.984 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 177.501 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 1.036 ' HB2' ' H62' ' E' ' 15' ' ' ' DA' . . . -68.78 -36.05 77.83 Favored 'General case' 0 N--CA 1.518 2.928 0 CA-C-O 117.658 -1.163 . . . . 0.0 110.111 177.146 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 10.5 p -76.77 -50.82 12.64 Favored 'General case' 0 N--CA 1.534 3.739 0 CA-C-N 119.604 1.093 . . . . 0.0 111.895 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.41 HG22 ' HB ' ' A' ' 57' ' ' ILE . 0.1 OUTLIER -64.7 -28.54 45.05 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.038 0 CA-C-O 118.102 -0.951 . . . . 0.0 113.087 -176.833 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 44.4 p -99.77 -29.13 12.8 Favored 'General case' 0 N--CA 1.515 2.81 0 CA-C-N 119.456 1.025 . . . . 0.0 111.294 -178.441 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.3 ptt180 -73.85 -24.73 59.8 Favored 'General case' 0 N--CA 1.535 3.815 0 CA-C-N 119.651 1.114 . . . . 0.0 108.892 175.181 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.62 -32.32 82.82 Favored Glycine 1 N--CA 1.519 4.196 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 175.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 6.4 t -65.77 -42.37 90.92 Favored 'General case' 1 N--CA 1.54 4.028 0 CA-C-N 117.899 0.85 . . . . 0.0 110.126 177.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -64.14 -30.29 71.36 Favored 'General case' 0 N--CA 1.537 3.913 0 C-N-CA 123.395 0.678 . . . . 0.0 111.115 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.2 m -67.57 -38.3 83.89 Favored 'General case' 0 N--CA 1.532 3.654 0 C-N-CA 123.355 0.662 . . . . 0.0 110.576 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 21.5 mt -55.73 -44.89 77.97 Favored 'General case' 0 N--CA 1.53 3.564 0 C-N-CA 124.151 0.981 . . . . 0.0 111.387 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -28.29 69.25 Favored 'General case' 1 N--CA 1.542 4.139 0 CA-C-O 118.786 -0.626 . . . . 0.0 111.442 179.868 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -69.91 -39.95 75.86 Favored 'General case' 0 N--CA 1.52 3.033 0 CA-C-N 118.426 0.557 . . . . 0.0 110.849 179.267 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.44 161.11 6.14 Favored Pre-proline 1 N--CA 1.542 4.127 0 CA-C-O 118.428 -0.796 . . . . 0.0 112.712 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -79.68 156.67 24.55 Favored 'Trans proline' 0 C--N 1.377 2.059 0 C-N-CA 122.077 1.851 . . . . 0.0 110.931 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.6 t -88.8 -27.79 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.096 0 CA-C-O 117.734 -1.127 . . . . 0.0 111.947 -178.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -64.06 -34.93 79.14 Favored 'General case' 0 N--CA 1.516 2.857 0 CA-C-N 120.262 1.392 . . . . 0.0 109.987 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.412 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.1 mp -96.94 -19.61 18.68 Favored 'General case' 0 N--CA 1.51 2.538 0 C-N-CA 123.85 0.86 . . . . 0.0 110.776 177.276 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.29 -33.58 74.93 Favored 'General case' 1 N--CA 1.547 4.387 0 N-CA-C 104.521 -2.399 . . . . 0.0 104.521 169.721 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -51.17 -42.8 61.06 Favored 'General case' 0 N--CA 1.522 3.164 0 C-N-CA 124.535 1.134 . . . . 0.0 110.803 175.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.632 ' CZ3' HD21 ' B' ' 538' ' ' LEU . 38.3 t90 -63.18 -36.04 82.3 Favored 'General case' 0 N--CA 1.532 3.662 0 N-CA-C 107.637 -1.246 . . . . 0.0 107.637 177.584 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.43 ' O ' ' HB2' ' A' ' 104' ' ' LEU . 1.5 tt -50.77 -40.9 56.23 Favored 'General case' 0 N--CA 1.537 3.905 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 175.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -69.17 -37.21 78.07 Favored 'General case' 1 N--CA 1.545 4.313 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 176.028 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.501 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 1.3 mm-40 -58.02 -23.23 53.34 Favored 'General case' 1 N--CA 1.545 4.276 0 C-N-CA 123.662 0.785 . . . . 0.0 110.55 175.814 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.564 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.4 OUTLIER -122.39 -0.64 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.314 0 CA-C-O 118.28 -0.867 . . . . 0.0 113.007 -176.924 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 100' ' ' LEU . 0.1 OUTLIER -112.31 -59.04 2.06 Favored 'General case' 0 N--CA 1.517 2.919 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 176.813 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.1 tt -54.06 -58.9 5.6 Favored 'General case' 1 N--CA 1.544 4.225 0 C-N-CA 124.776 1.23 . . . . 0.0 111.714 179.192 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -63.22 -30.36 71.52 Favored 'General case' 0 N--CA 1.539 3.981 0 CA-C-O 118.535 -0.745 . . . . 0.0 111.876 -178.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 70.4 m . . . . . 0 N--CA 1.524 3.228 0 CA-C-O 117.975 -1.012 . . . . 0.0 109.68 179.362 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 33.3 tt0 . . . . . 0 N--CA 1.501 2.104 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 40.9 p -120.37 142.37 33.73 Favored Pre-proline 0 N--CA 1.53 3.545 0 CA-C-O 117.641 -1.171 . . . . 0.0 110.674 179.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -62.54 121.22 9.09 Favored 'Trans proline' 0 C--N 1.394 2.96 0 C-N-CA 122.886 2.391 . . . . 0.0 110.75 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -97.78 124.77 42.29 Favored 'General case' 0 N--CA 1.519 2.984 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -179.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 72.5 m -133.62 -46.56 0.81 Allowed 'General case' 0 N--CA 1.525 3.309 0 C-N-CA 123.663 0.785 . . . . 0.0 109.128 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . 69.63 133.73 0.03 OUTLIER 'General case' 0 N--CA 1.531 3.6 0 C-N-CA 124.708 1.203 . . . . 0.0 111.44 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -140.52 -50.22 0.46 Allowed 'General case' 0 N--CA 1.521 3.118 0 C-N-CA 123.525 0.73 . . . . 0.0 109.26 179.467 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 16.8 mmt -100.36 137.35 38.91 Favored 'General case' 0 N--CA 1.525 3.296 0 C-N-CA 123.366 0.666 . . . . 0.0 109.614 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . 65.34 144.3 0.03 OUTLIER 'General case' 1 N--CA 1.542 4.166 0 C-N-CA 124.287 1.035 . . . . 0.0 111.869 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -83.66 -57.58 3.17 Favored 'General case' 0 N--CA 1.523 3.185 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 64.75 136.79 0.02 OUTLIER 'General case' 1 N--CA 1.548 4.43 0 C-N-CA 124.3 1.04 . . . . 0.0 111.085 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -131.46 131.32 43.42 Favored 'General case' 0 N--CA 1.531 3.595 0 CA-C-N 118.012 0.369 . . . . 0.0 111.693 -179.404 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 4.0 p-80 -121.58 117.87 27.83 Favored 'General case' 0 N--CA 1.526 3.375 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 177.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -91.79 125.99 36.71 Favored 'General case' 0 N--CA 1.529 3.507 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -177.265 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -139.54 -58.97 0.57 Allowed 'General case' 0 N--CA 1.524 3.256 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 178.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 519' ' ' TRP . . . . . 0.729 ' CE2' HD22 ' A' ' 39' ' ' LEU . 64.5 t-105 -47.02 -26.67 1.09 Allowed 'General case' 1 N--CA 1.542 4.137 0 C-N-CA 124.261 1.024 . . . . 0.0 112.588 177.056 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 520' ' ' LEU . . . . . 0.599 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.1 mm? -96.13 -28.23 14.68 Favored 'General case' 0 N--CA 1.529 3.494 0 CA-C-O 117.558 -1.21 . . . . 0.0 113.105 -173.276 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 55.4 ttt180 -61.71 -25.45 67.43 Favored 'General case' 1 N--CA 1.542 4.174 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 170.581 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 522' ' ' PHE . . . . . 0.57 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.6 m-85 -77.93 -41.97 34.57 Favored 'General case' 0 N--CA 1.51 2.557 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 174.088 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 86.0 t -65.17 -18.22 23.39 Favored 'Isoleucine or valine' 1 N--CA 1.574 5.775 0 CA-C-N 120.116 1.325 . . . . 0.0 111.918 178.339 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -78.13 -57.06 3.99 Favored 'General case' 0 N--CA 1.534 3.726 0 CA-C-N 120.406 1.457 . . . . 0.0 107.338 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.1 -24.68 67.28 Favored 'General case' 0 N--CA 1.537 3.881 0 O-C-N 123.248 0.343 . . . . 0.0 110.287 175.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 526' ' ' LEU . . . . . 0.492 HD23 ' O ' ' B' ' 522' ' ' PHE . 2.0 mm? -73.06 -36.77 66.94 Favored 'General case' 0 N--CA 1.516 2.868 0 CA-C-O 118.171 -0.918 . . . . 0.0 109.452 178.402 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 3.5 tttt -68.42 -22.89 64.59 Favored 'General case' 0 N--CA 1.528 3.455 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.037 178.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -71.91 -44.07 64.3 Favored 'General case' 0 N--CA 1.532 3.647 0 CA-C-N 119.282 0.946 . . . . 0.0 108.809 177.159 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 529' ' ' ALA . . . . . 0.573 ' HB1' ' N ' ' B' ' 535' ' ' HIS . . . -82.13 -13.51 57.12 Favored 'General case' 0 N--CA 1.511 2.575 0 CA-C-O 119.028 -0.51 . . . . 0.0 110.934 178.086 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -78.51 -30.89 47.38 Favored 'General case' 0 N--CA 1.534 3.742 0 CA-C-N 119.566 1.076 . . . . 0.0 109.65 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -66.1 -44.44 84.34 Favored 'General case' 0 N--CA 1.535 3.793 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 177.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -87.76 -90.31 0.12 Allowed 'General case' 0 N--CA 1.515 2.781 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 176.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.1 p30 156.46 50.08 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.831 0 C-N-CA 127.041 2.136 . . . . 0.0 108.667 176.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 534' ' ' LEU . . . . . 0.702 ' O ' HD13 ' B' ' 538' ' ' LEU . 7.8 mt -107.46 5.19 26.99 Favored 'General case' 0 N--CA 1.518 2.961 0 C-N-CA 124.901 1.28 . . . . 0.0 110.569 -178.786 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 535' ' ' HIS . . . . . 0.587 ' HA ' HD22 ' B' ' 538' ' ' LEU . 50.5 p-80 -77.84 3.73 13.62 Favored 'General case' 0 N--CA 1.522 3.132 0 O-C-N 121.824 -0.548 . . . . 0.0 109.6 174.587 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 536' ' ' LEU . . . . . 0.5 HD22 ' HE1' ' A' ' 19' ' ' TRP . 24.5 mt -93.21 -52.57 0.26 Allowed Pre-proline 0 N--CA 1.504 2.264 0 CA-C-O 116.783 -1.58 . . . . 0.0 108.42 -176.055 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 537' ' ' PRO . . . . . 0.476 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 4.8 Cg_exo -60.75 -33.32 93.2 Favored 'Trans proline' 0 C--N 1.397 3.124 0 C-N-CA 122.152 1.901 . . . . 0.0 107.942 171.312 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 538' ' ' LEU . . . . . 0.702 HD13 ' O ' ' B' ' 534' ' ' LEU . 7.5 mp -62.01 -49.06 77.54 Favored 'General case' 0 N--CA 1.536 3.865 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 174.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 29.4 mt -70.74 -11.5 60.98 Favored 'General case' 0 N--CA 1.534 3.757 0 CA-C-O 118.311 -0.852 . . . . 0.0 112.374 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -81.3 -15.74 54.54 Favored 'General case' 0 N--CA 1.52 3.072 0 CA-C-O 118.108 -0.949 . . . . 0.0 110.996 177.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 541' ' ' LEU . . . . . 0.712 HD21 HG11 ' A' ' 58' ' ' VAL . 0.0 OUTLIER -117.68 -30.3 5.5 Favored 'General case' 0 N--CA 1.525 3.325 0 CA-C-N 119.774 1.17 . . . . 0.0 112.497 -177.302 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 542' ' ' MET . . . . . 0.631 ' N ' HD13 ' B' ' 541' ' ' LEU . 4.6 ptt? -101.64 10.87 39.76 Favored 'General case' 1 N--CA 1.544 4.254 0 CA-C-N 120.286 1.403 . . . . 0.0 112.726 -179.233 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 543' ' ' LEU . . . . . 0.414 ' O ' HG23 ' B' ' 544' ' ' THR . 1.3 tt -128.72 -95.77 0.41 Allowed 'General case' 0 N--CA 1.528 3.459 0 CA-C-O 117.477 -1.249 . . . . 0.0 112.372 178.583 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 544' ' ' THR . . . . . 0.546 HG23 ' HB2' ' A' ' 898' ' ' TRP . 0.3 OUTLIER 162.75 177.77 0.03 OUTLIER Pre-proline 1 N--CA 1.585 6.319 0 CA-C-N 120.916 1.689 . . . . 0.0 109.549 -176.698 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -57.09 -21.45 42.49 Favored 'Trans proline' 1 N--CA 1.538 4.104 0 C-N-CA 122.31 2.007 . . . . 0.0 111.225 173.377 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -64.46 -0.37 1.31 Allowed 'General case' 0 N--CA 1.532 3.632 0 C-N-CA 123.613 0.765 . . . . 0.0 111.47 175.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -55.45 -79.8 0.02 OUTLIER 'General case' 0 N--CA 1.521 3.112 0 CA-C-O 116.608 -1.663 . . . . 0.0 108.632 178.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 25.4 ptt180 -88.07 -8.95 54.76 Favored 'General case' 0 N--CA 1.523 3.198 0 CA-C-N 121.878 2.126 . . . . 0.0 111.976 177.149 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -68.94 -54.88 12.99 Favored 'General case' 0 N--CA 1.534 3.753 0 CA-C-N 120.569 1.532 . . . . 0.0 107.676 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -85.33 -30.24 23.85 Favored 'General case' 0 N--CA 1.513 2.713 0 CA-C-O 117.843 -1.075 . . . . 0.0 111.809 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 551' ' ' LEU . . . . . 0.413 HD23 ' CE3' ' A' ' 19' ' ' TRP . 14.0 tp -67.88 -36.38 80.16 Favored 'General case' 1 N--CA 1.542 4.171 0 CA-C-N 121.136 1.789 . . . . 0.0 109.787 178.385 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -74.38 -55.71 5.47 Favored Glycine 0 N--CA 1.496 2.693 0 CA-C-O 118.642 -1.088 . . . . 0.0 112.563 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.6 m -76.74 -22.59 53.62 Favored 'General case' 1 N--CA 1.543 4.22 0 CA-C-N 118.953 1.377 . . . . 0.0 113.588 -176.034 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -81.14 -41.9 21.74 Favored 'General case' 0 N--CA 1.538 3.941 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 176.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 555' ' ' VAL . . . . . 0.48 HG21 ' HB2' ' A' ' 22' ' ' PHE . 93.1 t -64.49 -18.54 23.36 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.958 0 O-C-N 121.182 -0.949 . . . . 0.0 108.684 173.292 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -76.47 -43.45 39.77 Favored 'General case' 0 N--CA 1.522 3.137 0 CA-C-O 116.958 -1.496 . . . . 0.0 111.657 176.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 557' ' ' ILE . . . . . 0.546 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -72.96 -24.01 20.74 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.526 0 CA-C-N 121.938 2.153 . . . . 0.0 110.555 -179.3 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 558' ' ' VAL . . . . . 0.546 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.0 OUTLIER -82.31 -44.24 19.52 Favored 'Isoleucine or valine' 1 N--CA 1.546 4.336 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 -179.806 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -64.02 -28.78 70.04 Favored 'General case' 0 N--CA 1.528 3.463 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -89.51 -19.34 25.16 Favored 'General case' 0 N--CA 1.525 3.291 0 CA-C-O 118.467 -0.778 . . . . 0.0 110.421 177.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 32.5 tp -76.12 -47.17 25.43 Favored 'General case' 0 N--CA 1.532 3.673 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.254 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 1.5 tt -46.98 -33.87 5.07 Favored 'General case' 1 N--CA 1.547 4.385 0 C-N-CA 125.09 1.356 . . . . 0.0 110.972 178.484 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 19.6 mmm180 -81.4 -58.85 2.85 Favored 'General case' 0 N--CA 1.518 2.973 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 178.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 51.67 37.83 43.05 Favored Glycine 1 N--CA 1.535 5.238 0 C-N-CA 124.322 0.963 . . . . 0.0 112.909 178.478 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -99.48 -51.8 3.67 Favored 'General case' 0 N--CA 1.519 2.996 0 CA-C-N 117.777 0.789 . . . . 0.0 109.148 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 8.2 ptt? -157.35 44.48 0.36 Allowed 'General case' 0 N--CA 1.53 3.531 0 CA-C-O 121.659 0.742 . . . . 0.0 109.795 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 28.1 m -135.36 37.72 2.93 Favored 'General case' 0 N--CA 1.517 2.922 0 C-N-CA 123.554 0.742 . . . . 0.0 109.793 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -109.84 -54.85 2.51 Favored 'General case' 0 N--CA 1.514 2.741 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 569' ' ' ARG . . . . . 0.455 ' HA ' HD11 ' B' ' 579' ' ' ILE . 0.1 OUTLIER -97.37 -43.61 7.23 Favored 'General case' 0 N--CA 1.524 3.272 0 C-N-CA 122.957 0.503 . . . . 0.0 110.998 -179.196 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -79.21 -12.59 59.97 Favored 'General case' 0 N--CA 1.523 3.203 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -177.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 571' ' ' LEU . . . . . 0.835 HD23 HD11 ' B' ' 582' ' ' ILE . 17.9 tp -70.81 -44.11 67.25 Favored 'General case' 0 N--CA 1.532 3.669 0 CA-C-N 119.749 1.159 . . . . 0.0 111.493 -178.27 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -40.66 -29.6 0.1 Allowed 'General case' 1 N--CA 1.558 4.939 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -179.64 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -69.68 -48.7 58.79 Favored 'General case' 0 N--CA 1.538 3.958 0 CA-C-N 119.04 0.836 . . . . 0.0 109.336 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -55.3 -39.23 69.67 Favored 'General case' 0 N--CA 1.53 3.537 0 C-N-CA 124.908 1.283 . . . . 0.0 112.609 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 42.0 mt -114.34 -60.32 1.9 Allowed 'General case' 0 N--CA 1.53 3.555 0 C-N-CA 122.88 0.472 . . . . 0.0 111.457 -177.236 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 114.41 28.51 3.0 Favored Glycine 1 N--CA 1.522 4.412 0 CA-C-O 118.495 -1.17 . . . . 0.0 111.307 -178.406 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -101.28 115.94 31.66 Favored 'General case' 0 N--CA 1.517 2.882 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 178.204 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -38.5 166.26 0.01 OUTLIER Glycine 1 N--CA 1.536 5.358 0 C-N-CA 125.303 1.43 . . . . 0.0 115.414 -177.917 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 579' ' ' ILE . . . . . 0.814 HG21 ' N6 ' ' E' ' 4' ' ' ' DA' . 0.6 OUTLIER -79.78 -17.7 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.963 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 177.239 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 580' ' ' ALA . . . . . 0.791 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -65.62 -20.08 66.17 Favored 'General case' 0 N--CA 1.519 3.018 0 CA-C-O 116.996 -1.478 . . . . 0.0 111.192 176.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 581' ' ' THR . . . . . 0.567 HG21 ' OP2' ' F' ' 14' ' ' ' DT' . 1.2 p -101.59 -35.82 8.99 Favored 'General case' 1 N--CA 1.542 4.152 0 CA-C-N 120.811 1.642 . . . . 0.0 111.208 178.122 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 582' ' ' ILE . . . . . 0.835 HD11 HD23 ' B' ' 571' ' ' LEU . 2.9 tt -66.51 -39.06 83.03 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.565 0 C-N-CA 123.32 0.648 . . . . 0.0 110.575 -177.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 583' ' ' THR . . . . . 0.445 HG23 HG23 ' B' ' 582' ' ' ILE . 77.8 p -96.08 -19.58 19.32 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 118.301 -0.857 . . . . 0.0 110.437 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 10.5 ttp180 -64.69 -31.3 72.47 Favored 'General case' 1 N--CA 1.549 4.503 0 N-CA-C 106.688 -1.597 . . . . 0.0 106.688 172.023 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -66.46 -36.96 92.27 Favored Glycine 0 N--CA 1.514 3.835 0 N-CA-C 110.215 -1.154 . . . . 0.0 110.215 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 59.7 p -61.85 -30.14 70.65 Favored 'General case' 1 N--CA 1.55 4.537 0 CA-C-N 118.614 1.207 . . . . 0.0 112.407 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -66.93 -28.8 68.59 Favored 'General case' 0 N--CA 1.539 3.977 0 CA-C-N 118.681 0.673 . . . . 0.0 110.624 178.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 14.9 m -64.04 -34.98 79.25 Favored 'General case' 0 N--CA 1.533 3.721 0 C-N-CA 123.512 0.725 . . . . 0.0 111.692 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 13.4 mt -56.36 -41.73 76.63 Favored 'General case' 0 N--CA 1.536 3.831 0 C-N-CA 123.947 0.899 . . . . 0.0 111.776 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.96 -19.57 65.24 Favored 'General case' 1 N--CA 1.543 4.205 0 CA-C-O 118.359 -0.829 . . . . 0.0 112.787 -179.23 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -108.27 -21.92 12.56 Favored 'General case' 0 N--CA 1.521 3.098 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 -178.298 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -66.36 160.99 62.06 Favored Pre-proline 0 N--CA 1.538 3.972 0 CA-C-N 119.598 1.09 . . . . 0.0 112.424 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -83.82 148.47 12.31 Favored 'Trans proline' 0 C--N 1.379 2.162 0 C-N-CA 122.272 1.981 . . . . 0.0 108.935 178.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -82.91 -28.03 8.12 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.948 0 CA-C-O 117.858 -1.068 . . . . 0.0 112.045 -178.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -61.88 -37.8 85.91 Favored 'General case' 0 N--CA 1.519 3.013 0 CA-C-N 120.183 1.356 . . . . 0.0 110.513 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 596' ' ' LEU . . . . . 0.416 ' N ' HD12 ' B' ' 596' ' ' LEU . 6.9 mp -99.84 -17.86 17.43 Favored 'General case' 0 N--CA 1.513 2.679 0 C-N-CA 123.887 0.875 . . . . 0.0 111.269 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.12 -36.65 82.41 Favored 'General case' 1 N--CA 1.545 4.301 0 N-CA-C 103.823 -2.658 . . . . 0.0 103.823 170.022 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -56.92 -39.3 74.21 Favored 'General case' 0 N--CA 1.513 2.714 0 C-N-CA 124.405 1.082 . . . . 0.0 111.79 175.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 599' ' ' TRP . . . . . 0.623 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 63.6 t90 -63.31 -32.76 74.26 Favored 'General case' 0 N--CA 1.531 3.604 0 CA-C-O 117.832 -1.08 . . . . 0.0 108.331 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 46.5 mt -55.3 -37.94 68.0 Favored 'General case' 1 N--CA 1.541 4.077 0 CA-C-N 119.162 0.892 . . . . 0.0 109.167 176.099 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -73.05 -30.31 63.63 Favored 'General case' 0 N--CA 1.529 3.48 0 O-C-N 123.935 0.772 . . . . 0.0 109.532 176.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 602' ' ' GLU . . . . . 0.459 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.6 OUTLIER -65.17 -27.4 68.68 Favored 'General case' 1 N--CA 1.542 4.137 0 C-N-CA 123.928 0.891 . . . . 0.0 110.076 175.495 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' B' B ' 603' ' ' VAL . . . . . 0.511 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.0 OUTLIER -111.21 -4.44 11.01 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.245 0 CA-C-O 118.08 -0.962 . . . . 0.0 112.365 -177.081 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -94.39 -59.68 1.89 Allowed 'General case' 0 N--CA 1.512 2.632 0 N-CA-C 104.349 -2.464 . . . . 0.0 104.349 175.263 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.64 -70.21 0.32 Allowed 'General case' 0 N--CA 1.526 3.367 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 176.4 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 44.3 tttm 59.37 98.72 0.02 OUTLIER 'General case' 0 N--CA 1.522 3.173 0 C-N-CA 125.289 1.436 . . . . 0.0 111.489 178.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 39.3 p . . . . . 0 N--CA 1.526 3.346 0 CA-C-O 118.45 -0.786 . . . . 0.0 109.444 179.739 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 898' ' ' TRP . . . . . 0.546 ' HB2' HG23 ' B' ' 544' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.075 0 CA-C-O 118.402 -0.808 . . . . 0.0 108.866 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.506 2.332 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.87 3 O4'-C1'-N19 119.377 14.471 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.882 4 O4'-C1'-N19 120.472 15.84 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.423 -9.494 3 O4'-C1'-N19 120.346 15.683 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . 0.481 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 5 C3'--C2' 1.419 -9.93 4 O4'-C1'-N19 119.789 14.986 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' E' E ' 5' ' ' ' DC' . . . . . 0.565 ' H41' ' HA ' ' B' ' 580' ' ' ALA . . . . . . . . 5 O3'--C3' 1.567 10.464 3 O4'-C1'-N19 118.581 13.476 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . 0.475 ' H71' " H2'" ' E' ' 5' ' ' ' DC' . . . . . . . . 5 C3'--C2' 1.409 -10.891 3 O4'-C1'-N19 119.521 14.652 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' E' E ' 7' ' ' ' DA' . . . . . 0.684 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.398 -12.045 4 C4'-C3'-C2' 111.885 8.685 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' E' E ' 8' ' ' ' DG' . . . . . 0.684 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.416 -10.167 4 O4'-C1'-N19 119.903 15.128 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.932 6 O4'-C1'-N19 119.322 14.403 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.705 2 O4'-C1'-N19 119.383 14.479 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.413 -10.456 4 O4'-C1'-N19 121.152 16.69 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.759 5 O4'-C1'-N19 119.287 14.359 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.407 -11.097 3 O4'-C1'-N19 119.907 15.133 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' E' E ' 14' ' ' ' DT' . . . . . 0.912 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.417 -10.117 3 C4'-C3'-C2' 117.11 13.91 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' E' E ' 15' ' ' ' DA' . . . . . 0.851 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.418 -10.005 7 O4'-C1'-N19 119.469 14.587 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.419 -9.876 5 O4'-C1'-N19 119.704 14.88 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.564 10.195 3 O4'-C1'-N19 120.113 15.391 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.412 -10.592 4 O4'-C1'-N19 120.57 15.963 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.463 5 O4'-C1'-N19 120.047 15.308 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.512 7.104 4 O4'-C1'-N19 119.477 14.596 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.564 10.202 3 C4'-C3'-C2' 117.089 13.889 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.37 3 O4'-C1'-N19 119.553 14.691 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.41 -10.842 5 O4'-C1'-N19 119.907 15.134 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' F' F ' 4' ' ' ' DA' . . . . . 0.488 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.418 -10.027 3 O4'-C1'-N19 119.859 15.074 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' F' F ' 5' ' ' ' DC' . . . . . 0.692 ' H41' ' HA ' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.41 -10.782 5 O4'-C1'-N19 118.726 13.658 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.407 -11.142 3 O4'-C1'-N19 120.241 15.552 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' F' F ' 7' ' ' ' DA' . . . . . 0.401 H2'' " O5'" ' F' ' 8' ' ' ' DG' . . . . . . . . 4 C4'--C3' 1.412 -11.606 4 N19-C1'-C2' 129.658 9.661 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' F' F ' 8' ' ' ' DG' . . . . . 0.401 " O5'" H2'' ' F' ' 7' ' ' ' DA' . . . . . . . . 4 C3'--C2' 1.427 -9.135 3 O4'-C1'-N19 119.228 14.285 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.574 10.989 4 O4'-C1'-N19 119.134 14.167 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.413 -10.496 3 O4'-C1'-N19 119.169 14.211 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.416 -10.15 5 O4'-C1'-N19 120.547 15.934 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.058 2 O4'-C1'-N19 119.931 15.164 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' F' F ' 13' ' ' ' DC' . . . . . 0.47 H2'' HG21 ' B' ' 581' ' ' THR . . . . . . . . 5 O3'--C3' 1.581 11.564 5 O4'-C1'-N19 118.39 13.238 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' F' F ' 14' ' ' ' DT' . . . . . 0.665 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.414 -10.37 3 O4'-C1'-N19 119.004 14.005 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' F' F ' 15' ' ' ' DA' . . . . . 0.948 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.415 -10.33 6 O4'-C1'-N19 119.905 15.132 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.415 -10.283 4 O4'-C1'-N19 119.712 14.89 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.33 4 O4'-C1'-N19 119.376 14.47 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.177 2 O4'-C1'-N19 120.052 15.315 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -10.964 5 O4'-C1'-N19 118.894 13.867 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 O4'--C1' 1.517 7.433 5 O4'-C1'-N19 119.89 15.113 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 . . . . . 0 N--CA 1.506 2.362 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.9 t -144.46 143.42 21.72 Favored Pre-proline 0 N--CA 1.521 3.086 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.973 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -66.32 135.91 41.61 Favored 'Trans proline' 0 C--N 1.388 2.651 0 C-N-CA 123.128 2.552 . . . . 0.0 112.078 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -112.4 144.34 42.0 Favored 'General case' 0 N--CA 1.529 3.512 0 C-N-CA 123.6 0.76 . . . . 0.0 110.47 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 66.5 m 64.9 133.48 0.02 OUTLIER 'General case' 1 N--CA 1.542 4.127 0 C-N-CA 124.582 1.153 . . . . 0.0 111.18 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -147.18 130.83 16.88 Favored 'General case' 0 N--CA 1.522 3.142 0 C-N-CA 122.744 0.418 . . . . 0.0 110.357 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -115.57 136.18 53.33 Favored 'General case' 0 N--CA 1.526 3.344 0 C-N-CA 123.176 0.59 . . . . 0.0 110.464 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 3.7 mpp? -103.93 -50.94 3.26 Favored 'General case' 0 N--CA 1.52 3.074 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 179.153 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -138.71 -61.44 0.58 Allowed 'General case' 0 N--CA 1.523 3.175 0 C-N-CA 122.983 0.513 . . . . 0.0 109.655 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 64.63 134.44 0.02 OUTLIER 'General case' 0 N--CA 1.532 3.666 0 C-N-CA 124.752 1.221 . . . . 0.0 111.867 179.171 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 7.8 mm100 -142.47 116.59 9.45 Favored 'General case' 0 N--CA 1.521 3.109 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.45 133.91 0.01 OUTLIER 'General case' 0 N--CA 1.539 3.988 0 C-N-CA 125.166 1.386 . . . . 0.0 111.65 -179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.4 t-160 -167.46 -40.23 0.02 OUTLIER 'General case' 0 N--CA 1.534 3.731 0 CA-C-O 118.614 -0.708 . . . . 0.0 112.638 -178.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -76.18 -35.49 59.1 Favored 'General case' 0 N--CA 1.534 3.76 0 N-CA-C 114.792 1.404 . . . . 0.0 114.792 -174.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -103.91 -96.04 0.32 Allowed 'General case' 0 N--CA 1.532 3.664 0 CA-C-N 120.316 1.416 . . . . 0.0 111.95 -177.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.921 ' CE3' HD22 ' B' ' 551' ' ' LEU . 64.8 t-105 -49.07 -42.53 39.02 Favored 'General case' 0 N--CA 1.527 3.415 0 CA-C-N 119.629 1.104 . . . . 0.0 112.919 -177.801 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.428 ' N ' HD22 ' A' ' 20' ' ' LEU . 2.3 mm? -81.2 -24.7 37.29 Favored 'General case' 0 N--CA 1.528 3.451 0 CA-C-O 117.595 -1.193 . . . . 0.0 112.859 -175.007 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -61.38 -29.53 69.97 Favored 'General case' 0 N--CA 1.532 3.675 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 173.404 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.681 ' CD1' HD21 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -85.24 -29.76 24.39 Favored 'General case' 0 N--CA 1.519 3.004 0 CA-C-O 116.203 -1.856 . . . . 0.0 109.723 174.913 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 86.1 t -72.79 -31.01 34.84 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.239 0 CA-C-N 121.908 2.14 . . . . 0.0 111.315 -177.289 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -73.82 -49.68 24.04 Favored 'General case' 0 N--CA 1.532 3.633 0 CA-C-N 119.335 0.97 . . . . 0.0 108.5 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.0 mp -70.15 -18.56 63.22 Favored 'General case' 0 N--CA 1.531 3.611 0 CA-C-O 119.515 -0.279 . . . . 0.0 110.323 176.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.403 HD22 ' HA ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -73.09 -33.65 65.72 Favored 'General case' 0 N--CA 1.526 3.33 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 175.256 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -64.51 -22.49 66.98 Favored 'General case' 0 N--CA 1.521 3.084 0 CA-C-O 118.502 -0.761 . . . . 0.0 110.849 175.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -72.51 -46.03 56.56 Favored 'General case' 0 N--CA 1.534 3.757 0 CA-C-N 119.114 0.87 . . . . 0.0 108.864 177.271 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.636 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -80.93 -10.09 59.76 Favored 'General case' 0 N--CA 1.51 2.537 0 CA-C-O 118.645 -0.693 . . . . 0.0 110.988 178.554 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -81.01 -34.83 32.6 Favored 'General case' 0 N--CA 1.53 3.565 0 CA-C-N 119.995 1.27 . . . . 0.0 109.061 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -61.4 -40.81 95.74 Favored 'General case' 0 N--CA 1.534 3.757 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 177.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -94.38 -88.66 0.24 Allowed 'General case' 0 N--CA 1.512 2.66 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 177.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.7 p30 151.63 53.32 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.871 0 C-N-CA 127.737 2.415 . . . . 0.0 107.795 177.072 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.498 HD22 ' CD2' ' B' ' 596' ' ' LEU . 4.5 mt -112.91 9.86 18.91 Favored 'General case' 0 N--CA 1.529 3.518 0 C-N-CA 124.176 0.99 . . . . 0.0 111.246 -178.274 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.565 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 53.7 p-80 -82.4 4.57 23.56 Favored 'General case' 0 N--CA 1.516 2.827 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 174.263 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.799 ' HA ' HD23 ' A' ' 39' ' ' LEU . 19.7 mt -93.75 -52.13 0.25 Allowed Pre-proline 0 N--CA 1.511 2.577 0 CA-C-O 116.892 -1.527 . . . . 0.0 108.689 -176.133 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.526 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 3.5 Cg_exo -65.38 -31.07 52.86 Favored 'Trans proline' 0 C--N 1.392 2.839 0 N-CA-C 106.615 -2.11 . . . . 0.0 106.615 170.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.496 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.1 OUTLIER -65.67 -37.95 87.93 Favored 'General case' 0 N--CA 1.522 3.141 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 175.823 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.799 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -73.46 -19.44 60.95 Favored 'General case' 1 N--CA 1.545 4.295 0 CA-C-N 119.826 1.194 . . . . 0.0 111.083 176.708 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 53.1 m-80 -88.56 9.14 24.97 Favored 'General case' 0 N--CA 1.528 3.445 0 CA-C-N 119.099 0.863 . . . . 0.0 110.785 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.655 HD13 ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -127.33 -49.35 1.42 Allowed 'General case' 0 N--CA 1.522 3.14 0 CA-C-N 119.494 1.043 . . . . 0.0 111.188 -178.165 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.655 ' N ' HD13 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -89.53 -18.25 27.01 Favored 'General case' 1 N--CA 1.541 4.118 0 CA-C-N 120.113 1.324 . . . . 0.0 112.182 -178.275 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.513 HD11 HD12 ' B' ' 551' ' ' LEU . 2.2 mp -111.86 -87.69 0.54 Allowed 'General case' 0 N--CA 1.501 2.102 0 CA-C-O 117.833 -1.079 . . . . 0.0 108.294 -179.277 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.634 HG23 ' HB2' ' B' ' 998' ' ' TRP . 0.7 OUTLIER 160.33 166.62 0.04 OUTLIER Pre-proline 1 N--CA 1.557 4.883 0 C-N-CA 125.148 1.379 . . . . 0.0 109.452 -179.193 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -68.62 -36.64 14.16 Favored 'Trans proline' 0 N--CA 1.512 2.575 0 C-N-CA 122.322 2.015 . . . . 0.0 107.723 173.53 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -62.52 -23.15 66.81 Favored 'General case' 0 N--CA 1.53 3.561 0 C-N-CA 123.953 0.901 . . . . 0.0 110.533 176.181 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -71.88 -35.54 69.81 Favored 'General case' 0 N--CA 1.521 3.096 0 CA-C-O 117.539 -1.22 . . . . 0.0 109.772 178.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.8 ptt180 -81.04 -19.2 44.37 Favored 'General case' 1 N--CA 1.539 4.001 0 CA-C-N 119.905 1.23 . . . . 0.0 108.519 174.067 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -68.91 -30.95 69.54 Favored 'General case' 0 N--CA 1.528 3.431 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 173.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -88.57 -29.53 19.95 Favored 'General case' 0 N--CA 1.514 2.735 0 CA-C-O 117.739 -1.124 . . . . 0.0 110.74 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 26.7 tp -73.72 -21.26 60.28 Favored 'General case' 1 N--CA 1.539 4.013 0 CA-C-N 120.875 1.67 . . . . 0.0 106.69 173.4 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.43 -67.3 1.9 Allowed Glycine 0 N--CA 1.501 3.021 0 C-N-CA 125.26 1.41 . . . . 0.0 110.768 177.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.0 m -67.96 -27.46 66.61 Favored 'General case' 0 N--CA 1.532 3.669 0 CA-C-O 118.102 -0.952 . . . . 0.0 112.366 -178.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 17.1 mtm180 -70.52 -48.01 57.63 Favored 'General case' 0 N--CA 1.531 3.581 0 CA-C-N 119.594 1.088 . . . . 0.0 108.526 178.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.405 HG11 ' CD1' ' B' ' 522' ' ' PHE . 34.3 t -67.97 -15.71 20.06 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.074 0 O-C-N 120.742 -1.224 . . . . 0.0 109.618 174.969 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 66.4 mtt-85 -78.25 -42.94 29.64 Favored 'General case' 0 N--CA 1.53 3.557 0 CA-C-N 120.213 1.369 . . . . 0.0 111.565 178.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.403 ' CG2' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -72.17 -24.32 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.6 0 CA-C-N 121.533 1.969 . . . . 0.0 110.379 -179.908 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.499 HG11 HD11 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -86.94 -51.21 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.928 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 -179.549 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -58.86 -25.14 63.01 Favored 'General case' 0 N--CA 1.536 3.851 0 CA-C-O 118.96 -0.543 . . . . 0.0 110.2 177.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -96.62 -20.94 17.94 Favored 'General case' 0 N--CA 1.525 3.32 0 CA-C-O 118.1 -0.953 . . . . 0.0 111.073 178.134 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 5.3 mt -73.56 -55.4 6.35 Favored 'General case' 0 N--CA 1.539 3.978 0 CA-C-N 119.799 1.181 . . . . 0.0 108.232 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 42.4 mt -50.58 -30.92 14.41 Favored 'General case' 1 N--CA 1.543 4.2 0 C-N-CA 124.099 0.96 . . . . 0.0 112.434 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 28.6 mmm180 -82.97 -45.52 14.0 Favored 'General case' 0 N--CA 1.525 3.32 0 CA-C-N 118.213 0.46 . . . . 0.0 110.169 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.68 59.34 5.26 Favored Glycine 1 N--CA 1.522 4.383 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -116.36 -52.64 2.57 Favored 'General case' 0 N--CA 1.521 3.104 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 14.0 ptm -162.92 79.86 0.48 Allowed 'General case' 0 N--CA 1.529 3.516 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 96.1 p -133.87 1.62 3.32 Favored 'General case' 0 N--CA 1.518 2.956 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 -176.035 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -113.93 -63.99 1.37 Allowed 'General case' 0 N--CA 1.532 3.64 0 CA-C-N 120.212 1.369 . . . . 0.0 111.323 -178.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 15.5 mtt180 -103.99 -41.48 5.84 Favored 'General case' 0 N--CA 1.533 3.698 0 CA-C-N 118.525 0.602 . . . . 0.0 110.639 -178.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -74.65 -5.79 45.03 Favored 'General case' 0 N--CA 1.515 2.791 0 CA-C-O 118.389 -0.815 . . . . 0.0 112.82 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.533 HD23 HG21 ' A' ' 82' ' ' ILE . 35.2 tp -93.89 -49.5 5.78 Favored 'General case' 0 N--CA 1.527 3.398 0 CA-C-N 120.064 1.302 . . . . 0.0 113.094 -177.505 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -44.94 -29.46 0.83 Allowed 'General case' 1 N--CA 1.546 4.351 0 CA-C-N 120.026 1.284 . . . . 0.0 114.003 -177.54 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 15.9 t30 -80.48 -38.31 30.14 Favored 'General case' 0 N--CA 1.531 3.621 0 CA-C-O 119.02 -0.514 . . . . 0.0 112.022 -178.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -53.37 -58.83 5.71 Favored 'General case' 0 N--CA 1.532 3.655 0 N-CA-C 114.077 1.139 . . . . 0.0 114.077 -177.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.95 -39.31 2.73 Favored 'General case' 0 N--CA 1.538 3.948 0 CA-C-N 118.993 0.815 . . . . 0.0 111.808 -178.853 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 125.11 86.05 0.64 Allowed Glycine 1 N--CA 1.523 4.477 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -149.97 104.82 3.33 Favored 'General case' 0 N--CA 1.522 3.146 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 178.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -45.31 169.07 0.03 OUTLIER Glycine 1 N--CA 1.54 5.617 0 C-N-CA 124.268 0.937 . . . . 0.0 114.389 -177.34 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.488 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 1.8 mt -80.35 -13.72 12.98 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.759 0 CA-C-N 119.055 1.427 . . . . 0.0 109.613 179.119 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.912 ' HB3' ' H72' ' E' ' 14' ' ' ' DT' . . . -70.38 -37.26 74.51 Favored 'General case' 0 N--CA 1.524 3.249 0 CA-C-N 120.025 1.284 . . . . 0.0 110.491 177.329 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 3.2 p -78.97 -44.88 21.49 Favored 'General case' 0 N--CA 1.535 3.809 0 CA-C-N 119.296 0.953 . . . . 0.0 111.563 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.533 HG21 HD23 ' A' ' 71' ' ' LEU . 8.5 pt -70.41 -14.72 18.41 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.873 0 CA-C-O 117.658 -1.163 . . . . 0.0 114.09 -176.853 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 66.7 p -111.68 -35.78 5.66 Favored 'General case' 0 N--CA 1.517 2.925 0 CA-C-N 120.132 1.333 . . . . 0.0 110.134 178.083 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -70.17 -23.92 63.06 Favored 'General case' 0 N--CA 1.529 3.515 0 CA-C-N 119.04 0.837 . . . . 0.0 109.357 176.153 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.26 -32.66 84.51 Favored Glycine 1 N--CA 1.522 4.38 0 N-CA-C 109.336 -1.505 . . . . 0.0 109.336 175.58 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.7 t -70.46 -34.19 72.14 Favored 'General case' 0 N--CA 1.532 3.65 0 CA-C-N 118.146 0.973 . . . . 0.0 110.467 177.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -65.83 -22.78 66.57 Favored 'General case' 0 N--CA 1.535 3.806 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.66 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.1 m -67.38 -37.18 82.76 Favored 'General case' 0 N--CA 1.531 3.624 0 CA-C-N 118.611 0.641 . . . . 0.0 110.539 179.268 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.0 mt -55.12 -51.79 65.32 Favored 'General case' 0 N--CA 1.525 3.31 0 C-N-CA 124.292 1.037 . . . . 0.0 112.362 -179.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 6.7 ptpt -68.46 -9.28 47.68 Favored 'General case' 0 N--CA 1.536 3.84 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 -178.495 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.23 -44.81 10.59 Favored 'General case' 0 N--CA 1.521 3.089 0 CA-C-N 119.675 1.125 . . . . 0.0 110.262 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.423 ' HB1' ' HD2' ' A' ' 93' ' ' PRO . . . -56.69 167.03 1.11 Allowed Pre-proline 1 N--CA 1.546 4.374 0 CA-C-O 117.861 -1.066 . . . . 0.0 112.088 179.457 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.423 ' HD2' ' HB1' ' A' ' 92' ' ' ALA . 30.3 Cg_endo -74.31 -179.93 5.23 Favored 'Trans proline' 0 C--N 1.384 2.446 0 C-N-CA 121.055 1.17 . . . . 0.0 110.951 178.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.7 t -102.23 -30.07 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.91 0 CA-C-O 117.506 -1.235 . . . . 0.0 111.683 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -63.02 -40.92 99.21 Favored 'General case' 0 N--CA 1.517 2.907 0 CA-C-N 119.952 1.251 . . . . 0.0 110.839 -177.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.403 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.0 mp -97.84 -20.08 17.73 Favored 'General case' 0 N--CA 1.512 2.649 0 C-N-CA 123.417 0.687 . . . . 0.0 111.445 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.59 -28.63 67.92 Favored 'General case' 0 N--CA 1.536 3.866 0 N-CA-C 103.798 -2.668 . . . . 0.0 103.798 169.562 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -56.76 -39.84 74.76 Favored 'General case' 0 N--CA 1.515 2.822 0 C-N-CA 124.179 0.991 . . . . 0.0 110.046 173.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.634 ' CH2' ' HB2' ' B' ' 529' ' ' ALA . 54.5 t90 -64.66 -34.69 78.89 Favored 'General case' 0 N--CA 1.524 3.267 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.15 -37.57 47.05 Favored 'General case' 1 N--CA 1.542 4.174 0 CA-C-N 119.279 0.945 . . . . 0.0 108.514 175.589 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -69.11 -40.34 78.41 Favored 'General case' 1 N--CA 1.539 4.021 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 175.727 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.44 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 2.9 mt-10 -58.78 -22.86 59.2 Favored 'General case' 1 N--CA 1.549 4.5 0 C-N-CA 123.499 0.72 . . . . 0.0 111.031 175.893 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.543 ' HB ' HD23 ' B' ' 525' ' ' LEU . 0.0 OUTLIER -116.44 -2.65 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.508 0 CA-C-O 118.193 -0.908 . . . . 0.0 112.056 -176.87 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.31 -57.36 2.28 Favored 'General case' 0 N--CA 1.515 2.814 0 N-CA-C 104.176 -2.527 . . . . 0.0 104.176 174.645 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 47.2 mt -65.35 -44.41 87.78 Favored 'General case' 0 N--CA 1.535 3.804 0 C-N-CA 124.935 1.294 . . . . 0.0 109.411 175.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 42.9 tttm 90.37 -45.39 0.02 OUTLIER 'General case' 1 N--CA 1.541 4.076 0 C-N-CA 126.454 1.902 . . . . 0.0 110.226 -179.368 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 38.2 p . . . . . 0 N--CA 1.526 3.373 0 CA-C-O 118.556 -0.735 . . . . 0.0 110.089 179.789 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 . . . . . 0 N--CA 1.502 2.154 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 37.3 p -72.9 145.65 86.81 Favored Pre-proline 0 N--CA 1.532 3.634 0 CA-C-O 118.025 -0.988 . . . . 0.0 111.695 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -71.63 131.18 18.2 Favored 'Trans proline' 0 C--N 1.387 2.599 0 C-N-CA 122.829 2.353 . . . . 0.0 111.576 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -86.59 133.88 33.68 Favored 'General case' 0 N--CA 1.528 3.437 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 178.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 7.8 m 74.92 111.71 0.07 Allowed 'General case' 0 N--CA 1.538 3.932 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -107.83 144.26 35.26 Favored 'General case' 0 N--CA 1.526 3.34 0 C-N-CA 123.028 0.531 . . . . 0.0 111.671 -178.322 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -123.65 145.66 48.79 Favored 'General case' 0 N--CA 1.524 3.263 0 C-N-CA 123.494 0.718 . . . . 0.0 110.752 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 60.2 mtt -76.97 120.7 22.45 Favored 'General case' 0 N--CA 1.526 3.33 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 178.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -131.2 129.6 41.9 Favored 'General case' 0 N--CA 1.515 2.777 0 C-N-CA 122.719 0.408 . . . . 0.0 110.444 -178.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -112.67 -47.59 3.06 Favored 'General case' 0 N--CA 1.514 2.762 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -117.99 -23.96 7.24 Favored 'General case' 0 N--CA 1.528 3.437 0 CA-C-O 118.149 -0.929 . . . . 0.0 112.329 -179.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 6.7 mmt180 -67.5 151.29 47.61 Favored 'General case' 1 N--CA 1.54 4.051 0 CA-C-N 119.632 1.105 . . . . 0.0 112.328 -179.025 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 4.3 t-80 84.48 -57.36 0.11 Allowed 'General case' 1 N--CA 1.539 4.009 0 C-N-CA 125.894 1.678 . . . . 0.0 110.173 179.135 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -79.12 116.8 19.63 Favored 'General case' 0 N--CA 1.522 3.169 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 179.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -146.64 -82.35 0.13 Allowed 'General case' 0 N--CA 1.527 3.422 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 519' ' ' TRP . . . . . 0.761 ' CE2' HD22 ' A' ' 39' ' ' LEU . 60.7 t-105 -44.33 -26.32 0.32 Allowed 'General case' 1 N--CA 1.551 4.603 0 C-N-CA 124.188 0.995 . . . . 0.0 113.236 178.216 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 520' ' ' LEU . . . . . 0.539 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.4 mm? -95.39 -32.18 13.05 Favored 'General case' 0 N--CA 1.523 3.212 0 CA-C-O 117.655 -1.164 . . . . 0.0 113.815 -172.257 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 521' ' ' ARG . . . . . 0.449 ' HG2' HH11 ' B' ' 521' ' ' ARG . 10.7 tpt180 -63.83 -23.28 67.29 Favored 'General case' 0 N--CA 1.529 3.495 0 N-CA-C 106.047 -1.834 . . . . 0.0 106.047 172.403 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 522' ' ' PHE . . . . . 0.505 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.7 m-85 -77.93 -42.06 34.33 Favored 'General case' 0 N--CA 1.505 2.302 0 N-CA-C 106.555 -1.646 . . . . 0.0 106.555 174.082 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 523' ' ' VAL . . . . . 0.486 HG23 ' O ' ' B' ' 519' ' ' TRP . 79.0 t -67.34 -20.27 26.41 Favored 'Isoleucine or valine' 1 N--CA 1.563 5.194 0 CA-C-O 117.665 -1.159 . . . . 0.0 112.374 179.008 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -77.15 -54.39 6.58 Favored 'General case' 0 N--CA 1.533 3.713 0 CA-C-N 120.37 1.441 . . . . 0.0 108.43 -178.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 525' ' ' LEU . . . . . 0.543 HD23 ' HB ' ' A' ' 103' ' ' VAL . 5.1 mp -70.96 -17.42 62.66 Favored 'General case' 0 N--CA 1.527 3.416 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 175.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 526' ' ' LEU . . . . . 0.464 ' HB2' ' HA ' ' B' ' 523' ' ' VAL . 0.6 OUTLIER -69.08 -38.32 78.95 Favored 'General case' 0 N--CA 1.516 2.828 0 N-CA-C 107.162 -1.421 . . . . 0.0 107.162 175.153 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 527' ' ' LYS . . . . . 0.712 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 8.4 tptm -68.85 -19.9 64.27 Favored 'General case' 0 N--CA 1.516 2.87 0 CA-C-O 118.029 -0.986 . . . . 0.0 111.473 176.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -66.95 -38.56 86.36 Favored 'General case' 1 N--CA 1.541 4.122 0 CA-C-N 119.798 1.181 . . . . 0.0 108.325 174.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 529' ' ' ALA . . . . . 0.634 ' HB2' ' CH2' ' A' ' 99' ' ' TRP . . . -89.37 -14.35 35.77 Favored 'General case' 0 N--CA 1.504 2.272 0 CA-C-O 118.52 -0.752 . . . . 0.0 111.012 177.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 530' ' ' TYR . . . . . 0.712 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.7 OUTLIER -75.9 -32.02 59.46 Favored 'General case' 0 N--CA 1.538 3.974 0 CA-C-N 120.098 1.317 . . . . 0.0 109.683 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -65.09 -44.24 89.5 Favored 'General case' 0 N--CA 1.534 3.755 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 177.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -90.63 -87.47 0.19 Allowed 'General case' 0 N--CA 1.518 2.928 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 177.319 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.8 p30 152.71 52.88 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.827 0 C-N-CA 127.406 2.282 . . . . 0.0 108.025 177.222 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 534' ' ' LEU . . . . . 0.403 HD22 ' CD2' ' A' ' 96' ' ' LEU . 5.6 mt -111.45 9.38 21.37 Favored 'General case' 0 N--CA 1.529 3.485 0 C-N-CA 124.718 1.207 . . . . 0.0 110.858 -178.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 535' ' ' HIS . . . . . 0.593 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 47.9 p-80 -83.82 1.66 41.98 Favored 'General case' 0 N--CA 1.517 2.879 0 C-N-CA 123.501 0.72 . . . . 0.0 109.499 175.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 536' ' ' LEU . . . . . 0.461 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 42.8 mt -95.17 -51.01 0.24 Allowed Pre-proline 0 N--CA 1.497 1.878 0 CA-C-O 116.507 -1.711 . . . . 0.0 108.488 -176.349 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 537' ' ' PRO . . . . . 0.461 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 4.5 Cg_exo -66.94 -33.73 31.91 Favored 'Trans proline' 0 C--N 1.394 2.943 0 N-CA-C 107.51 -1.765 . . . . 0.0 107.51 172.096 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.16 -44.14 93.04 Favored 'General case' 0 N--CA 1.522 3.165 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 175.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 43.3 mt -76.5 -11.38 59.87 Favored 'General case' 0 N--CA 1.535 3.804 0 CA-C-O 118.183 -0.913 . . . . 0.0 112.41 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -83.96 -0.66 52.41 Favored 'General case' 0 N--CA 1.526 3.343 0 CA-C-N 119.56 1.073 . . . . 0.0 109.428 174.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 541' ' ' LEU . . . . . 0.617 HD13 ' N ' ' B' ' 542' ' ' MET . 0.0 OUTLIER -114.46 -50.09 2.81 Favored 'General case' 0 N--CA 1.51 2.536 0 C-N-CA 124.979 1.312 . . . . 0.0 108.416 -179.312 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 542' ' ' MET . . . . . 0.617 ' N ' HD13 ' B' ' 541' ' ' LEU . 4.7 ptm -95.85 7.55 46.02 Favored 'General case' 0 N--CA 1.534 3.738 0 CA-C-O 118.266 -0.874 . . . . 0.0 112.89 -178.746 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 543' ' ' LEU . . . . . 0.43 ' O ' HG23 ' B' ' 544' ' ' THR . 0.2 OUTLIER -130.39 -102.14 0.3 Allowed 'General case' 0 N--CA 1.531 3.612 0 CA-C-N 120.274 1.397 . . . . 0.0 113.187 -179.576 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 544' ' ' THR . . . . . 0.605 HG23 ' HB2' ' A' ' 898' ' ' TRP . 0.3 OUTLIER 165.04 156.38 0.08 OUTLIER Pre-proline 1 N--CA 1.571 5.621 0 CA-C-N 121.425 1.921 . . . . 0.0 110.562 -178.118 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -74.11 -45.7 0.35 Allowed 'Trans proline' 0 C--N 1.388 2.615 0 C-N-CA 123.194 2.596 . . . . 0.0 110.076 177.183 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -56.33 -28.22 58.3 Favored 'General case' 1 N--CA 1.54 4.037 0 CA-C-O 118.759 -0.639 . . . . 0.0 112.025 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -75.61 -34.66 60.6 Favored 'General case' 0 N--CA 1.524 3.228 0 CA-C-O 117.766 -1.111 . . . . 0.0 110.927 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 9.5 ptt-85 -71.95 -28.55 63.53 Favored 'General case' 0 N--CA 1.534 3.768 0 CA-C-N 119.902 1.228 . . . . 0.0 109.909 177.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -64.29 -48.61 75.02 Favored 'General case' 1 N--CA 1.54 4.048 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 175.367 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -76.83 -8.91 58.22 Favored 'General case' 0 N--CA 1.52 3.064 0 CA-C-O 118.155 -0.926 . . . . 0.0 111.398 177.48 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 551' ' ' LEU . . . . . 0.921 HD22 ' CE3' ' A' ' 19' ' ' TRP . 4.2 tp -78.88 -40.38 32.54 Favored 'General case' 0 N--CA 1.519 3.02 0 CA-C-N 120.141 1.337 . . . . 0.0 108.143 176.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -73.85 -42.47 38.18 Favored Glycine 0 N--CA 1.513 3.797 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 3.3 m -71.38 -35.45 71.09 Favored 'General case' 0 N--CA 1.532 3.633 0 CA-C-N 117.612 0.706 . . . . 0.0 110.878 -178.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -67.54 -45.68 74.98 Favored 'General case' 0 N--CA 1.537 3.883 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 177.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 555' ' ' VAL . . . . . 0.471 HG23 ' O ' ' B' ' 551' ' ' LEU . 44.0 t -66.55 -17.87 23.22 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.059 0 CA-C-O 117.703 -1.141 . . . . 0.0 109.622 175.897 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -81.83 -40.08 23.03 Favored 'General case' 0 N--CA 1.519 2.985 0 CA-C-O 116.943 -1.503 . . . . 0.0 111.703 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 557' ' ' ILE . . . . . 0.448 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -73.02 -23.82 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.31 0 CA-C-N 122.277 2.308 . . . . 0.0 109.955 179.057 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 558' ' ' VAL . . . . . 0.554 HG11 HD11 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -85.56 -48.0 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.981 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 179.626 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -61.93 -22.46 65.63 Favored 'General case' 0 N--CA 1.532 3.626 0 CA-C-O 118.801 -0.619 . . . . 0.0 109.856 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -87.79 -29.98 20.59 Favored 'General case' 0 N--CA 1.522 3.159 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 13.5 mt -66.4 -46.58 76.1 Favored 'General case' 1 N--CA 1.542 4.144 0 CA-C-N 118.9 0.773 . . . . 0.0 109.305 178.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 33.1 mt -54.41 -27.02 33.95 Favored 'General case' 0 N--CA 1.537 3.906 0 C-N-CA 123.685 0.794 . . . . 0.0 111.762 178.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 1.9 mmm-85 -79.78 -52.07 8.39 Favored 'General case' 0 N--CA 1.526 3.348 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 59.62 72.07 0.67 Allowed Glycine 1 N--CA 1.527 4.728 0 CA-C-O 119.341 -0.699 . . . . 0.0 112.833 178.001 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -145.76 -56.31 0.3 Allowed 'General case' 0 N--CA 1.525 3.305 0 N-CA-C 108.558 -0.905 . . . . 0.0 108.558 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 46.2 mtt -144.59 61.41 1.33 Allowed 'General case' 0 N--CA 1.526 3.363 0 N-CA-C 106.174 -1.787 . . . . 0.0 106.174 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 65.0 m -131.12 4.26 4.41 Favored 'General case' 0 N--CA 1.52 3.027 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -175.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -96.03 -80.15 0.43 Allowed 'General case' 0 N--CA 1.524 3.241 0 CA-C-N 119.81 1.186 . . . . 0.0 110.28 -179.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.62 -34.3 11.0 Favored 'General case' 0 N--CA 1.539 3.996 0 CA-C-N 119.578 1.081 . . . . 0.0 111.515 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -70.45 -10.1 58.25 Favored 'General case' 0 N--CA 1.518 2.971 0 CA-C-O 118.358 -0.83 . . . . 0.0 112.793 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 571' ' ' LEU . . . . . 0.768 HD23 HD11 ' B' ' 582' ' ' ILE . 14.8 tp -89.6 -43.67 10.61 Favored 'General case' 0 N--CA 1.527 3.395 0 CA-C-N 119.767 1.167 . . . . 0.0 111.106 -178.528 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -38.48 -32.31 0.07 Allowed 'General case' 1 N--CA 1.558 4.939 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 -178.96 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -74.27 -46.95 38.08 Favored 'General case' 0 N--CA 1.529 3.507 0 CA-C-N 118.183 0.447 . . . . 0.0 110.278 -179.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -46.81 -45.8 20.31 Favored 'General case' 0 N--CA 1.534 3.769 0 C-N-CA 124.94 1.296 . . . . 0.0 113.891 -178.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 1.8 pp -132.39 -44.04 0.93 Allowed 'General case' 0 N--CA 1.535 3.813 0 CA-C-N 118.68 0.673 . . . . 0.0 112.067 -178.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 109.69 81.65 1.28 Allowed Glycine 1 N--CA 1.525 4.603 0 N-CA-C 110.975 -0.85 . . . . 0.0 110.975 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -111.06 -50.99 2.9 Favored 'General case' 0 N--CA 1.522 3.161 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 114.16 163.36 14.74 Favored Glycine 1 N--CA 1.528 4.787 0 N-CA-C 110.219 -1.152 . . . . 0.0 110.219 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 579' ' ' ILE . . . . . 0.481 HG21 ' N6 ' ' E' ' 4' ' ' ' DA' . 0.6 OUTLIER -82.9 -21.02 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.377 0 CA-C-N 119.54 1.67 . . . . 0.0 108.229 177.828 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 580' ' ' ALA . . . . . 0.948 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -68.88 -54.58 14.78 Favored 'General case' 0 N--CA 1.519 2.979 0 CA-C-N 119.578 1.081 . . . . 0.0 109.57 177.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 581' ' ' THR . . . . . 0.47 HG21 H2'' ' F' ' 13' ' ' ' DC' . 0.9 OUTLIER -69.26 -36.75 77.43 Favored 'General case' 1 N--CA 1.539 4.018 0 CA-C-N 118.662 0.665 . . . . 0.0 112.699 -179.026 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' B' B ' 582' ' ' ILE . . . . . 0.768 HD11 HD23 ' B' ' 571' ' ' LEU . 2.1 tt -64.3 -38.18 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.874 0 CA-C-N 118.543 0.61 . . . . 0.0 110.682 -177.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 80.6 p -98.98 -8.75 24.97 Favored 'General case' 0 N--CA 1.509 2.499 0 CA-C-O 118.604 -0.712 . . . . 0.0 111.023 178.004 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 10.3 ttp180 -72.95 -36.95 67.26 Favored 'General case' 0 N--CA 1.538 3.934 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 174.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -63.32 -38.44 96.44 Favored Glycine 1 N--CA 1.52 4.288 0 N-CA-C 109.075 -1.61 . . . . 0.0 109.075 176.606 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 19.6 m -58.75 -41.23 86.03 Favored 'General case' 1 N--CA 1.543 4.186 0 C-N-CA 123.217 0.607 . . . . 0.0 111.196 178.336 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -63.39 -32.47 73.9 Favored 'General case' 1 N--CA 1.539 4.009 0 C-N-CA 123.268 0.627 . . . . 0.0 111.026 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 15.7 m -68.2 -42.05 80.46 Favored 'General case' 0 N--CA 1.534 3.735 0 C-N-CA 123.059 0.544 . . . . 0.0 109.833 178.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 22.1 mt -58.9 -41.06 86.32 Favored 'General case' 0 N--CA 1.53 3.535 0 C-N-CA 124.387 1.075 . . . . 0.0 111.601 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -65.62 -27.08 68.13 Favored 'General case' 0 N--CA 1.539 3.979 0 CA-C-O 118.575 -0.726 . . . . 0.0 112.427 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -95.49 -25.0 16.4 Favored 'General case' 0 N--CA 1.523 3.195 0 CA-C-O 118.524 -0.751 . . . . 0.0 112.606 -179.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -61.59 164.31 9.78 Favored Pre-proline 0 N--CA 1.537 3.903 0 CA-C-N 119.132 0.878 . . . . 0.0 111.758 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -77.48 146.91 24.88 Favored 'Trans proline' 0 C--N 1.381 2.26 0 C-N-CA 121.751 1.634 . . . . 0.0 108.84 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 594' ' ' VAL . . . . . 0.511 ' HA ' ' HB3' ' B' ' 597' ' ' ARG . 2.8 t -80.95 -25.55 10.78 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.826 0 CA-C-O 117.514 -1.232 . . . . 0.0 112.64 -177.166 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -63.74 -38.42 91.02 Favored 'General case' 0 N--CA 1.519 3.003 0 CA-C-N 120.386 1.448 . . . . 0.0 110.783 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 596' ' ' LEU . . . . . 0.498 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.8 mp -99.68 -18.01 17.49 Favored 'General case' 0 N--CA 1.513 2.689 0 C-N-CA 123.958 0.903 . . . . 0.0 111.064 179.016 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 597' ' ' ARG . . . . . 0.511 ' HB3' ' HA ' ' B' ' 594' ' ' VAL . 0.0 OUTLIER -63.66 -32.49 73.99 Favored 'General case' 1 N--CA 1.547 4.376 0 N-CA-C 103.635 -2.728 . . . . 0.0 103.635 168.69 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -59.19 -38.77 80.65 Favored 'General case' 0 N--CA 1.521 3.116 0 C-N-CA 125.081 1.352 . . . . 0.0 110.835 174.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 599' ' ' TRP . . . . . 0.636 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 48.0 t90 -59.4 -34.48 72.5 Favored 'General case' 0 N--CA 1.535 3.776 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.464 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 75.6 mt -52.91 -39.86 63.1 Favored 'General case' 0 N--CA 1.539 3.998 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 177.036 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -70.73 -33.31 70.71 Favored 'General case' 0 N--CA 1.529 3.478 0 O-C-N 123.927 0.767 . . . . 0.0 109.399 176.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -61.71 -23.68 66.28 Favored 'General case' 1 N--CA 1.546 4.374 0 C-N-CA 123.473 0.709 . . . . 0.0 109.858 174.357 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 603' ' ' VAL . . . . . 0.508 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.1 OUTLIER -117.7 10.47 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.708 0 C-N-CA 123.766 0.826 . . . . 0.0 112.352 -177.97 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -115.36 -57.82 2.2 Favored 'General case' 0 N--CA 1.512 2.634 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 177.334 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 4.9 tt -54.4 -55.7 26.1 Favored 'General case' 0 N--CA 1.539 3.996 0 C-N-CA 125.281 1.432 . . . . 0.0 111.689 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -76.77 -57.93 3.57 Favored 'General case' 0 N--CA 1.529 3.521 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 7.4 t . . . . . 0 N--CA 1.528 3.432 0 CA-C-O 118.132 -0.937 . . . . 0.0 110.385 179.897 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 898' ' ' TRP . . . . . 0.605 ' HB2' HG23 ' B' ' 544' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.007 0 CA-C-O 117.495 -1.241 . . . . 0.0 109.052 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 998' ' ' TRP . . . . . 0.634 ' HB2' HG23 ' A' ' 44' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.16 0 CA-C-O 118.322 -0.846 . . . . 0.0 108.739 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.425 -9.282 2 C4'-C3'-C2' 117.254 14.054 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.429 -8.885 4 O4'-C1'-N19 119.553 14.691 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.424 -9.445 3 O4'-C1'-N19 119.053 14.066 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.413 -10.475 2 O4'-C1'-N19 119.344 14.429 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' E' E ' 5' ' ' ' DC' . . . . . 0.673 ' H41' ' HA ' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.41 -10.791 5 O4'-C1'-N19 118.883 13.854 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 O3'--C3' 1.566 10.368 5 O4'-C1'-N19 119.335 14.419 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' E' E ' 7' ' ' ' DA' . . . . . 0.674 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.395 -12.281 4 C4'-C3'-C2' 112.0 8.8 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' E' E ' 8' ' ' ' DG' . . . . . 0.674 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 5 O3'--C3' 1.551 9.223 4 O4'-C1'-N19 119.504 14.629 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.632 6 C4'-C3'-C2' 116.726 13.526 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.404 -11.401 2 O4'-C1'-N19 119.991 15.238 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.418 -9.996 4 O4'-C1'-N19 120.96 16.45 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.262 4 O4'-C1'-N19 119.241 14.301 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.427 -9.104 4 O4'-C1'-N19 118.54 13.425 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' E' E ' 14' ' ' ' DT' . . . . . 0.741 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.416 -10.218 3 O4'-C1'-N19 119.019 14.024 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' E' E ' 15' ' ' ' DA' . . . . . 0.823 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.413 -10.476 6 O4'-C1'-N19 119.466 14.583 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.416 -10.177 4 O4'-C1'-N19 120.13 15.412 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.564 10.21 2 O4'-C1'-N19 120.336 15.671 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.42 4 O4'-C1'-N19 120.349 15.686 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.206 5 O4'-C1'-N19 119.786 14.982 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.515 7.301 3 O4'-C1'-N19 119.847 15.059 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.571 3 C4'-C3'-C2' 117.046 13.846 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.404 -11.431 6 O4'-C1'-N19 119.449 14.561 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.642 3 O4'-C1'-N19 120.382 15.727 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' F' F ' 4' ' ' ' DA' . . . . . 0.558 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 5 C3'--C2' 1.415 -10.293 4 O4'-C1'-N19 120.301 15.626 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' F' F ' 5' ' ' ' DC' . . . . . 0.645 ' H41' ' HA ' ' A' ' 80' ' ' ALA . . . . . . . . 6 O3'--C3' 1.57 10.674 4 O4'-C1'-N19 118.409 13.261 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . 0.456 ' H71' " H2'" ' F' ' 5' ' ' ' DC' . . . . . . . . 6 C3'--C2' 1.402 -11.561 3 O4'-C1'-N19 119.186 14.233 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.413 -11.464 4 N19-C1'-C2' 130.051 9.907 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.416 -10.225 4 O4'-C1'-N19 119.85 15.062 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.568 10.522 3 O4'-C1'-N19 120.047 15.308 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.379 5 O4'-C1'-N19 118.534 13.418 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.179 4 O4'-C1'-N19 121.376 16.97 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.419 -9.923 3 O4'-C1'-N19 118.836 13.795 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -9.995 4 O4'-C1'-N19 119.152 14.189 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' F' F ' 14' ' ' ' DT' . . . . . 0.768 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.411 -10.675 6 O4'-C1'-N19 118.396 13.245 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' F' F ' 15' ' ' ' DA' . . . . . 0.888 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 5 C3'--C2' 1.419 -9.864 5 O4'-C1'-N19 119.822 15.028 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.417 -10.122 4 O4'-C1'-N19 120.115 15.394 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.234 2 O4'-C1'-N19 119.539 14.674 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.478 5 O4'-C1'-N19 118.528 13.41 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.416 -10.166 4 O4'-C1'-N19 119.309 14.386 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.515 7.295 4 O4'-C1'-N19 119.06 14.075 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 . . . . . 0 N--CA 1.498 1.967 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 67.5 p -128.12 99.39 25.07 Favored Pre-proline 0 N--CA 1.518 2.957 0 CA-C-O 118.628 -0.701 . . . . 0.0 110.058 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -75.29 130.09 12.67 Favored 'Trans proline' 0 C--N 1.391 2.774 0 C-N-CA 122.866 2.377 . . . . 0.0 109.785 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -82.06 127.75 33.41 Favored 'General case' 0 N--CA 1.525 3.289 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 68.0 m -151.84 123.37 7.85 Favored 'General case' 0 N--CA 1.52 3.062 0 C-N-CA 122.673 0.389 . . . . 0.0 110.103 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 64.48 135.49 0.02 OUTLIER 'General case' 0 N--CA 1.538 3.942 0 C-N-CA 124.74 1.216 . . . . 0.0 111.875 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -153.09 -45.57 0.1 Allowed 'General case' 0 N--CA 1.523 3.2 0 C-N-CA 122.743 0.417 . . . . 0.0 111.136 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 25.4 ttp 70.46 140.26 0.04 OUTLIER 'General case' 0 N--CA 1.539 3.984 0 C-N-CA 124.384 1.074 . . . . 0.0 110.364 -179.267 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -118.5 134.0 55.42 Favored 'General case' 0 N--CA 1.516 2.848 0 C-N-CA 123.221 0.608 . . . . 0.0 110.802 -179.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -88.89 -55.44 3.69 Favored 'General case' 0 N--CA 1.524 3.259 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -128.18 149.19 50.55 Favored 'General case' 0 N--CA 1.522 3.164 0 C-N-CA 123.465 0.706 . . . . 0.0 109.754 178.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -97.66 -46.05 6.14 Favored 'General case' 0 N--CA 1.523 3.195 0 CA-C-O 119.026 -0.512 . . . . 0.0 110.276 -179.051 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 24.1 t60 -100.11 124.31 45.36 Favored 'General case' 0 N--CA 1.523 3.196 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -105.81 128.62 53.84 Favored 'General case' 0 N--CA 1.52 3.066 0 C-N-CA 123.555 0.742 . . . . 0.0 109.233 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -127.75 -67.63 0.81 Allowed 'General case' 0 N--CA 1.519 2.988 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.688 ' O ' HG23 ' A' ' 23' ' ' VAL . 71.2 t-105 -52.31 -25.19 8.93 Favored 'General case' 0 N--CA 1.538 3.931 0 CA-C-O 118.083 -0.961 . . . . 0.0 111.794 177.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.52 ' N ' HD22 ' A' ' 20' ' ' LEU . 2.6 mm? -90.2 -30.76 17.38 Favored 'General case' 0 N--CA 1.53 3.573 0 CA-C-O 118.253 -0.88 . . . . 0.0 112.153 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.06 -27.47 68.92 Favored 'General case' 0 N--CA 1.534 3.735 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 173.452 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -88.28 -28.5 21.04 Favored 'General case' 0 N--CA 1.511 2.62 0 CA-C-O 116.359 -1.782 . . . . 0.0 108.245 174.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.688 HG23 ' O ' ' A' ' 19' ' ' TRP . 69.5 t -72.15 -22.89 21.26 Favored 'Isoleucine or valine' 1 N--CA 1.567 5.393 0 CA-C-N 122.241 2.291 . . . . 0.0 111.045 179.286 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -77.93 -51.46 10.37 Favored 'General case' 0 N--CA 1.53 3.536 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 178.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.61 -27.79 69.48 Favored 'General case' 0 N--CA 1.536 3.83 0 O-C-N 123.267 0.354 . . . . 0.0 110.609 176.555 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.95 -33.25 63.84 Favored 'General case' 0 N--CA 1.524 3.274 0 CA-C-O 118.214 -0.898 . . . . 0.0 109.033 177.628 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.421 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 13.4 mttt -68.98 -24.09 64.19 Favored 'General case' 0 N--CA 1.524 3.261 0 CA-C-O 118.378 -0.82 . . . . 0.0 110.74 177.597 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -73.44 -43.32 60.61 Favored 'General case' 0 N--CA 1.533 3.722 0 CA-C-N 119.166 0.894 . . . . 0.0 108.893 177.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.639 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -85.85 -8.64 57.94 Favored 'General case' 0 N--CA 1.508 2.463 0 CA-C-O 118.314 -0.85 . . . . 0.0 110.71 178.089 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.421 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 1.4 m-85 -80.16 -27.45 39.0 Favored 'General case' 0 N--CA 1.53 3.55 0 CA-C-N 120.032 1.287 . . . . 0.0 107.672 177.526 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -62.53 -48.84 77.76 Favored 'General case' 0 N--CA 1.531 3.602 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 176.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -91.82 -89.92 0.18 Allowed 'General case' 0 N--CA 1.514 2.738 0 N-CA-C 106.29 -1.744 . . . . 0.0 106.29 177.284 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 p30 156.18 50.16 0.0 OUTLIER 'General case' 1 N--CA 1.555 4.805 0 C-N-CA 127.489 2.316 . . . . 0.0 107.809 177.493 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.433 HD22 ' CD2' ' B' ' 596' ' ' LEU . 8.7 mt -107.05 10.36 30.29 Favored 'General case' 0 N--CA 1.53 3.525 0 C-N-CA 124.644 1.178 . . . . 0.0 110.606 -178.614 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.543 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 42.2 p-80 -85.06 5.14 30.8 Favored 'General case' 0 N--CA 1.507 2.38 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 175.3 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.803 ' HA ' HD23 ' A' ' 39' ' ' LEU . 26.5 mt -93.95 -51.47 0.26 Allowed Pre-proline 0 N--CA 1.506 2.361 0 CA-C-O 116.8 -1.572 . . . . 0.0 108.773 -176.13 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.487 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 4.0 Cg_exo -65.57 -34.5 41.96 Favored 'Trans proline' 0 C--N 1.397 3.13 0 N-CA-C 106.1 -2.308 . . . . 0.0 106.1 170.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.543 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.3 OUTLIER -63.27 -37.7 88.26 Favored 'General case' 0 N--CA 1.518 2.938 0 C-N-CA 124.078 0.951 . . . . 0.0 109.337 176.363 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.803 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -71.43 -25.89 62.51 Favored 'General case' 1 N--CA 1.551 4.579 0 CA-C-N 120.06 1.3 . . . . 0.0 110.186 176.945 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -72.36 -19.28 61.65 Favored 'General case' 0 N--CA 1.526 3.354 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.366 177.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.5 pp -101.48 -46.32 5.02 Favored 'General case' 0 N--CA 1.53 3.527 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 -177.185 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 6.2 ptp -105.23 -2.29 24.28 Favored 'General case' 1 N--CA 1.54 4.05 0 CA-C-O 117.994 -1.003 . . . . 0.0 112.332 -176.259 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.43 -87.01 0.53 Allowed 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 117.843 -1.075 . . . . 0.0 109.065 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 154.55 163.4 0.0 OUTLIER Pre-proline 1 N--CA 1.564 5.256 0 C-N-CA 125.71 1.604 . . . . 0.0 109.888 179.672 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -71.84 -36.59 6.02 Favored 'Trans proline' 0 C--N 1.383 2.36 0 C-N-CA 122.827 2.351 . . . . 0.0 108.033 173.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -70.43 -16.61 62.96 Favored 'General case' 0 N--CA 1.525 3.288 0 CA-C-O 117.928 -1.034 . . . . 0.0 110.536 176.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -71.57 -35.25 70.52 Favored 'General case' 0 N--CA 1.527 3.415 0 CA-C-N 119.629 1.104 . . . . 0.0 108.364 176.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 10.1 ptt180 -85.5 -19.23 31.51 Favored 'General case' 0 N--CA 1.527 3.405 0 CA-C-O 118.477 -0.773 . . . . 0.0 109.549 175.286 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -70.01 -33.0 71.45 Favored 'General case' 0 N--CA 1.534 3.727 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 174.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.444 ' HB1' ' CZ ' ' A' ' 54' ' ' ARG . . . -88.7 -31.56 18.41 Favored 'General case' 0 N--CA 1.506 2.359 0 CA-C-O 117.719 -1.134 . . . . 0.0 110.094 179.413 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.531 HD23 ' CE3' ' B' ' 519' ' ' TRP . 12.3 tp -70.58 -23.28 62.56 Favored 'General case' 0 N--CA 1.535 3.818 0 CA-C-N 120.856 1.662 . . . . 0.0 107.588 175.099 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.425 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -72.97 -69.97 1.31 Allowed Glycine 0 N--CA 1.502 3.089 0 C-N-CA 124.802 1.191 . . . . 0.0 111.181 176.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.9 m -67.09 -24.7 65.97 Favored 'General case' 1 N--CA 1.542 4.145 0 CA-C-N 117.897 0.848 . . . . 0.0 112.505 -177.618 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.444 ' CZ ' ' HB1' ' A' ' 50' ' ' ALA . 84.0 mtt180 -70.0 -50.51 40.87 Favored 'General case' 0 N--CA 1.527 3.401 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 176.433 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 23.1 t -63.53 -17.77 20.73 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.103 0 CA-C-O 118.073 -0.965 . . . . 0.0 110.209 175.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 57.4 mtt-85 -70.8 -56.36 6.5 Favored 'General case' 0 N--CA 1.528 3.427 0 CA-C-N 119.635 1.107 . . . . 0.0 111.09 177.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.432 ' CG2' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -68.76 -24.48 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.91 0 CA-C-N 119.871 1.214 . . . . 0.0 112.202 -177.194 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -83.26 -48.91 17.17 Favored 'Isoleucine or valine' 1 N--CA 1.55 4.531 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 -179.803 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -63.13 -21.78 66.42 Favored 'General case' 0 N--CA 1.528 3.458 0 CA-C-O 118.693 -0.67 . . . . 0.0 110.418 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -90.65 -23.76 20.68 Favored 'General case' 0 N--CA 1.529 3.505 0 CA-C-O 118.137 -0.935 . . . . 0.0 110.27 177.487 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 14.5 tp -81.57 -53.09 6.55 Favored 'General case' 0 N--CA 1.522 3.132 0 CA-C-N 119.515 1.052 . . . . 0.0 109.12 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 28.9 mt -48.12 -29.58 3.76 Favored 'General case' 1 N--CA 1.541 4.117 0 C-N-CA 124.99 1.316 . . . . 0.0 112.96 -178.827 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 19.5 mmm-85 -89.98 -42.24 11.28 Favored 'General case' 0 N--CA 1.528 3.447 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.07 85.37 0.76 Allowed Glycine 0 N--CA 1.513 3.783 0 N-CA-C 110.071 -1.211 . . . . 0.0 110.071 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -156.7 -57.56 0.09 Allowed 'General case' 0 N--CA 1.521 3.103 0 CA-C-N 117.398 0.599 . . . . 0.0 110.546 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 36.1 mtt -139.49 80.65 1.79 Allowed 'General case' 0 N--CA 1.513 2.675 0 CA-C-O 121.976 0.893 . . . . 0.0 108.939 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.3 t -135.53 2.92 3.0 Favored 'General case' 0 N--CA 1.525 3.299 0 CA-C-N 115.582 -0.735 . . . . 0.0 112.747 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -120.41 -77.88 0.59 Allowed 'General case' 0 N--CA 1.525 3.322 0 CA-C-N 119.912 1.233 . . . . 0.0 113.147 -178.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -103.53 -44.21 5.18 Favored 'General case' 0 N--CA 1.53 3.556 0 CA-C-N 119.336 0.971 . . . . 0.0 112.019 -176.687 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -71.81 -9.8 58.83 Favored 'General case' 0 N--CA 1.513 2.703 0 CA-C-O 117.761 -1.114 . . . . 0.0 112.553 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.597 HD23 HG21 ' A' ' 82' ' ' ILE . 24.4 tp -80.79 -52.24 7.74 Favored 'General case' 0 N--CA 1.523 3.223 0 CA-C-N 120.185 1.357 . . . . 0.0 112.273 -178.738 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -43.81 -30.87 0.72 Allowed 'General case' 1 N--CA 1.547 4.414 0 CA-C-N 119.353 0.979 . . . . 0.0 113.358 -177.809 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -82.28 -38.66 24.07 Favored 'General case' 0 N--CA 1.527 3.377 0 CA-C-O 118.795 -0.621 . . . . 0.0 111.551 -178.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -47.34 -56.77 6.21 Favored 'General case' 1 N--CA 1.539 4.004 0 C-N-CA 124.365 1.066 . . . . 0.0 113.155 -178.212 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -124.03 -43.35 2.1 Favored 'General case' 0 N--CA 1.534 3.747 0 CA-C-O 118.777 -0.63 . . . . 0.0 111.088 -179.751 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 128.9 76.8 0.19 Allowed Glycine 1 N--CA 1.521 4.31 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -140.12 114.22 9.02 Favored 'General case' 0 N--CA 1.52 3.072 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 178.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -47.06 171.43 0.03 OUTLIER Glycine 1 N--CA 1.542 5.748 0 C-N-CA 124.202 0.906 . . . . 0.0 113.781 -178.51 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.558 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.9 OUTLIER -81.7 -18.77 11.27 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.684 0 CA-C-N 118.871 1.336 . . . . 0.0 108.404 178.473 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.823 ' HB2' ' H62' ' E' ' 15' ' ' ' DA' . . . -66.39 -45.78 78.85 Favored 'General case' 0 N--CA 1.52 3.036 0 CA-C-N 119.972 1.26 . . . . 0.0 110.774 177.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.472 HG21 ' OP2' ' E' ' 14' ' ' ' DT' . 1.0 OUTLIER -72.57 -39.31 67.53 Favored 'General case' 0 N--CA 1.536 3.83 0 CA-C-N 119.335 0.97 . . . . 0.0 112.524 -178.462 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.597 HG21 HD23 ' A' ' 71' ' ' LEU . 10.1 pt -71.33 -26.03 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.968 0 CA-C-N 119.255 0.934 . . . . 0.0 111.541 -179.204 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 73.1 p -102.2 -4.69 25.38 Favored 'General case' 0 N--CA 1.517 2.895 0 CA-C-N 119.125 0.875 . . . . 0.0 110.228 174.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -80.13 -33.02 38.95 Favored 'General case' 0 N--CA 1.533 3.689 0 N-CA-C 105.506 -2.035 . . . . 0.0 105.506 172.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -66.57 -28.59 73.83 Favored Glycine 1 N--CA 1.524 4.543 0 CA-C-O 118.407 -1.219 . . . . 0.0 110.634 176.325 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 90.7 p -64.21 -21.03 66.42 Favored 'General case' 1 N--CA 1.542 4.174 0 CA-C-N 119.015 1.407 . . . . 0.0 111.339 177.692 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -55.33 -23.42 23.69 Favored 'General case' 1 N--CA 1.544 4.244 0 CA-C-N 118.659 0.663 . . . . 0.0 110.549 176.055 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.406 ' HB3' ' HG ' ' B' ' 541' ' ' LEU . 78.5 p -45.33 -48.79 13.19 Favored 'General case' 1 N--CA 1.546 4.358 0 C-N-CA 125.709 1.603 . . . . 0.0 111.743 178.213 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.9 mt -67.69 -39.67 84.41 Favored 'General case' 0 N--CA 1.522 3.169 0 C-N-CA 124.195 0.998 . . . . 0.0 110.703 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.15 0.25 55.59 Favored 'General case' 0 N--CA 1.53 3.566 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -178.285 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -125.04 -61.88 1.26 Allowed 'General case' 0 N--CA 1.523 3.215 0 CA-C-N 120.218 1.372 . . . . 0.0 110.449 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.1 161.6 6.89 Favored Pre-proline 1 N--CA 1.54 4.066 0 C-N-CA 123.755 0.822 . . . . 0.0 113.146 -179.467 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.444 ' O ' ' HB2' ' A' ' 97' ' ' ARG . 41.3 Cg_endo -80.73 -179.14 4.92 Favored 'Trans proline' 0 C--N 1.38 2.214 0 C-N-CA 121.886 1.724 . . . . 0.0 110.437 178.325 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.1 t -99.67 -27.23 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.283 0 CA-C-O 117.864 -1.065 . . . . 0.0 111.65 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -61.73 -39.81 92.86 Favored 'General case' 0 N--CA 1.522 3.144 0 CA-C-N 119.989 1.268 . . . . 0.0 111.035 -178.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.469 ' CD2' HD22 ' B' ' 534' ' ' LEU . 6.6 mp -97.77 -18.11 18.98 Favored 'General case' 0 N--CA 1.511 2.624 0 C-N-CA 123.882 0.873 . . . . 0.0 110.817 179.425 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -62.37 -37.66 86.58 Favored 'General case' 1 N--CA 1.544 4.256 0 N-CA-C 103.826 -2.657 . . . . 0.0 103.826 168.725 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -53.83 -39.66 65.74 Favored 'General case' 0 N--CA 1.516 2.828 0 C-N-CA 125.102 1.361 . . . . 0.0 111.289 174.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.59 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 45.7 t90 -59.54 -36.59 76.43 Favored 'General case' 0 N--CA 1.533 3.703 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 179.171 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 44.3 mt -53.11 -40.2 63.98 Favored 'General case' 1 N--CA 1.546 4.35 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 176.502 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -68.85 -34.4 75.42 Favored 'General case' 0 N--CA 1.526 3.332 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 176.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.402 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 2.0 mt-10 -61.45 -25.42 67.22 Favored 'General case' 1 N--CA 1.548 4.433 0 C-N-CA 123.655 0.782 . . . . 0.0 110.051 174.604 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -116.79 6.14 7.2 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.34 0 C-N-CA 124.147 0.979 . . . . 0.0 112.093 -177.197 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 29.2 mt -112.68 -61.56 1.71 Allowed 'General case' 0 N--CA 1.521 3.098 0 N-CA-C 106.091 -1.818 . . . . 0.0 106.091 176.484 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.4 tp -49.73 -36.83 26.92 Favored 'General case' 0 N--CA 1.535 3.794 0 C-N-CA 125.138 1.375 . . . . 0.0 111.787 178.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.2 ttmp? -94.44 -57.38 2.51 Favored 'General case' 0 N--CA 1.52 3.06 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 68.5 m . . . . . 0 N--CA 1.526 3.335 0 CA-C-O 118.114 -0.946 . . . . 0.0 109.879 -179.83 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 . . . . . 0 N--CA 1.503 2.209 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 44.5 p -153.19 142.0 14.36 Favored Pre-proline 0 N--CA 1.529 3.481 0 CA-C-O 117.485 -1.245 . . . . 0.0 111.304 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -72.15 138.37 30.55 Favored 'Trans proline' 0 C--N 1.388 2.632 0 C-N-CA 122.557 2.171 . . . . 0.0 110.948 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 65.45 132.29 0.02 OUTLIER 'General case' 0 N--CA 1.538 3.963 0 C-N-CA 124.688 1.195 . . . . 0.0 110.896 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 8.0 t -80.83 131.25 35.37 Favored 'General case' 0 N--CA 1.525 3.298 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.607 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -77.97 -48.18 16.83 Favored 'General case' 0 N--CA 1.526 3.331 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . 66.46 128.9 0.02 OUTLIER 'General case' 0 N--CA 1.535 3.823 0 C-N-CA 124.567 1.147 . . . . 0.0 110.503 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 16.8 ptt? -111.76 -34.43 6.03 Favored 'General case' 0 N--CA 1.531 3.612 0 C-N-CA 123.249 0.619 . . . . 0.0 111.676 -179.147 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . 68.48 124.98 0.03 OUTLIER 'General case' 0 N--CA 1.536 3.849 0 C-N-CA 124.401 1.08 . . . . 0.0 109.711 -178.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -102.82 133.56 47.68 Favored 'General case' 0 N--CA 1.526 3.34 0 C-N-CA 122.873 0.469 . . . . 0.0 110.226 -178.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -88.5 121.37 30.82 Favored 'General case' 0 N--CA 1.524 3.264 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 178.32 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 48.5 mtp180 -103.28 -41.68 5.97 Favored 'General case' 0 N--CA 1.525 3.285 0 CA-C-O 118.646 -0.693 . . . . 0.0 111.51 -177.334 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 50.8 m-70 -142.43 131.06 22.59 Favored 'General case' 0 N--CA 1.528 3.461 0 CA-C-N 118.772 0.715 . . . . 0.0 110.033 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -98.14 -72.28 0.66 Allowed 'General case' 0 N--CA 1.519 2.979 0 CA-C-O 118.588 -0.72 . . . . 0.0 110.119 -179.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -149.18 -65.81 0.22 Allowed 'General case' 0 N--CA 1.52 3.043 0 CA-C-N 118.984 0.811 . . . . 0.0 110.976 -178.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 519' ' ' TRP . . . . . 0.662 ' NE1' HD22 ' A' ' 39' ' ' LEU . 69.0 t-105 -36.37 -55.28 0.82 Allowed 'General case' 1 N--CA 1.55 4.552 0 C-N-CA 124.951 1.3 . . . . 0.0 114.033 -176.551 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 520' ' ' LEU . . . . . 0.628 ' H ' HD13 ' B' ' 520' ' ' LEU . 0.0 OUTLIER -73.85 -24.76 59.81 Favored 'General case' 0 N--CA 1.533 3.709 0 CA-C-O 117.275 -1.345 . . . . 0.0 114.518 -175.347 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.65 -25.71 64.96 Favored 'General case' 0 N--CA 1.534 3.752 0 N-CA-C 105.626 -1.99 . . . . 0.0 105.626 172.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 522' ' ' PHE . . . . . 0.511 ' CD2' ' HG ' ' A' ' 51' ' ' LEU . 3.2 m-85 -76.46 -35.25 58.56 Favored 'General case' 0 N--CA 1.515 2.814 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 172.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 80.1 t -69.09 -19.24 23.58 Favored 'Isoleucine or valine' 1 N--CA 1.55 4.526 0 CA-C-O 117.599 -1.191 . . . . 0.0 111.025 176.589 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -73.23 -52.53 13.7 Favored 'General case' 0 N--CA 1.535 3.81 0 CA-C-N 120.614 1.552 . . . . 0.0 107.985 -179.117 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 5.4 mp -67.98 -23.88 65.08 Favored 'General case' 0 N--CA 1.531 3.619 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 175.04 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.1 -34.17 77.04 Favored 'General case' 0 N--CA 1.522 3.138 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 175.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 527' ' ' LYS . . . . . 0.424 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 0.9 OUTLIER -69.31 -26.84 64.93 Favored 'General case' 0 N--CA 1.518 2.958 0 CA-C-O 118.297 -0.858 . . . . 0.0 110.385 176.993 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -67.98 -37.16 81.17 Favored 'General case' 0 N--CA 1.534 3.758 0 CA-C-N 119.125 0.875 . . . . 0.0 109.16 176.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 529' ' ' ALA . . . . . 0.59 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -91.62 -8.74 46.4 Favored 'General case' 0 CA--C 1.582 2.187 0 CA-C-O 118.369 -0.825 . . . . 0.0 110.476 178.048 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 530' ' ' TYR . . . . . 0.424 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.1 OUTLIER -81.11 -33.62 33.16 Favored 'General case' 0 N--CA 1.533 3.716 0 CA-C-N 120.468 1.486 . . . . 0.0 108.977 179.635 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -62.14 -44.43 96.65 Favored 'General case' 0 N--CA 1.535 3.808 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 177.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 -89.74 -86.72 0.19 Allowed 'General case' 0 N--CA 1.522 3.148 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 177.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.9 p30 151.7 48.79 0.0 OUTLIER 'General case' 1 N--CA 1.559 5.023 0 C-N-CA 127.426 2.291 . . . . 0.0 108.688 177.219 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 534' ' ' LEU . . . . . 0.469 HD22 ' CD2' ' A' ' 96' ' ' LEU . 6.5 mt -108.45 12.54 26.13 Favored 'General case' 0 N--CA 1.524 3.273 0 C-N-CA 124.665 1.186 . . . . 0.0 110.276 -179.303 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 535' ' ' HIS . . . . . 0.55 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 46.9 p-80 -83.93 4.38 29.88 Favored 'General case' 0 N--CA 1.516 2.829 0 C-N-CA 123.595 0.758 . . . . 0.0 109.076 175.362 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 536' ' ' LEU . . . . . 0.464 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 35.5 mt -97.12 -49.61 0.23 Allowed Pre-proline 0 N--CA 1.506 2.365 0 CA-C-O 116.526 -1.702 . . . . 0.0 109.125 -175.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 537' ' ' PRO . . . . . 0.464 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 2.9 Cg_exo -67.69 -34.38 25.12 Favored 'Trans proline' 0 C--N 1.394 2.963 0 C-N-CA 122.386 2.057 . . . . 0.0 107.417 171.368 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.78 -47.12 79.3 Favored 'General case' 0 N--CA 1.523 3.185 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 176.434 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 76.4 mt -77.67 -6.59 54.39 Favored 'General case' 0 N--CA 1.533 3.71 0 CA-C-O 118.702 -0.666 . . . . 0.0 111.228 178.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -63.76 -30.65 71.73 Favored 'General case' 0 N--CA 1.532 3.648 0 CA-C-N 119.584 1.084 . . . . 0.0 109.52 176.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 541' ' ' LEU . . . . . 0.406 ' HG ' ' HB3' ' A' ' 88' ' ' SER . 3.4 tm? -104.31 -50.9 3.23 Favored 'General case' 0 N--CA 1.509 2.489 0 CA-C-O 118.63 -0.7 . . . . 0.0 109.942 179.07 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 9.9 ptp -82.51 17.91 1.64 Allowed 'General case' 0 N--CA 1.533 3.698 0 CA-C-N 118.938 0.79 . . . . 0.0 112.859 -177.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 7.6 tp -138.85 -73.71 0.39 Allowed 'General case' 0 N--CA 1.528 3.428 0 CA-C-N 119.674 1.124 . . . . 0.0 111.542 174.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 66.5 p 116.73 152.82 0.0 OUTLIER Pre-proline 1 N--CA 1.571 5.591 0 C-N-CA 127.947 2.499 . . . . 0.0 111.02 -179.178 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -69.57 -40.91 5.03 Favored 'Trans proline' 0 C--N 1.396 3.052 0 C-N-CA 123.027 2.485 . . . . 0.0 110.04 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -57.9 -29.47 65.11 Favored 'General case' 1 N--CA 1.543 4.195 0 C-N-CA 123.422 0.689 . . . . 0.0 110.773 178.361 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -75.05 -36.54 61.82 Favored 'General case' 0 N--CA 1.521 3.116 0 CA-C-O 118.279 -0.867 . . . . 0.0 108.744 177.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 548' ' ' ARG . . . . . 0.482 ' HA ' HD12 ' B' ' 551' ' ' LEU . 35.3 ptt180 -83.26 3.7 30.13 Favored 'General case' 0 N--CA 1.531 3.623 0 CA-C-N 118.993 0.815 . . . . 0.0 111.036 174.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -85.09 -48.96 8.67 Favored 'General case' 0 N--CA 1.519 2.99 0 N-CA-C 102.663 -3.088 . . . . 0.0 102.663 170.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -77.52 -11.91 59.91 Favored 'General case' 0 N--CA 1.504 2.253 0 CA-C-O 116.947 -1.501 . . . . 0.0 112.357 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 551' ' ' LEU . . . . . 0.679 HD11 ' N ' ' A' ' 19' ' ' TRP . 0.0 OUTLIER -75.32 -39.02 59.91 Favored 'General case' 1 N--CA 1.54 4.032 0 CA-C-N 121.559 1.982 . . . . 0.0 106.457 174.682 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' B' B ' 552' ' ' GLY . . . . . 0.667 ' N ' HD13 ' B' ' 551' ' ' LEU . . . -66.6 -56.23 14.16 Favored Glycine 0 N--CA 1.495 2.629 0 N-CA-C 109.021 -1.632 . . . . 0.0 109.021 -178.058 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.6 m -64.57 -30.52 71.55 Favored 'General case' 1 N--CA 1.542 4.141 0 CA-C-O 118.495 -0.764 . . . . 0.0 112.302 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -65.97 -52.93 45.17 Favored 'General case' 1 N--CA 1.545 4.306 0 N-CA-C 107.184 -1.413 . . . . 0.0 107.184 177.126 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 555' ' ' VAL . . . . . 0.502 HG23 ' O ' ' B' ' 551' ' ' LEU . 28.1 t -64.15 -18.51 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.738 0 CA-C-O 117.88 -1.057 . . . . 0.0 110.176 177.633 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -79.42 -43.6 23.04 Favored 'General case' 0 N--CA 1.529 3.498 0 CA-C-O 117.554 -1.213 . . . . 0.0 111.499 179.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 557' ' ' ILE . . . . . 0.467 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -73.46 -23.89 19.89 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.248 0 CA-C-N 121.017 1.735 . . . . 0.0 110.678 -179.701 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 558' ' ' VAL . . . . . 0.467 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -84.33 -50.62 14.87 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.809 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -179.444 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -61.34 -23.54 65.82 Favored 'General case' 0 N--CA 1.532 3.646 0 CA-C-O 118.797 -0.621 . . . . 0.0 110.049 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -96.89 -20.35 18.2 Favored 'General case' 0 N--CA 1.525 3.321 0 CA-C-O 117.541 -1.218 . . . . 0.0 111.757 179.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 3.3 pp -88.8 -33.39 17.44 Favored 'General case' 0 N--CA 1.538 3.961 0 CA-C-N 120.59 1.541 . . . . 0.0 110.102 179.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 1.1 tt -58.54 -36.57 74.07 Favored 'General case' 0 N--CA 1.537 3.906 0 C-N-CA 124.15 0.98 . . . . 0.0 110.301 178.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 11.8 mmm-85 -74.36 -52.25 12.72 Favored 'General case' 0 N--CA 1.532 3.644 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 70.76 89.09 0.1 OUTLIER Glycine 0 N--CA 1.513 3.81 0 CA-C-O 119.512 -0.604 . . . . 0.0 112.991 176.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -148.25 -54.23 0.2 Allowed 'General case' 0 N--CA 1.525 3.303 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 14.5 ptm -148.2 61.87 1.11 Allowed 'General case' 0 N--CA 1.525 3.297 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 6.8 t -123.84 1.47 8.72 Favored 'General case' 0 N--CA 1.522 3.153 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.23 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -88.17 -71.56 0.57 Allowed 'General case' 0 N--CA 1.522 3.131 0 CA-C-N 119.754 1.161 . . . . 0.0 110.67 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.53 -19.89 12.38 Favored 'General case' 0 N--CA 1.536 3.845 0 CA-C-O 118.338 -0.839 . . . . 0.0 112.36 -179.214 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -83.98 -7.7 59.34 Favored 'General case' 0 N--CA 1.518 2.957 0 CA-C-N 119.245 0.929 . . . . 0.0 113.251 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 571' ' ' LEU . . . . . 0.607 HD23 HD11 ' B' ' 582' ' ' ILE . 60.6 tp -89.69 -50.02 6.31 Favored 'General case' 0 N--CA 1.535 3.811 0 CA-C-N 120.313 1.415 . . . . 0.0 113.635 -177.505 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -36.18 -33.56 0.04 OUTLIER 'General case' 1 N--CA 1.548 4.475 0 N-CA-C 116.173 1.916 . . . . 0.0 116.173 -175.03 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -66.21 -44.63 83.32 Favored 'General case' 1 N--CA 1.543 4.186 0 CA-C-N 118.724 0.693 . . . . 0.0 109.816 -179.661 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -62.78 -43.46 98.75 Favored 'General case' 0 N--CA 1.523 3.192 0 C-N-CA 124.77 1.228 . . . . 0.0 112.282 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 51.0 mt -102.68 -64.45 1.07 Allowed 'General case' 0 N--CA 1.533 3.685 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -176.12 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 101.86 45.43 1.77 Allowed Glycine 0 N--CA 1.512 3.745 0 N-CA-C 108.494 -1.843 . . . . 0.0 108.494 -176.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -93.44 -37.08 12.15 Favored 'General case' 0 N--CA 1.527 3.41 0 CA-C-N 117.475 0.637 . . . . 0.0 110.329 179.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 109.48 164.56 20.01 Favored Glycine 1 N--CA 1.523 4.456 0 N-CA-C 110.0 -1.24 . . . . 0.0 110.0 -178.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 579' ' ' ILE . . . . . 0.445 ' HA ' HG22 ' B' ' 582' ' ' ILE . 1.9 mt -84.69 -16.88 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.719 0 CA-C-N 119.227 1.514 . . . . 0.0 108.36 177.71 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 580' ' ' ALA . . . . . 0.888 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -69.66 -39.56 76.99 Favored 'General case' 0 N--CA 1.524 3.249 0 CA-C-N 119.874 1.215 . . . . 0.0 109.159 176.113 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 2.6 p -74.78 -40.55 61.1 Favored 'General case' 0 N--CA 1.537 3.879 0 CA-C-N 118.449 0.568 . . . . 0.0 111.527 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 582' ' ' ILE . . . . . 0.607 HD11 HD23 ' B' ' 571' ' ' LEU . 2.8 tt -66.12 -37.35 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.518 0 C-N-CA 123.243 0.617 . . . . 0.0 112.336 -175.544 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 80.5 p -95.92 -33.12 12.3 Favored 'General case' 0 N--CA 1.515 2.812 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.221 -178.134 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -71.31 -21.57 62.05 Favored 'General case' 0 N--CA 1.529 3.509 0 CA-C-N 119.188 0.904 . . . . 0.0 109.333 176.082 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -69.37 -33.31 72.67 Favored Glycine 1 N--CA 1.517 4.052 0 N-CA-C 108.784 -1.726 . . . . 0.0 108.784 174.741 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 37.5 m -63.5 -39.34 94.2 Favored 'General case' 1 N--CA 1.544 4.234 0 CA-C-N 118.376 1.088 . . . . 0.0 110.166 177.527 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -60.13 -27.88 67.42 Favored 'General case' 1 N--CA 1.543 4.217 0 C-N-CA 123.614 0.766 . . . . 0.0 111.314 178.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 73.7 m -58.88 -44.73 91.2 Favored 'General case' 0 N--CA 1.537 3.914 0 C-N-CA 123.771 0.828 . . . . 0.0 111.57 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 33.5 mt -57.44 -42.65 82.87 Favored 'General case' 0 N--CA 1.528 3.457 0 C-N-CA 123.862 0.865 . . . . 0.0 111.127 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.54 -26.38 68.54 Favored 'General case' 1 N--CA 1.541 4.084 0 CA-C-O 118.638 -0.696 . . . . 0.0 111.889 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -76.54 -42.84 41.56 Favored 'General case' 0 N--CA 1.518 2.949 0 CA-C-N 118.598 0.635 . . . . 0.0 110.522 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -62.64 159.54 42.38 Favored Pre-proline 0 N--CA 1.536 3.844 0 CA-C-O 118.386 -0.816 . . . . 0.0 111.863 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -78.83 -176.46 3.3 Favored 'Trans proline' 0 C--N 1.377 2.059 0 C-N-CA 121.63 1.554 . . . . 0.0 110.981 178.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.4 t -96.68 -29.86 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.95 0 CA-C-O 117.8 -1.095 . . . . 0.0 111.099 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -65.83 -38.25 88.39 Favored 'General case' 0 N--CA 1.515 2.808 0 CA-C-N 119.63 1.104 . . . . 0.0 110.03 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 596' ' ' LEU . . . . . 0.433 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.7 mp -98.51 -18.33 18.24 Favored 'General case' 0 N--CA 1.511 2.579 0 C-N-CA 123.776 0.831 . . . . 0.0 111.27 178.692 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.52 -30.14 69.73 Favored 'General case' 0 N--CA 1.535 3.783 0 N-CA-C 103.124 -2.917 . . . . 0.0 103.124 167.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -55.34 -38.87 69.31 Favored 'General case' 0 N--CA 1.518 2.942 0 C-N-CA 123.859 0.863 . . . . 0.0 110.174 173.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 599' ' ' TRP . . . . . 0.639 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 50.5 t90 -62.17 -37.39 85.04 Favored 'General case' 0 N--CA 1.527 3.388 0 CA-C-O 117.75 -1.119 . . . . 0.0 108.168 178.597 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 11.2 mp -54.19 -38.17 65.33 Favored 'General case' 1 N--CA 1.542 4.165 0 CA-C-N 119.226 0.921 . . . . 0.0 108.638 176.551 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -71.1 -32.53 69.15 Favored 'General case' 0 N--CA 1.531 3.624 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 176.163 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 602' ' ' GLU . . . . . 0.426 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 2.2 mm-40 -64.4 -22.17 66.87 Favored 'General case' 1 N--CA 1.544 4.265 0 C-N-CA 123.687 0.795 . . . . 0.0 110.133 174.899 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 603' ' ' VAL . . . . . 0.562 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.1 OUTLIER -121.05 3.45 6.51 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.495 0 C-N-CA 123.807 0.843 . . . . 0.0 112.295 -177.521 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -110.91 -56.95 2.3 Favored 'General case' 0 N--CA 1.514 2.761 0 N-CA-C 105.774 -1.936 . . . . 0.0 105.774 176.307 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 2.5 tt -63.42 -57.56 9.89 Favored 'General case' 0 N--CA 1.532 3.659 0 C-N-CA 124.901 1.281 . . . . 0.0 111.486 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 68.9 tttt -66.75 -63.1 1.14 Allowed 'General case' 0 N--CA 1.536 3.832 0 C-N-CA 122.92 0.488 . . . . 0.0 110.963 -177.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 37.1 p . . . . . 0 N--CA 1.525 3.322 0 CA-C-O 118.477 -0.773 . . . . 0.0 110.149 179.972 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 898' ' ' TRP . . . . . 0.406 ' CZ2' HG22 ' A' ' 81' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.22 0 N-CA-C 108.874 -0.788 . . . . 0.0 108.874 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.504 2.251 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.424 -9.413 3 O4'-C1'-N19 119.796 14.995 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.914 4 O4'-C1'-N19 119.74 14.925 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.855 3 O4'-C1'-N19 119.723 14.904 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . 0.493 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 6 C3'--C2' 1.414 -10.444 5 O4'-C1'-N19 120.072 15.339 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' E' E ' 5' ' ' ' DC' . . . . . 0.478 ' H41' ' HA ' ' B' ' 580' ' ' ALA . . . . . . . . 6 O3'--C3' 1.576 11.168 4 O4'-C1'-N19 118.589 13.486 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.411 -10.744 5 O4'-C1'-N19 119.691 14.864 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' E' E ' 7' ' ' ' DA' . . . . . 0.663 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.394 -12.399 3 C4'-C3'-C2' 113.165 9.965 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' E' E ' 8' ' ' ' DG' . . . . . 0.663 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.421 -9.661 4 O4'-C1'-N19 119.78 14.975 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.569 10.594 4 C4'-C3'-C2' 117.064 13.864 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.566 10.415 3 O4'-C1'-N19 119.271 14.338 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.384 4 O4'-C1'-N19 120.961 16.451 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.466 5 O4'-C1'-N19 119.25 14.312 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.413 -10.549 3 O4'-C1'-N19 119.868 15.084 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' E' E ' 14' ' ' ' DT' . . . . . 0.862 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.418 -9.959 6 O4'-C1'-N19 119.053 14.066 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' E' E ' 15' ' ' ' DA' . . . . . 0.76 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 5 C3'--C2' 1.427 -9.084 4 O4'-C1'-N19 119.621 14.776 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' E' E ' 16' ' ' ' DG' . . . . . 0.447 ' O6 ' HG22 ' A' ' 79' ' ' ILE . . . . . . . . 5 C3'--C2' 1.416 -10.17 4 O4'-C1'-N19 119.4 14.5 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.565 10.276 3 O4'-C1'-N19 120.019 15.274 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.609 5 O4'-C1'-N19 120.557 15.946 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.138 5 O4'-C1'-N19 119.871 15.089 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.512 7.046 3 O4'-C1'-N19 118.847 13.808 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.564 10.227 3 C4'-C3'-C2' 117.018 13.818 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.413 -10.543 3 O4'-C1'-N19 119.886 15.108 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.411 -10.676 5 O4'-C1'-N19 120.288 15.61 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' F' F ' 4' ' ' ' DA' . . . . . 0.613 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 5 C3'--C2' 1.415 -10.257 4 O4'-C1'-N19 120.466 15.833 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' F' F ' 5' ' ' ' DC' . . . . . 0.588 ' H41' ' HA ' ' A' ' 80' ' ' ALA . . . . . . . . 5 O3'--C3' 1.575 11.041 4 O4'-C1'-N19 118.876 13.845 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.403 -11.497 6 O4'-C1'-N19 119.47 14.587 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.424 -10.367 3 C4'-C3'-C2' 113.576 10.376 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.416 -10.201 5 O4'-C1'-N19 119.949 15.187 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.574 10.978 4 O4'-C1'-N19 118.771 13.713 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.684 3 O4'-C1'-N19 119.0 14.0 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.765 3 O4'-C1'-N19 119.946 15.183 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.525 4 O4'-C1'-N19 119.434 14.542 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.377 4 O4'-C1'-N19 119.382 14.477 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' F' F ' 14' ' ' ' DT' . . . . . 0.712 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 O3'--C3' 1.565 10.271 3 C4'-C3'-C2' 117.078 13.878 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' F' F ' 15' ' ' ' DA' . . . . . 0.778 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.416 -10.16 6 O4'-C1'-N19 119.765 14.956 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.419 -9.893 4 O4'-C1'-N19 119.608 14.76 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.423 -9.516 3 O4'-C1'-N19 119.062 14.078 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.417 -10.071 4 O4'-C1'-N19 119.976 15.22 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -10.995 4 O4'-C1'-N19 120.347 15.684 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 C4'--C3' 1.599 7.137 5 O4'-C1'-N19 120.375 15.718 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 . . . . . 0 N--CA 1.501 2.102 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 40.8 p -114.52 125.57 29.01 Favored Pre-proline 0 N--CA 1.524 3.261 0 CA-C-O 117.346 -1.311 . . . . 0.0 109.773 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -74.35 138.5 24.83 Favored 'Trans proline' 0 C--N 1.388 2.628 0 C-N-CA 122.606 2.204 . . . . 0.0 111.231 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -110.63 138.48 46.96 Favored 'General case' 0 N--CA 1.529 3.501 0 C-N-CA 123.327 0.651 . . . . 0.0 110.039 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.2 t -95.37 139.01 32.26 Favored 'General case' 0 N--CA 1.527 3.392 0 C-N-CA 123.058 0.543 . . . . 0.0 111.16 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -135.43 131.83 36.7 Favored 'General case' 0 N--CA 1.528 3.44 0 C-N-CA 123.665 0.786 . . . . 0.0 109.364 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -96.9 -69.68 0.75 Allowed 'General case' 0 N--CA 1.526 3.362 0 CA-C-O 118.914 -0.565 . . . . 0.0 111.326 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 16.3 ttt -144.74 -58.01 0.36 Allowed 'General case' 0 N--CA 1.527 3.383 0 CA-C-N 118.683 0.674 . . . . 0.0 110.079 -178.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -117.52 149.51 40.5 Favored 'General case' 0 N--CA 1.521 3.118 0 C-N-CA 123.031 0.532 . . . . 0.0 111.856 -179.022 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 66.24 125.34 0.02 OUTLIER 'General case' 0 N--CA 1.532 3.635 0 C-N-CA 124.642 1.177 . . . . 0.0 110.951 178.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -127.2 -50.12 1.43 Allowed 'General case' 0 N--CA 1.522 3.164 0 C-N-CA 123.691 0.796 . . . . 0.0 108.975 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.73 119.5 20.42 Favored 'General case' 0 N--CA 1.522 3.151 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 179.1 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -113.02 72.93 0.79 Allowed 'General case' 0 N--CA 1.524 3.252 0 CA-C-O 121.536 0.684 . . . . 0.0 109.945 -177.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 6.9 mp0 -112.9 97.98 6.89 Favored 'General case' 0 N--CA 1.523 3.19 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -136.28 -84.63 0.36 Allowed 'General case' 0 N--CA 1.528 3.426 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.587 ' CZ3' HD22 ' B' ' 551' ' ' LEU . 72.5 t-105 -52.99 -46.98 68.54 Favored 'General case' 0 N--CA 1.539 4.0 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 175.235 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.419 ' N ' HD22 ' A' ' 20' ' ' LEU . 3.6 mm? -74.15 -27.38 60.81 Favored 'General case' 0 N--CA 1.514 2.736 0 O-C-N 125.339 1.649 . . . . 0.0 112.087 -177.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.0 ttt180 -56.95 -29.51 63.22 Favored 'General case' 1 N--CA 1.544 4.242 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 173.356 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.48 ' O ' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -83.57 -38.71 21.31 Favored 'General case' 0 CA--C 1.586 2.338 0 CA-C-O 116.387 -1.768 . . . . 0.0 109.003 173.733 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.558 HG11 ' NE2' ' B' ' 535' ' ' HIS . 19.2 t -70.15 -27.53 32.64 Favored 'Isoleucine or valine' 1 N--CA 1.574 5.73 0 CA-C-N 121.042 1.746 . . . . 0.0 112.985 -175.185 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -73.91 -50.52 19.75 Favored 'General case' 0 N--CA 1.535 3.814 0 CA-C-N 119.994 1.27 . . . . 0.0 108.258 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.2 mp -72.51 -15.62 61.79 Favored 'General case' 0 N--CA 1.528 3.447 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 175.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -70.44 -35.2 73.22 Favored 'General case' 0 N--CA 1.518 2.951 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 174.611 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.449 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 29.6 ttmt -64.03 -24.19 67.62 Favored 'General case' 0 N--CA 1.525 3.302 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.485 176.052 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -69.55 -41.23 76.17 Favored 'General case' 0 N--CA 1.534 3.766 0 CA-C-N 119.282 0.946 . . . . 0.0 108.583 176.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.631 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -87.21 -7.99 57.34 Favored 'General case' 0 N--CA 1.504 2.263 0 CA-C-O 118.59 -0.719 . . . . 0.0 110.738 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.449 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -84.1 -31.83 25.06 Favored 'General case' 0 N--CA 1.534 3.743 0 CA-C-N 120.433 1.47 . . . . 0.0 109.059 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -64.5 -41.33 96.5 Favored 'General case' 0 N--CA 1.531 3.607 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 51.6 m-80 -92.75 -90.78 0.18 Allowed 'General case' 0 N--CA 1.514 2.766 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 177.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.0 p30 155.19 51.16 0.0 OUTLIER 'General case' 1 N--CA 1.555 4.782 0 C-N-CA 127.381 2.272 . . . . 0.0 108.222 177.19 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.529 HD22 ' CD2' ' B' ' 596' ' ' LEU . 7.2 mt -110.08 12.21 23.61 Favored 'General case' 0 N--CA 1.522 3.149 0 C-N-CA 124.209 1.003 . . . . 0.0 110.459 -179.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.53 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 50.0 p-80 -84.47 5.82 25.92 Favored 'General case' 0 N--CA 1.515 2.781 0 C-N-CA 123.723 0.809 . . . . 0.0 108.854 174.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.59 ' HA ' HD23 ' A' ' 39' ' ' LEU . 31.7 mt -96.09 -52.39 0.23 Allowed Pre-proline 0 N--CA 1.502 2.151 0 CA-C-O 117.058 -1.448 . . . . 0.0 108.746 -176.199 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.463 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 6.1 Cg_exo -66.41 -32.04 41.36 Favored 'Trans proline' 0 C--N 1.391 2.799 0 N-CA-C 107.106 -1.921 . . . . 0.0 107.106 170.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.53 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 1.0 OUTLIER -65.58 -41.64 92.66 Favored 'General case' 0 N--CA 1.52 3.034 0 CA-C-O 118.212 -0.899 . . . . 0.0 108.739 176.79 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.59 HD23 ' HA ' ' A' ' 36' ' ' LEU 0.274 0.1 OUTLIER -78.28 -8.58 58.56 Favored 'General case' 1 N--CA 1.552 4.653 0 CA-C-N 119.612 1.096 . . . . 0.0 111.448 177.272 . . . . . . . . 5 4 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -90.22 8.57 32.43 Favored 'General case' 0 N--CA 1.524 3.245 0 CA-C-N 118.727 0.694 . . . . 0.0 109.618 174.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.57 HD11 HG11 ' B' ' 558' ' ' VAL . 0.3 OUTLIER -125.47 -56.32 1.51 Allowed 'General case' 0 N--CA 1.513 2.723 0 C-N-CA 124.048 0.939 . . . . 0.0 109.629 -178.748 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.566 ' N ' HD13 ' A' ' 41' ' ' LEU . 15.7 ptp -98.06 7.72 45.88 Favored 'General case' 0 N--CA 1.538 3.943 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -176.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.47 ' O ' HG23 ' A' ' 44' ' ' THR . 1.8 mp -120.63 -71.36 0.74 Allowed 'General case' 0 N--CA 1.514 2.726 0 CA-C-O 117.333 -1.318 . . . . 0.0 110.229 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.57 HG23 ' HB2' ' B' ' 998' ' ' TRP . 24.9 p 128.41 161.75 0.0 OUTLIER Pre-proline 1 N--CA 1.579 6.014 0 C-N-CA 127.533 2.333 . . . . 0.0 109.071 -179.194 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -68.16 -33.36 25.07 Favored 'Trans proline' 0 C--N 1.392 2.82 0 C-N-CA 121.934 1.756 . . . . 0.0 108.929 176.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -64.56 -22.78 67.06 Favored 'General case' 0 N--CA 1.532 3.644 0 CA-C-O 118.278 -0.867 . . . . 0.0 110.561 176.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -71.26 -37.11 71.93 Favored 'General case' 0 N--CA 1.524 3.245 0 CA-C-O 117.745 -1.121 . . . . 0.0 109.658 178.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.9 ptt180 -81.85 -20.31 39.21 Favored 'General case' 1 N--CA 1.541 4.113 0 CA-C-N 119.589 1.086 . . . . 0.0 108.896 174.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -71.99 -26.3 62.18 Favored 'General case' 0 N--CA 1.523 3.217 0 N-CA-C 107.559 -1.275 . . . . 0.0 107.559 174.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.02 -35.48 16.35 Favored 'General case' 0 N--CA 1.504 2.268 0 CA-C-O 117.365 -1.302 . . . . 0.0 110.114 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.492 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 29.5 tp -74.27 -19.98 60.31 Favored 'General case' 1 N--CA 1.541 4.1 0 CA-C-N 120.646 1.566 . . . . 0.0 106.94 173.689 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.41 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -69.01 -70.24 1.21 Allowed Glycine 0 N--CA 1.497 2.742 0 C-N-CA 125.346 1.45 . . . . 0.0 110.254 177.418 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.4 t -72.93 -22.14 60.77 Favored 'General case' 0 N--CA 1.526 3.368 0 CA-C-O 117.628 -1.177 . . . . 0.0 113.019 -179.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 12.2 mtt180 -70.57 -51.02 31.27 Favored 'General case' 0 N--CA 1.531 3.604 0 CA-C-N 120.073 1.306 . . . . 0.0 108.035 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 20.3 t -65.66 -18.75 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.978 0 CA-C-O 117.875 -1.059 . . . . 0.0 109.39 175.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.4 mmt180 -75.71 -45.19 38.13 Favored 'General case' 0 N--CA 1.525 3.325 0 CA-C-O 117.376 -1.297 . . . . 0.0 111.807 178.331 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.424 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -73.6 -25.62 21.05 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.261 0 CA-C-N 121.26 1.846 . . . . 0.0 111.137 -178.371 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.517 HG11 HD11 ' B' ' 541' ' ' LEU . 0.0 OUTLIER -85.23 -47.16 17.08 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.108 0 CA-C-N 120.128 1.331 . . . . 0.0 107.536 -179.946 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -62.03 -24.28 66.97 Favored 'General case' 0 N--CA 1.534 3.741 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 177.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -92.73 -21.23 20.09 Favored 'General case' 0 N--CA 1.518 2.929 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.373 177.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 12.6 tp -74.75 -56.47 4.76 Favored 'General case' 0 N--CA 1.526 3.337 0 CA-C-N 120.091 1.314 . . . . 0.0 109.395 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 57.2 mt -51.15 -27.99 9.94 Favored 'General case' 1 N--CA 1.544 4.233 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -178.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.72 -57.45 2.98 Favored 'General case' 0 N--CA 1.524 3.261 0 N-CA-C 106.91 -1.515 . . . . 0.0 106.91 178.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 66.76 64.92 3.03 Favored Glycine 1 N--CA 1.517 4.094 0 C-N-CA 124.0 0.809 . . . . 0.0 112.698 178.058 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -115.17 -54.93 2.52 Favored 'General case' 0 N--CA 1.524 3.257 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 11.8 ptm -147.01 65.72 1.16 Allowed 'General case' 0 N--CA 1.528 3.463 0 N-CA-C 106.39 -1.707 . . . . 0.0 106.39 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.415 ' HA ' ' HB2' ' A' ' 71' ' ' LEU . 14.8 m -124.03 6.49 8.6 Favored 'General case' 0 N--CA 1.524 3.233 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -174.248 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -114.91 -70.09 0.82 Allowed 'General case' 0 N--CA 1.527 3.418 0 CA-C-N 119.61 1.096 . . . . 0.0 111.502 -179.161 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 8.6 mtt180 -91.44 -43.6 9.62 Favored 'General case' 0 N--CA 1.533 3.706 0 CA-C-N 118.591 0.632 . . . . 0.0 111.536 -177.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -77.07 -13.59 59.93 Favored 'General case' 0 N--CA 1.519 3.011 0 CA-C-O 118.321 -0.847 . . . . 0.0 112.925 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.547 HD23 HG21 ' A' ' 82' ' ' ILE . 24.4 tp -81.41 -50.46 9.43 Favored 'General case' 0 N--CA 1.523 3.198 0 CA-C-N 119.767 1.167 . . . . 0.0 111.522 -178.204 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.92 -31.79 1.39 Allowed 'General case' 1 N--CA 1.545 4.289 0 CA-C-N 119.57 1.077 . . . . 0.0 113.666 -179.171 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -77.86 -38.9 44.99 Favored 'General case' 0 N--CA 1.527 3.423 0 CA-C-O 119.232 -0.413 . . . . 0.0 111.217 -178.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -51.09 -59.19 4.44 Favored 'General case' 0 N--CA 1.529 3.521 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -177.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -119.08 -36.86 3.31 Favored 'General case' 0 N--CA 1.537 3.893 0 CA-C-O 118.455 -0.783 . . . . 0.0 112.075 -178.305 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 119.95 77.71 0.52 Allowed Glycine 1 N--CA 1.525 4.593 0 N-CA-C 110.76 -0.936 . . . . 0.0 110.76 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -146.0 100.83 3.45 Favored 'General case' 0 N--CA 1.524 3.242 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 178.334 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -40.18 170.48 0.01 OUTLIER Glycine 1 N--CA 1.54 5.624 0 C-N-CA 125.351 1.453 . . . . 0.0 116.094 -176.346 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.613 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.4 OUTLIER -77.14 -20.81 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.04 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 178.513 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.862 ' HB3' ' H72' ' E' ' 14' ' ' ' DT' . . . -66.94 -50.26 62.93 Favored 'General case' 0 N--CA 1.516 2.839 0 CA-C-O 117.944 -1.027 . . . . 0.0 109.302 177.367 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.416 HG22 ' CZ2' ' A' ' 898' ' ' TRP . 0.7 OUTLIER -65.09 -41.6 94.86 Favored 'General case' 1 N--CA 1.541 4.082 0 CA-C-O 117.875 -1.059 . . . . 0.0 113.459 -178.494 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.547 HG21 HD23 ' A' ' 71' ' ' LEU . 0.1 OUTLIER -69.68 -32.16 51.34 Favored 'Isoleucine or valine' 1 N--CA 1.549 4.508 0 CA-C-N 120.392 1.451 . . . . 0.0 110.96 -179.616 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 71.3 p -98.9 -2.15 38.33 Favored 'General case' 0 N--CA 1.518 2.947 0 CA-C-N 119.101 0.864 . . . . 0.0 111.443 177.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -88.22 -32.87 18.34 Favored 'General case' 0 N--CA 1.529 3.478 0 N-CA-C 105.519 -2.03 . . . . 0.0 105.519 173.37 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.64 -29.64 72.54 Favored Glycine 1 N--CA 1.519 4.196 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 176.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 62.2 p -69.4 -35.89 76.19 Favored 'General case' 0 N--CA 1.538 3.942 0 CA-C-N 118.544 1.172 . . . . 0.0 110.259 177.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -63.16 -26.35 68.77 Favored 'General case' 0 N--CA 1.538 3.965 0 C-N-CA 123.146 0.578 . . . . 0.0 110.721 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.3 m -68.61 -38.68 80.8 Favored 'General case' 0 N--CA 1.534 3.757 0 C-N-CA 123.584 0.754 . . . . 0.0 110.375 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 13.5 mt -57.47 -37.96 73.73 Favored 'General case' 0 N--CA 1.533 3.682 0 C-N-CA 124.05 0.94 . . . . 0.0 111.468 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -68.43 -27.98 66.67 Favored 'General case' 0 N--CA 1.531 3.618 0 CA-C-O 118.563 -0.732 . . . . 0.0 111.757 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -76.42 -46.31 27.66 Favored 'General case' 0 N--CA 1.518 2.963 0 CA-C-N 118.782 0.719 . . . . 0.0 110.992 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.25 160.04 52.76 Favored Pre-proline 0 N--CA 1.538 3.955 0 CA-C-O 118.29 -0.862 . . . . 0.0 112.571 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -81.85 175.46 9.29 Favored 'Trans proline' 0 C--N 1.377 2.072 0 C-N-CA 121.737 1.625 . . . . 0.0 111.123 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 t -95.69 -25.19 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.192 0 CA-C-O 117.945 -1.026 . . . . 0.0 111.242 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -59.79 -44.94 93.69 Favored 'General case' 0 N--CA 1.516 2.85 0 CA-C-N 120.071 1.305 . . . . 0.0 109.966 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.597 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.9 mp -98.49 -9.98 24.24 Favored 'General case' 0 N--CA 1.505 2.282 0 CA-C-O 118.061 -0.971 . . . . 0.0 112.268 178.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.1 -33.93 76.9 Favored 'General case' 1 N--CA 1.549 4.52 0 N-CA-C 102.881 -3.007 . . . . 0.0 102.881 168.014 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -53.23 -41.26 65.22 Favored 'General case' 0 N--CA 1.519 3.007 0 C-N-CA 124.501 1.121 . . . . 0.0 110.159 174.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.671 ' CH2' ' HB2' ' B' ' 529' ' ' ALA . 51.1 t90 -64.46 -35.29 80.45 Favored 'General case' 0 N--CA 1.532 3.665 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 176.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.37 -38.56 59.14 Favored 'General case' 0 N--CA 1.537 3.901 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 176.212 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -69.97 -36.41 75.2 Favored 'General case' 0 N--CA 1.539 3.994 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 175.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.428 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 0.8 OUTLIER -59.12 -24.4 62.94 Favored 'General case' 1 N--CA 1.549 4.522 0 C-N-CA 123.419 0.688 . . . . 0.0 109.984 175.124 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.529 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -119.7 3.66 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.39 0 C-N-CA 123.615 0.766 . . . . 0.0 112.356 -177.345 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -98.68 -59.36 1.75 Allowed 'General case' 0 N--CA 1.517 2.909 0 N-CA-C 104.346 -2.464 . . . . 0.0 104.346 175.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 1.6 tp -64.15 -37.47 87.57 Favored 'General case' 0 N--CA 1.528 3.464 0 C-N-CA 124.687 1.195 . . . . 0.0 109.602 176.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 60.0 tttt 94.34 -38.59 0.01 OUTLIER 'General case' 0 N--CA 1.539 4.0 0 C-N-CA 126.917 2.087 . . . . 0.0 110.831 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 6.8 t . . . . . 0 N--CA 1.539 3.98 0 C-N-CA 124.477 1.111 . . . . 0.0 111.171 179.788 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 . . . . . 0 N--CA 1.504 2.274 0 CA-C-O 120.196 0.045 . . . . 0.0 110.906 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 70.1 m -121.82 124.37 27.09 Favored Pre-proline 0 N--CA 1.522 3.162 0 CA-C-O 117.392 -1.29 . . . . 0.0 109.437 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -72.55 159.55 48.7 Favored 'Trans proline' 0 C--N 1.391 2.806 0 C-N-CA 122.221 1.947 . . . . 0.0 111.613 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 85.44 -61.23 0.07 Allowed 'General case' 1 N--CA 1.544 4.251 0 C-N-CA 126.11 1.764 . . . . 0.0 110.234 -179.673 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 36.9 p -87.97 134.27 33.76 Favored 'General case' 0 N--CA 1.526 3.334 0 C-N-CA 123.257 0.623 . . . . 0.0 111.02 -178.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -123.53 116.71 23.63 Favored 'General case' 0 N--CA 1.513 2.702 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 178.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -97.66 127.97 44.01 Favored 'General case' 0 N--CA 1.521 3.085 0 C-N-CA 122.476 0.31 . . . . 0.0 111.041 -177.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 16.7 ttt -111.65 135.9 51.62 Favored 'General case' 0 N--CA 1.523 3.178 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 178.44 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . 68.57 132.39 0.03 OUTLIER 'General case' 1 N--CA 1.54 4.046 0 C-N-CA 123.89 0.876 . . . . 0.0 109.705 -179.061 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -69.59 -36.97 76.72 Favored 'General case' 0 N--CA 1.532 3.643 0 CA-C-O 118.876 -0.583 . . . . 0.0 110.956 -179.275 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 63.6 mm-40 -83.06 110.26 17.84 Favored 'General case' 0 N--CA 1.523 3.178 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 29.7 ptt180 -79.89 142.65 34.98 Favored 'General case' 0 N--CA 1.53 3.566 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -177.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 77.4 m-70 -138.89 122.78 17.74 Favored 'General case' 0 N--CA 1.524 3.269 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 177.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -108.13 140.89 40.67 Favored 'General case' 0 N--CA 1.529 3.505 0 C-N-CA 123.483 0.713 . . . . 0.0 110.901 -178.108 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -95.17 -83.15 0.36 Allowed 'General case' 0 N--CA 1.52 3.025 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 519' ' ' TRP . . . . . 0.524 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 67.9 t-105 -42.92 -28.15 0.24 Allowed 'General case' 1 N--CA 1.549 4.489 0 CA-C-N 119.641 1.11 . . . . 0.0 113.65 179.865 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 520' ' ' LEU . . . . . 0.58 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.2 mm? -95.03 -29.1 14.78 Favored 'General case' 0 N--CA 1.53 3.532 0 CA-C-O 117.84 -1.076 . . . . 0.0 113.827 -172.426 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -27.23 68.26 Favored 'General case' 1 N--CA 1.545 4.297 0 N-CA-C 105.426 -2.064 . . . . 0.0 105.426 171.02 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 522' ' ' PHE . . . . . 0.561 ' O ' HD23 ' B' ' 526' ' ' LEU . 0.9 OUTLIER -78.08 -40.37 38.67 Favored 'General case' 0 N--CA 1.507 2.402 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 174.77 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 37.0 t -63.02 -22.43 30.65 Favored 'Isoleucine or valine' 1 N--CA 1.569 5.48 0 CA-C-N 120.283 1.401 . . . . 0.0 111.965 178.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -76.89 -49.83 14.75 Favored 'General case' 0 N--CA 1.536 3.84 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 179.263 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 6.7 tt -63.45 -31.4 72.55 Favored 'General case' 0 N--CA 1.538 3.939 0 O-C-N 123.29 0.369 . . . . 0.0 110.115 176.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 526' ' ' LEU . . . . . 0.561 HD23 ' O ' ' B' ' 522' ' ' PHE . 3.7 mm? -68.65 -33.78 74.58 Favored 'General case' 0 N--CA 1.523 3.223 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 177.331 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 527' ' ' LYS . . . . . 0.433 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 31.4 ttmt -67.66 -26.57 66.28 Favored 'General case' 0 N--CA 1.518 2.971 0 CA-C-O 118.161 -0.923 . . . . 0.0 110.853 177.298 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -69.58 -37.43 76.95 Favored 'General case' 0 N--CA 1.536 3.854 0 CA-C-N 119.462 1.028 . . . . 0.0 108.896 176.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 529' ' ' ALA . . . . . 0.671 ' HB2' ' CH2' ' A' ' 99' ' ' TRP . . . -90.98 -9.46 45.92 Favored 'General case' 0 CA--C 1.579 2.084 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.967 178.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 530' ' ' TYR . . . . . 0.496 ' CZ ' HG13 ' A' ' 23' ' ' VAL . 1.2 m-85 -82.32 -32.11 29.59 Favored 'General case' 0 N--CA 1.531 3.6 0 CA-C-N 120.312 1.414 . . . . 0.0 109.328 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -65.85 -43.0 89.76 Favored 'General case' 0 N--CA 1.534 3.766 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 177.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 65.6 m-80 -90.82 -90.15 0.16 Allowed 'General case' 0 N--CA 1.514 2.754 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 154.86 50.74 0.0 OUTLIER 'General case' 1 N--CA 1.559 4.977 0 C-N-CA 127.574 2.35 . . . . 0.0 107.984 177.384 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 534' ' ' LEU . . . . . 0.597 HD22 ' CD2' ' A' ' 96' ' ' LEU . 6.9 mt -106.35 7.83 31.42 Favored 'General case' 0 N--CA 1.528 3.449 0 C-N-CA 124.297 1.039 . . . . 0.0 111.021 -178.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 535' ' ' HIS . . . . . 0.616 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 29.3 p-80 -80.57 0.01 35.77 Favored 'General case' 0 N--CA 1.514 2.732 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 175.29 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 536' ' ' LEU . . . . . 0.418 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 35.5 mt -94.23 -50.95 0.26 Allowed Pre-proline 0 N--CA 1.505 2.283 0 CA-C-O 116.486 -1.721 . . . . 0.0 109.263 -175.497 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 537' ' ' PRO . . . . . 0.418 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 5.2 Cg_exo -66.33 -35.37 31.8 Favored 'Trans proline' 0 C--N 1.394 2.966 0 N-CA-C 106.775 -2.048 . . . . 0.0 106.775 171.283 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 538' ' ' LEU . . . . . 0.441 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 1.0 OUTLIER -62.24 -41.7 98.66 Favored 'General case' 0 N--CA 1.524 3.251 0 C-N-CA 124.267 1.027 . . . . 0.0 108.334 175.979 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 11.5 mt -72.14 -21.76 61.42 Favored 'General case' 1 N--CA 1.54 4.057 0 CA-C-O 118.358 -0.83 . . . . 0.0 111.057 178.573 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -77.72 -6.18 53.11 Favored 'General case' 0 N--CA 1.524 3.234 0 CA-C-N 118.976 0.807 . . . . 0.0 110.44 177.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 541' ' ' LEU . . . . . 0.634 HD13 ' N ' ' B' ' 542' ' ' MET . 0.0 OUTLIER -109.88 -47.77 3.3 Favored 'General case' 0 N--CA 1.512 2.63 0 C-N-CA 124.053 0.941 . . . . 0.0 109.445 -179.092 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 542' ' ' MET . . . . . 0.634 ' N ' HD13 ' B' ' 541' ' ' LEU . 12.7 ptp -89.76 -10.54 45.21 Favored 'General case' 0 N--CA 1.536 3.852 0 CA-C-O 117.407 -1.282 . . . . 0.0 113.542 -177.836 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 543' ' ' LEU . . . . . 0.575 ' O ' HG23 ' B' ' 544' ' ' THR . 1.2 tt -128.2 -112.58 0.27 Allowed 'General case' 0 N--CA 1.53 3.563 0 CA-C-O 116.558 -1.687 . . . . 0.0 112.752 -178.053 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 544' ' ' THR . . . . . 0.575 HG23 ' O ' ' B' ' 543' ' ' LEU . 2.2 p -174.56 161.66 2.64 Favored Pre-proline 1 N--CA 1.561 5.087 0 CA-C-N 121.505 1.957 . . . . 0.0 111.245 -178.483 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -74.81 -42.49 0.55 Allowed 'Trans proline' 0 C--N 1.388 2.621 0 C-N-CA 123.021 2.481 . . . . 0.0 109.733 176.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -58.28 -31.9 67.91 Favored 'General case' 1 N--CA 1.543 4.192 0 C-N-CA 123.707 0.803 . . . . 0.0 111.63 179.729 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -71.96 -34.09 68.7 Favored 'General case' 0 N--CA 1.526 3.35 0 CA-C-O 117.843 -1.075 . . . . 0.0 110.664 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 32.1 ptt180 -79.09 -23.51 44.08 Favored 'General case' 0 N--CA 1.533 3.692 0 CA-C-N 119.597 1.09 . . . . 0.0 110.133 177.087 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -65.16 -41.48 94.66 Favored 'General case' 0 N--CA 1.536 3.828 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 173.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -78.14 -19.95 53.01 Favored 'General case' 0 N--CA 1.508 2.448 0 CA-C-O 116.992 -1.48 . . . . 0.0 111.185 177.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 551' ' ' LEU . . . . . 0.587 HD22 ' CZ3' ' A' ' 19' ' ' TRP . 18.0 tp -76.44 -28.19 56.5 Favored 'General case' 0 N--CA 1.529 3.497 0 CA-C-N 121.368 1.895 . . . . 0.0 108.52 175.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -72.23 -56.3 6.38 Favored Glycine 0 N--CA 1.501 2.993 0 N-CA-C 108.491 -1.844 . . . . 0.0 108.491 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.4 m -66.19 -28.18 68.56 Favored 'General case' 0 N--CA 1.537 3.913 0 CA-C-O 118.432 -0.794 . . . . 0.0 112.05 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 26.0 mtm-85 -69.22 -45.81 68.94 Favored 'General case' 1 N--CA 1.541 4.102 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 176.459 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 555' ' ' VAL . . . . . 0.483 HG23 ' O ' ' B' ' 551' ' ' LEU . 34.9 t -70.73 -15.47 18.93 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.66 0 CA-C-O 118.11 -0.947 . . . . 0.0 109.353 177.161 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -79.82 -44.35 20.72 Favored 'General case' 0 N--CA 1.523 3.222 0 CA-C-O 117.395 -1.288 . . . . 0.0 111.212 178.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 557' ' ' ILE . . . . . 0.483 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -72.3 -25.07 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.213 0 CA-C-N 121.428 1.922 . . . . 0.0 110.107 179.88 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 558' ' ' VAL . . . . . 0.57 HG11 HD11 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -84.32 -52.76 12.24 Favored 'Isoleucine or valine' 1 N--CA 1.547 4.397 0 CA-C-N 120.736 1.607 . . . . 0.0 107.541 -179.888 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -58.07 -25.69 61.59 Favored 'General case' 0 N--CA 1.529 3.507 0 CA-C-O 118.874 -0.584 . . . . 0.0 110.696 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -93.7 -24.58 17.8 Favored 'General case' 0 N--CA 1.523 3.225 0 CA-C-O 118.132 -0.937 . . . . 0.0 111.043 178.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.92 -38.71 66.76 Favored 'General case' 1 N--CA 1.541 4.092 0 CA-C-N 119.728 1.149 . . . . 0.0 108.561 177.776 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 34.7 mt -57.35 -22.32 41.63 Favored 'General case' 0 N--CA 1.536 3.857 0 C-N-CA 123.665 0.786 . . . . 0.0 111.545 177.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 24.5 mmm180 -77.77 -51.39 10.6 Favored 'General case' 0 N--CA 1.527 3.406 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 66.97 50.57 45.85 Favored Glycine 1 N--CA 1.522 4.386 0 CA-C-O 119.086 -0.841 . . . . 0.0 112.494 178.396 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -124.76 -54.21 1.65 Allowed 'General case' 0 N--CA 1.527 3.405 0 CA-C-N 118.362 1.081 . . . . 0.0 108.431 178.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 30.6 mtt -148.98 64.32 1.04 Allowed 'General case' 0 N--CA 1.522 3.168 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 567' ' ' SER . . . . . 0.405 ' HA ' ' HB2' ' B' ' 571' ' ' LEU . 80.0 p -130.87 -4.83 4.02 Favored 'General case' 0 N--CA 1.52 3.063 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -175.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -93.49 -78.43 0.43 Allowed 'General case' 0 N--CA 1.528 3.468 0 CA-C-N 120.164 1.347 . . . . 0.0 111.255 -179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.79 -34.86 13.02 Favored 'General case' 1 N--CA 1.541 4.086 0 CA-C-N 119.146 0.885 . . . . 0.0 112.043 -178.492 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -76.96 -11.08 59.76 Favored 'General case' 0 N--CA 1.52 3.028 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -178.04 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 571' ' ' LEU . . . . . 0.81 HD23 HD11 ' B' ' 582' ' ' ILE . 16.8 tp -83.17 -43.65 15.93 Favored 'General case' 0 N--CA 1.532 3.639 0 CA-C-N 119.749 1.158 . . . . 0.0 112.649 -177.572 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -44.63 -29.21 0.7 Allowed 'General case' 1 N--CA 1.556 4.856 0 CA-C-N 120.249 1.386 . . . . 0.0 113.474 -178.591 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -66.4 -46.35 76.88 Favored 'General case' 0 N--CA 1.538 3.96 0 CA-C-N 118.698 0.681 . . . . 0.0 109.414 179.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -57.53 -51.13 70.71 Favored 'General case' 0 N--CA 1.525 3.293 0 C-N-CA 124.662 1.185 . . . . 0.0 112.413 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 61.0 mt -108.77 -61.83 1.55 Allowed 'General case' 0 N--CA 1.53 3.534 0 C-N-CA 122.988 0.515 . . . . 0.0 111.828 -177.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 122.81 20.82 2.76 Favored Glycine 1 N--CA 1.529 4.898 0 CA-C-O 118.199 -1.334 . . . . 0.0 112.619 -178.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -86.27 119.31 26.41 Favored 'General case' 0 N--CA 1.522 3.135 0 CA-C-N 119.577 1.689 . . . . 0.0 107.021 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -42.26 167.97 0.01 OUTLIER Glycine 1 N--CA 1.538 5.444 0 C-N-CA 124.616 1.103 . . . . 0.0 115.209 -177.536 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 579' ' ' ILE . . . . . 0.493 HG21 ' N6 ' ' E' ' 4' ' ' ' DA' . 0.7 OUTLIER -80.27 -19.05 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.743 0 CA-C-O 117.632 -1.175 . . . . 0.0 108.568 178.74 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 580' ' ' ALA . . . . . 0.778 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -69.22 -37.21 77.91 Favored 'General case' 0 N--CA 1.527 3.424 0 CA-C-N 119.879 1.218 . . . . 0.0 109.501 176.361 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.4 -36.65 38.81 Favored 'General case' 0 N--CA 1.536 3.831 0 CA-C-N 118.978 0.808 . . . . 0.0 111.776 178.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 582' ' ' ILE . . . . . 0.81 HD11 HD23 ' B' ' 571' ' ' LEU . 3.1 tt -67.07 -38.41 81.2 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.216 0 CA-C-O 118.975 -0.535 . . . . 0.0 112.223 -175.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 583' ' ' THR . . . . . 0.445 HG23 HG23 ' B' ' 582' ' ' ILE . 69.8 p -99.11 -27.34 13.87 Favored 'General case' 0 N--CA 1.508 2.443 0 CA-C-O 117.812 -1.089 . . . . 0.0 111.837 -178.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 13.3 ptt180 -73.66 -24.87 60.04 Favored 'General case' 0 N--CA 1.531 3.584 0 CA-C-N 120.061 1.301 . . . . 0.0 109.762 176.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -68.88 -36.11 81.08 Favored Glycine 1 N--CA 1.517 4.081 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 177.149 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 35.2 p -78.68 -29.49 45.62 Favored 'General case' 0 N--CA 1.531 3.607 0 CA-C-N 118.05 0.925 . . . . 0.0 111.278 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -64.01 -30.89 71.93 Favored 'General case' 1 N--CA 1.544 4.233 0 CA-C-N 119.346 0.976 . . . . 0.0 110.683 179.032 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 3.8 m -59.02 -35.98 74.2 Favored 'General case' 1 N--CA 1.541 4.108 0 C-N-CA 123.276 0.63 . . . . 0.0 110.411 178.412 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 43.7 mt -52.56 -45.84 66.57 Favored 'General case' 0 N--CA 1.532 3.641 0 C-N-CA 124.582 1.153 . . . . 0.0 111.398 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.52 -34.85 69.54 Favored 'General case' 1 N--CA 1.543 4.222 0 C-N-CA 123.268 0.627 . . . . 0.0 111.815 -179.744 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -81.2 -34.01 32.58 Favored 'General case' 0 N--CA 1.519 2.992 0 CA-C-O 118.878 -0.582 . . . . 0.0 111.859 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 592' ' ' ALA . . . . . 0.55 ' HB1' ' HD2' ' B' ' 593' ' ' PRO . . . -61.94 171.99 1.3 Allowed Pre-proline 1 N--CA 1.54 4.061 0 CA-C-O 118.218 -0.896 . . . . 0.0 111.707 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 593' ' ' PRO . . . . . 0.55 ' HD2' ' HB1' ' B' ' 592' ' ' ALA . 61.4 Cg_endo -83.17 140.73 10.0 Favored 'Trans proline' 0 C--N 1.377 2.033 0 C-N-CA 121.775 1.65 . . . . 0.0 109.207 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.3 t -79.64 -20.82 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.019 0 CA-C-O 117.928 -1.034 . . . . 0.0 111.027 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -63.54 -41.91 98.44 Favored 'General case' 0 N--CA 1.516 2.856 0 CA-C-N 120.101 1.319 . . . . 0.0 109.786 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 596' ' ' LEU . . . . . 0.529 ' CD2' HD22 ' A' ' 34' ' ' LEU . 7.4 mp -97.64 -13.79 21.33 Favored 'General case' 0 N--CA 1.511 2.592 0 C-N-CA 123.683 0.793 . . . . 0.0 111.349 177.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.16 -32.18 73.1 Favored 'General case' 1 N--CA 1.541 4.081 0 N-CA-C 103.595 -2.743 . . . . 0.0 103.595 168.496 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -54.16 -38.26 65.33 Favored 'General case' 0 N--CA 1.519 3.003 0 C-N-CA 124.532 1.133 . . . . 0.0 109.693 174.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 599' ' ' TRP . . . . . 0.631 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 49.7 t90 -63.25 -37.16 86.15 Favored 'General case' 0 N--CA 1.528 3.432 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 176.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -51.34 -39.03 56.16 Favored 'General case' 1 N--CA 1.543 4.204 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 175.869 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -69.64 -37.15 76.67 Favored 'General case' 1 N--CA 1.543 4.177 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 175.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 602' ' ' GLU . . . . . 0.43 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 2.9 mt-10 -59.35 -23.25 62.37 Favored 'General case' 1 N--CA 1.547 4.41 0 C-N-CA 123.424 0.69 . . . . 0.0 110.141 175.101 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 603' ' ' VAL . . . . . 0.543 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.2 OUTLIER -120.77 3.49 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.323 0 C-N-CA 123.566 0.747 . . . . 0.0 112.468 -177.399 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -111.68 -61.49 1.7 Allowed 'General case' 0 N--CA 1.509 2.508 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 176.447 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.74 -65.86 0.63 Allowed 'General case' 0 N--CA 1.535 3.792 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 177.679 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt 84.68 -44.48 0.08 Allowed 'General case' 0 N--CA 1.535 3.819 0 C-N-CA 126.452 1.901 . . . . 0.0 111.647 178.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 37.0 p . . . . . 0 N--CA 1.526 3.336 0 CA-C-O 118.129 -0.938 . . . . 0.0 109.582 179.836 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 898' ' ' TRP . . . . . 0.469 ' HB2' HG23 ' B' ' 544' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.209 0 CA-C-O 117.849 -1.072 . . . . 0.0 109.033 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 998' ' ' TRP . . . . . 0.57 ' HB2' HG23 ' A' ' 44' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.161 0 CA-C-O 118.315 -0.85 . . . . 0.0 109.537 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.054 3 O4'-C1'-N19 119.843 15.054 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.057 4 O4'-C1'-N19 120.187 15.484 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -9.982 3 O4'-C1'-N19 119.039 14.048 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . 0.61 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 6 C3'--C2' 1.416 -10.155 4 O4'-C1'-N19 120.195 15.493 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' E' E ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.566 10.392 3 C4'-C3'-C2' 116.98 13.78 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.41 -10.756 5 O4'-C1'-N19 119.731 14.913 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' E' E ' 7' ' ' ' DA' . . . . . 0.647 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 5 C3'--C2' 1.392 -12.567 4 C4'-C3'-C2' 113.058 9.858 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' E' E ' 8' ' ' ' DG' . . . . . 0.647 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.42 -9.816 4 O4'-C1'-N19 120.108 15.385 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.574 11.015 4 C4'-C3'-C2' 116.596 13.396 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.406 -11.171 5 O4'-C1'-N19 119.144 14.18 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.571 10.783 2 O4'-C1'-N19 120.004 15.255 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.406 -11.219 4 O4'-C1'-N19 119.654 14.818 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.415 -10.349 5 O4'-C1'-N19 119.876 15.094 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' E' E ' 14' ' ' ' DT' . . . . . 0.641 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.417 -10.077 2 O4'-C1'-N19 119.612 14.765 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' E' E ' 15' ' ' ' DA' . . . . . 0.939 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.416 -10.234 6 O4'-C1'-N19 119.766 14.957 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.416 -10.227 6 O4'-C1'-N19 119.513 14.641 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.578 11.317 4 O4'-C1'-N19 119.786 14.983 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.42 -9.796 4 O4'-C1'-N19 120.356 15.695 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.094 5 O4'-C1'-N19 120.004 15.255 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.598 6.995 4 O4'-C1'-N19 120.24 15.551 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.197 4 O4'-C1'-N19 118.582 13.477 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.405 -11.32 3 O4'-C1'-N19 118.919 13.899 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' F' F ' 3' ' ' ' DT' . . . . . 0.411 ' H71' ' OE1' ' A' ' 68' ' ' GLN . . . . . . . . 6 C3'--C2' 1.409 -10.862 3 O4'-C1'-N19 119.718 14.897 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' F' F ' 4' ' ' ' DA' . . . . . 0.576 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 6 O3'--C3' 1.563 10.158 4 O4'-C1'-N19 119.185 14.231 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' F' F ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.572 10.856 4 O4'-C1'-N19 118.773 13.716 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.408 -10.97 4 C4'-C3'-C2' 115.985 12.785 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.408 -12.013 4 N19-C1'-C2' 130.071 9.919 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.425 -9.341 3 O4'-C1'-N19 119.527 14.659 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.565 10.301 3 O4'-C1'-N19 119.665 14.831 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' F' F ' 10' ' ' ' DT' . . . . . 0.461 " H4'" ' OP1' ' F' ' 11' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.417 -10.076 5 O4'-C1'-N19 117.531 12.163 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . 0.461 ' OP1' " H4'" ' F' ' 10' ' ' ' DT' . . . . . . . . 5 C3'--C2' 1.413 -10.527 4 O4'-C1'-N19 121.533 17.166 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.618 5 O4'-C1'-N19 120.473 15.841 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.706 3 O4'-C1'-N19 120.914 16.392 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' F' F ' 14' ' ' ' DT' . . . . . 0.655 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 O3'--C3' 1.567 10.459 3 O4'-C1'-N19 119.129 14.161 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' F' F ' 15' ' ' ' DA' . . . . . 0.822 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.415 -10.254 6 O4'-C1'-N19 120.173 15.466 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.415 -10.328 5 O4'-C1'-N19 120.03 15.287 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.135 4 O4'-C1'-N19 119.239 14.299 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.47 5 O4'-C1'-N19 119.997 15.246 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.485 4 O4'-C1'-N19 120.397 15.746 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.511 6.966 4 O4'-C1'-N19 120.19 15.488 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 . . . . . 0 N--CA 1.498 1.947 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 36.2 p -102.77 152.5 38.46 Favored Pre-proline 0 N--CA 1.534 3.739 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.661 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -74.02 124.84 9.4 Favored 'Trans proline' 0 C--N 1.388 2.618 0 C-N-CA 122.468 2.112 . . . . 0.0 110.935 -179.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -145.49 -57.0 0.32 Allowed 'General case' 0 N--CA 1.525 3.313 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 179.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.0 p -105.61 149.86 25.93 Favored 'General case' 0 N--CA 1.528 3.426 0 C-N-CA 123.687 0.795 . . . . 0.0 108.87 177.121 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 71.19 127.71 0.03 OUTLIER 'General case' 1 N--CA 1.544 4.26 0 C-N-CA 123.884 0.874 . . . . 0.0 109.154 -178.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.66 -56.75 4.33 Favored 'General case' 0 N--CA 1.524 3.238 0 CA-C-O 119.107 -0.473 . . . . 0.0 111.162 -178.505 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 13.3 ttt -113.8 123.41 49.76 Favored 'General case' 0 N--CA 1.519 3.01 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -137.79 131.99 32.02 Favored 'General case' 0 N--CA 1.523 3.209 0 C-N-CA 123.637 0.775 . . . . 0.0 109.167 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -142.39 132.3 24.34 Favored 'General case' 0 N--CA 1.518 2.965 0 CA-C-N 117.905 0.32 . . . . 0.0 111.252 -178.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 65.4 mm-40 -102.78 -42.97 5.7 Favored 'General case' 0 N--CA 1.525 3.296 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 176.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 87.5 mtm180 68.49 139.92 0.03 OUTLIER 'General case' 0 N--CA 1.526 3.342 0 C-N-CA 125.014 1.326 . . . . 0.0 112.509 177.298 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 12.4 p-80 -146.99 -37.37 0.22 Allowed 'General case' 0 N--CA 1.524 3.254 0 C-N-CA 123.894 0.878 . . . . 0.0 110.554 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -68.33 132.94 47.95 Favored 'General case' 0 N--CA 1.527 3.424 0 C-N-CA 123.334 0.654 . . . . 0.0 111.533 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -148.91 -66.21 0.23 Allowed 'General case' 0 N--CA 1.528 3.445 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 177.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.663 ' CE3' HD22 ' B' ' 551' ' ' LEU . 61.6 t-105 -54.65 -38.26 66.67 Favored 'General case' 0 N--CA 1.531 3.598 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 173.334 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.478 ' N ' HD22 ' A' ' 20' ' ' LEU . 2.8 mm? -80.03 -27.27 39.5 Favored 'General case' 0 N--CA 1.517 2.881 0 CA-C-O 117.263 -1.351 . . . . 0.0 112.279 -175.671 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 mmt180 -57.9 -31.54 66.86 Favored 'General case' 1 N--CA 1.549 4.508 0 N-CA-C 105.335 -2.098 . . . . 0.0 105.335 172.138 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.501 ' O ' ' HB2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -76.59 -41.98 44.23 Favored 'General case' 0 N--CA 1.503 2.2 0 CA-C-O 116.718 -1.61 . . . . 0.0 109.382 173.628 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 26.8 t -69.91 -25.04 27.24 Favored 'Isoleucine or valine' 1 N--CA 1.566 5.349 0 CA-C-N 120.566 1.53 . . . . 0.0 113.981 -174.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -76.29 -51.56 11.74 Favored 'General case' 0 N--CA 1.535 3.815 0 CA-C-N 120.392 1.451 . . . . 0.0 108.276 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.5 mp -74.68 -12.33 60.4 Favored 'General case' 0 N--CA 1.52 3.059 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 175.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.501 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -70.76 -36.92 73.33 Favored 'General case' 0 N--CA 1.521 3.097 0 N-CA-C 106.495 -1.669 . . . . 0.0 106.495 173.22 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.441 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 17.5 tttt -62.79 -22.15 66.4 Favored 'General case' 0 N--CA 1.525 3.276 0 CA-C-O 118.495 -0.764 . . . . 0.0 111.006 176.346 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -70.36 -45.53 65.89 Favored 'General case' 0 N--CA 1.538 3.927 0 N-CA-C 108.307 -0.998 . . . . 0.0 108.307 176.604 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.661 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -81.67 -9.37 59.67 Favored 'General case' 0 N--CA 1.508 2.455 0 CA-C-O 118.695 -0.669 . . . . 0.0 110.841 177.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.441 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -81.4 -36.15 29.88 Favored 'General case' 0 N--CA 1.533 3.707 0 CA-C-N 120.251 1.387 . . . . 0.0 109.066 179.987 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -59.99 -42.43 94.18 Favored 'General case' 0 N--CA 1.536 3.863 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 177.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 61.3 m-80 -90.15 -85.59 0.21 Allowed 'General case' 0 N--CA 1.513 2.717 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 176.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 147.94 50.96 0.0 OUTLIER 'General case' 1 N--CA 1.555 4.792 0 C-N-CA 128.042 2.537 . . . . 0.0 108.422 177.61 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.447 HD22 ' CD2' ' B' ' 596' ' ' LEU . 3.7 mt -111.63 12.38 21.2 Favored 'General case' 0 N--CA 1.526 3.339 0 C-N-CA 124.822 1.249 . . . . 0.0 110.021 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.549 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 51.6 p-80 -83.91 6.66 20.88 Favored 'General case' 0 N--CA 1.507 2.41 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 175.364 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.834 ' HA ' HD23 ' A' ' 39' ' ' LEU . 18.6 mt -96.37 -52.04 0.23 Allowed Pre-proline 0 N--CA 1.509 2.505 0 CA-C-O 116.794 -1.574 . . . . 0.0 108.828 -175.556 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.477 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 5.7 Cg_exo -66.02 -32.27 44.59 Favored 'Trans proline' 0 C--N 1.396 3.04 0 N-CA-C 106.489 -2.158 . . . . 0.0 106.489 170.642 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.549 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.9 OUTLIER -64.14 -39.22 93.57 Favored 'General case' 0 N--CA 1.517 2.9 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 175.679 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.834 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -71.35 -21.5 62.03 Favored 'General case' 1 N--CA 1.543 4.196 0 CA-C-N 119.324 0.966 . . . . 0.0 109.978 176.547 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -85.73 -3.19 58.83 Favored 'General case' 0 N--CA 1.527 3.42 0 CA-C-N 119.106 0.866 . . . . 0.0 111.131 177.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.569 HD13 ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -112.96 -36.09 5.23 Favored 'General case' 0 N--CA 1.53 3.548 0 CA-C-N 119.698 1.135 . . . . 0.0 111.558 -178.26 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.569 ' N ' HD13 ' A' ' 41' ' ' LEU . 3.9 ptt? -126.81 27.18 6.07 Favored 'General case' 1 N--CA 1.554 4.725 0 CA-C-N 120.249 1.386 . . . . 0.0 111.674 -179.687 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.3 tp -134.1 -61.89 0.77 Allowed 'General case' 0 N--CA 1.516 2.867 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.9 p 118.5 158.8 0.0 OUTLIER Pre-proline 1 N--CA 1.566 5.345 0 C-N-CA 128.348 2.659 . . . . 0.0 109.495 -178.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -69.26 -31.26 23.1 Favored 'Trans proline' 0 C--N 1.392 2.864 0 C-N-CA 122.163 1.908 . . . . 0.0 109.058 175.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -67.17 -21.07 65.81 Favored 'General case' 0 N--CA 1.528 3.441 0 CA-C-O 118.131 -0.937 . . . . 0.0 110.243 176.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -75.46 -29.74 59.74 Favored 'General case' 0 N--CA 1.521 3.086 0 CA-C-O 117.599 -1.191 . . . . 0.0 109.853 178.21 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -87.18 -22.03 25.54 Favored 'General case' 0 N--CA 1.539 3.995 0 CA-C-N 119.933 1.242 . . . . 0.0 109.026 174.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -71.58 -27.94 63.49 Favored 'General case' 0 N--CA 1.527 3.423 0 N-CA-C 106.433 -1.692 . . . . 0.0 106.433 172.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.48 -27.24 20.48 Favored 'General case' 0 N--CA 1.503 2.177 0 CA-C-O 117.432 -1.27 . . . . 0.0 110.405 178.603 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 27.6 tp -75.55 -21.74 57.64 Favored 'General case' 0 N--CA 1.537 3.915 0 N-CA-C 106.249 -1.76 . . . . 0.0 106.249 173.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.459 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -67.85 -72.42 0.8 Allowed Glycine 0 C--N 1.376 2.802 0 N-CA-C 109.198 -1.561 . . . . 0.0 109.198 176.326 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.7 m -66.08 -22.38 66.41 Favored 'General case' 0 N--CA 1.535 3.82 0 CA-C-O 117.468 -1.253 . . . . 0.0 113.204 -179.091 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.3 mtm180 -71.27 -52.66 17.71 Favored 'General case' 0 N--CA 1.538 3.933 0 CA-C-N 120.498 1.499 . . . . 0.0 107.464 177.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.3 t -67.63 -16.2 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.903 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.84 176.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -76.09 -46.66 27.85 Favored 'General case' 0 N--CA 1.531 3.59 0 CA-C-N 120.052 1.296 . . . . 0.0 111.172 178.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.589 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -72.2 -23.04 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.376 0 CA-C-N 120.563 1.529 . . . . 0.0 111.573 -178.922 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.452 HG11 HD11 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -88.79 -53.31 9.75 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.765 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 -179.903 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -57.39 -22.61 44.03 Favored 'General case' 0 N--CA 1.531 3.609 0 CA-C-O 118.454 -0.784 . . . . 0.0 110.755 178.078 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -95.33 -29.01 14.69 Favored 'General case' 0 N--CA 1.522 3.132 0 CA-C-O 118.148 -0.929 . . . . 0.0 110.365 177.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 45.6 tp -67.6 -56.33 9.83 Favored 'General case' 1 N--CA 1.539 4.007 0 CA-C-N 119.598 1.09 . . . . 0.0 110.073 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 54.9 mt -54.02 -24.64 17.68 Favored 'General case' 1 N--CA 1.541 4.09 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 -179.26 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -79.22 -48.83 13.51 Favored 'General case' 0 N--CA 1.53 3.531 0 CA-C-N 118.669 0.668 . . . . 0.0 110.045 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 74.61 81.14 0.48 Allowed Glycine 1 N--CA 1.521 4.344 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 179.491 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -158.57 -57.17 0.07 Allowed 'General case' 0 N--CA 1.53 3.528 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 44.1 mtt -138.61 76.56 1.58 Allowed 'General case' 0 N--CA 1.522 3.156 0 N-CA-C 104.344 -2.465 . . . . 0.0 104.344 177.51 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.5 m -128.5 -33.17 2.12 Favored 'General case' 0 N--CA 1.525 3.324 0 N-CA-C 114.104 1.15 . . . . 0.0 114.104 -172.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.411 ' OE1' ' H71' ' F' ' 3' ' ' ' DT' . 31.7 mt-30 -105.91 -65.65 1.05 Allowed 'General case' 0 N--CA 1.526 3.343 0 CA-C-N 118.727 0.694 . . . . 0.0 111.933 -176.57 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 10.7 mtt180 -97.24 -45.59 6.45 Favored 'General case' 0 N--CA 1.526 3.361 0 CA-C-N 118.485 0.584 . . . . 0.0 111.419 -177.45 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -71.81 -14.87 62.1 Favored 'General case' 0 N--CA 1.521 3.083 0 CA-C-O 118.439 -0.791 . . . . 0.0 112.297 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.605 HD23 HG21 ' A' ' 82' ' ' ILE . 24.1 tp -79.14 -54.9 5.53 Favored 'General case' 0 N--CA 1.525 3.298 0 CA-C-N 119.484 1.038 . . . . 0.0 111.62 -178.666 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -41.77 -36.55 1.03 Allowed 'General case' 1 N--CA 1.549 4.511 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -178.174 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 14.1 t30 -74.12 -39.97 62.99 Favored 'General case' 0 N--CA 1.532 3.642 0 CA-C-N 118.112 0.415 . . . . 0.0 111.035 -178.242 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -46.3 -54.38 9.04 Favored 'General case' 0 N--CA 1.537 3.886 0 C-N-CA 124.824 1.25 . . . . 0.0 113.409 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -133.23 -39.88 0.92 Allowed 'General case' 0 N--CA 1.533 3.683 0 CA-C-O 118.63 -0.7 . . . . 0.0 111.835 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 117.77 86.79 1.17 Allowed Glycine 1 N--CA 1.523 4.486 0 N-CA-C 110.51 -1.036 . . . . 0.0 110.51 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -115.92 -47.1 2.8 Favored 'General case' 0 N--CA 1.522 3.152 0 C-N-CA 123.613 0.765 . . . . 0.0 109.397 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.99 161.67 22.84 Favored Glycine 1 N--CA 1.525 4.629 0 N-CA-C 109.771 -1.331 . . . . 0.0 109.771 -179.039 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.576 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.9 OUTLIER -83.11 -14.98 11.76 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.858 0 CA-C-N 119.439 1.619 . . . . 0.0 108.133 177.781 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.939 ' HB2' ' H62' ' E' ' 15' ' ' ' DA' . . . -70.94 -30.72 67.11 Favored 'General case' 0 N--CA 1.518 2.949 0 CA-C-O 117.463 -1.256 . . . . 0.0 111.239 177.681 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.9 p -93.4 -36.38 12.52 Favored 'General case' 1 N--CA 1.545 4.316 0 CA-C-N 120.45 1.477 . . . . 0.0 112.133 -179.222 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.605 HG21 HD23 ' A' ' 71' ' ' LEU . 1.0 OUTLIER -73.93 -25.38 20.24 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.056 0 CA-C-O 118.101 -0.952 . . . . 0.0 111.898 -179.122 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.5 p -103.95 -29.67 10.79 Favored 'General case' 0 N--CA 1.513 2.697 0 CA-C-O 117.954 -1.022 . . . . 0.0 110.554 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.0 ptt180 -73.28 -25.59 60.74 Favored 'General case' 1 N--CA 1.545 4.287 0 CA-C-N 120.042 1.292 . . . . 0.0 108.154 173.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -64.71 -27.58 72.18 Favored Glycine 1 N--CA 1.524 4.543 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 174.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 20.1 m -70.33 -35.47 73.63 Favored 'General case' 0 N--CA 1.535 3.795 0 CA-C-N 117.973 0.886 . . . . 0.0 108.753 176.28 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -60.92 -30.69 70.35 Favored 'General case' 1 N--CA 1.542 4.143 0 C-N-CA 123.457 0.703 . . . . 0.0 110.096 177.379 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.481 ' HB3' ' HA ' ' B' ' 541' ' ' LEU . 1.6 m -64.76 -38.14 89.98 Favored 'General case' 0 N--CA 1.533 3.711 0 C-N-CA 123.509 0.723 . . . . 0.0 110.716 179.33 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.8 mt -53.39 -37.91 62.9 Favored 'General case' 0 N--CA 1.538 3.935 0 C-N-CA 123.734 0.813 . . . . 0.0 111.135 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -68.27 -36.3 79.19 Favored 'General case' 0 N--CA 1.534 3.755 0 C-N-CA 123.096 0.558 . . . . 0.0 111.174 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.67 -36.77 81.32 Favored 'General case' 0 N--CA 1.525 3.276 0 C-N-CA 123.216 0.607 . . . . 0.0 111.905 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.35 158.41 88.06 Favored Pre-proline 0 N--CA 1.526 3.363 0 CA-C-O 118.535 -0.745 . . . . 0.0 111.851 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -86.46 -178.54 2.75 Favored 'Trans proline' 0 CA--C 1.563 1.972 0 C-N-CA 122.331 2.021 . . . . 0.0 111.189 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.446 ' HA ' ' HB3' ' A' ' 97' ' ' ARG . 3.1 t -97.04 -28.76 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.101 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.773 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -59.78 -45.22 92.94 Favored 'General case' 0 N--CA 1.514 2.762 0 CA-C-N 119.666 1.121 . . . . 0.0 110.009 -178.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.587 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.6 mp -100.02 -11.63 20.42 Favored 'General case' 0 N--CA 1.511 2.591 0 CA-C-O 118.307 -0.854 . . . . 0.0 112.706 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.446 ' HB3' ' HA ' ' A' ' 94' ' ' VAL . 0.2 OUTLIER -67.56 -30.84 70.58 Favored 'General case' 1 N--CA 1.544 4.269 0 N-CA-C 102.368 -3.197 . . . . 0.0 102.368 167.849 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -56.67 -38.54 72.37 Favored 'General case' 0 N--CA 1.515 2.823 0 C-N-CA 124.134 0.973 . . . . 0.0 110.277 175.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.646 ' CH2' ' HB2' ' B' ' 529' ' ' ALA . 53.5 t90 -66.45 -34.22 77.45 Favored 'General case' 0 N--CA 1.538 3.963 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 176.282 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.52 -37.15 62.53 Favored 'General case' 0 N--CA 1.535 3.775 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 176.152 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -68.06 -38.94 83.0 Favored 'General case' 1 N--CA 1.541 4.089 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 175.341 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.51 -23.8 58.99 Favored 'General case' 1 N--CA 1.544 4.247 0 C-N-CA 123.459 0.704 . . . . 0.0 110.643 175.734 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.504 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -120.88 2.73 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.493 0 C-N-CA 123.375 0.67 . . . . 0.0 112.617 -177.143 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -109.57 -56.95 2.24 Favored 'General case' 0 N--CA 1.518 2.935 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 177.117 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.3 tp -50.2 -44.93 53.24 Favored 'General case' 0 N--CA 1.531 3.591 0 C-N-CA 125.149 1.38 . . . . 0.0 111.491 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -80.6 -55.59 4.75 Favored 'General case' 0 N--CA 1.524 3.267 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 N--CA 1.523 3.189 0 CA-C-O 118.761 -0.638 . . . . 0.0 109.992 -179.584 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.503 2.185 0 CA-C-O 119.209 -0.424 . . . . 0.0 109.914 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 58.5 m -110.01 109.57 59.04 Favored Pre-proline 0 N--CA 1.518 2.938 0 CA-C-O 118.031 -0.985 . . . . 0.0 108.666 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -70.09 130.8 19.55 Favored 'Trans proline' 0 C--N 1.394 2.943 0 C-N-CA 122.696 2.264 . . . . 0.0 110.443 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -99.72 140.57 33.73 Favored 'General case' 0 N--CA 1.524 3.272 0 C-N-CA 122.878 0.471 . . . . 0.0 110.579 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 60.8 m 67.35 -82.45 0.03 OUTLIER 'General case' 0 N--CA 1.528 3.432 0 C-N-CA 125.067 1.347 . . . . 0.0 112.627 178.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -114.92 167.09 11.09 Favored 'General case' 0 N--CA 1.53 3.57 0 CA-C-N 119.549 1.068 . . . . 0.0 112.993 -177.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -118.57 144.34 46.17 Favored 'General case' 0 N--CA 1.526 3.341 0 C-N-CA 123.675 0.79 . . . . 0.0 110.678 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 31.7 mtt -100.54 149.39 23.76 Favored 'General case' 0 N--CA 1.537 3.883 0 C-N-CA 123.155 0.582 . . . . 0.0 110.553 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -136.8 -53.64 0.71 Allowed 'General case' 0 N--CA 1.524 3.232 0 CA-C-O 118.965 -0.54 . . . . 0.0 111.208 -179.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -103.52 149.77 24.55 Favored 'General case' 0 N--CA 1.533 3.695 0 CA-C-N 118.439 0.563 . . . . 0.0 111.989 -178.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -148.32 132.03 16.93 Favored 'General case' 0 N--CA 1.526 3.352 0 C-N-CA 123.519 0.728 . . . . 0.0 109.449 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 86.8 mtt-85 65.79 134.49 0.02 OUTLIER 'General case' 1 N--CA 1.542 4.166 0 C-N-CA 124.601 1.16 . . . . 0.0 110.707 -179.112 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 -152.53 118.93 5.59 Favored 'General case' 0 N--CA 1.527 3.395 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 178.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -104.22 136.08 44.49 Favored 'General case' 0 N--CA 1.525 3.324 0 C-N-CA 122.744 0.417 . . . . 0.0 110.965 -178.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -128.55 -61.23 1.08 Allowed 'General case' 0 N--CA 1.52 3.047 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 178.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 519' ' ' TRP . . . . . 0.727 ' CE2' HD22 ' A' ' 39' ' ' LEU . 63.1 t-105 -42.54 -26.43 0.12 Allowed 'General case' 1 N--CA 1.552 4.64 0 C-N-CA 124.558 1.143 . . . . 0.0 113.753 178.523 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 520' ' ' LEU . . . . . 0.54 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.4 mm? -93.88 -34.29 13.18 Favored 'General case' 0 N--CA 1.526 3.369 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -172.299 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.58 -25.02 68.04 Favored 'General case' 0 N--CA 1.534 3.755 0 N-CA-C 106.291 -1.744 . . . . 0.0 106.291 172.521 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 522' ' ' PHE . . . . . 0.459 ' CE2' ' HA2' ' A' ' 52' ' ' GLY . 2.2 m-85 -78.74 -37.33 41.56 Favored 'General case' 0 N--CA 1.513 2.716 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 173.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 523' ' ' VAL . . . . . 0.47 HG23 ' O ' ' B' ' 519' ' ' TRP . 25.4 t -66.4 -23.35 31.46 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.232 0 CA-C-N 120.169 1.349 . . . . 0.0 111.646 179.103 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -75.19 -49.38 19.61 Favored 'General case' 0 N--CA 1.536 3.849 0 CA-C-N 120.063 1.301 . . . . 0.0 108.345 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 1.8 tp -65.5 -29.31 69.94 Favored 'General case' 1 N--CA 1.54 4.05 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 176.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 526' ' ' LEU . . . . . 0.443 HD23 ' O ' ' B' ' 522' ' ' PHE . 0.9 OUTLIER -68.41 -33.05 73.54 Favored 'General case' 0 N--CA 1.522 3.171 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 177.128 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 527' ' ' LYS . . . . . 0.447 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 31.0 ttmt -65.89 -25.52 67.21 Favored 'General case' 0 N--CA 1.519 3.01 0 CA-C-O 118.387 -0.816 . . . . 0.0 111.144 177.106 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -69.22 -39.94 78.28 Favored 'General case' 0 N--CA 1.536 3.829 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 176.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 529' ' ' ALA . . . . . 0.646 ' HB2' ' CH2' ' A' ' 99' ' ' TRP . . . -88.63 -9.5 51.93 Favored 'General case' 0 N--CA 1.506 2.367 0 CA-C-O 118.417 -0.802 . . . . 0.0 111.295 178.048 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 530' ' ' TYR . . . . . 0.447 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.9 OUTLIER -81.61 -32.9 31.79 Favored 'General case' 0 N--CA 1.532 3.625 0 CA-C-N 120.439 1.472 . . . . 0.0 108.733 -179.919 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -61.6 -44.43 97.02 Favored 'General case' 0 N--CA 1.538 3.944 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 176.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 61.4 m-80 -91.56 -86.45 0.22 Allowed 'General case' 0 N--CA 1.517 2.878 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 177.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 150.72 52.41 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.855 0 C-N-CA 128.027 2.531 . . . . 0.0 107.818 178.179 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 534' ' ' LEU . . . . . 0.587 HD22 ' CD2' ' A' ' 96' ' ' LEU . 4.8 mt -111.08 10.65 22.02 Favored 'General case' 0 N--CA 1.528 3.429 0 C-N-CA 124.558 1.143 . . . . 0.0 110.831 -178.816 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 535' ' ' HIS . . . . . 0.611 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 39.9 p-80 -82.43 -0.32 45.67 Favored 'General case' 0 N--CA 1.517 2.888 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 174.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 536' ' ' LEU . . . . . 0.469 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 34.6 mt -93.96 -51.63 0.26 Allowed Pre-proline 0 N--CA 1.504 2.266 0 CA-C-O 116.728 -1.606 . . . . 0.0 108.952 -175.909 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 537' ' ' PRO . . . . . 0.469 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 6.3 Cg_exo -66.19 -33.86 38.43 Favored 'Trans proline' 0 C--N 1.394 2.941 0 C-N-CA 122.158 1.906 . . . . 0.0 107.235 171.128 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 538' ' ' LEU . . . . . 0.438 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 0.6 OUTLIER -64.07 -45.69 87.6 Favored 'General case' 0 N--CA 1.521 3.108 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 176.292 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . 0.262 2.2 pp -81.89 -2.86 52.67 Favored 'General case' 1 N--CA 1.542 4.161 0 CA-C-N 118.824 0.738 . . . . 0.0 111.9 178.392 . . . . . . . . 3 2 . 1 . 009 nuclear build full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -81.51 -12.01 58.99 Favored 'General case' 0 N--CA 1.518 2.946 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 172.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 541' ' ' LEU . . . . . 0.629 HD13 ' N ' ' B' ' 542' ' ' MET . 0.0 OUTLIER -108.3 -45.05 3.99 Favored 'General case' 0 N--CA 1.512 2.635 0 C-N-CA 124.476 1.11 . . . . 0.0 109.639 -178.838 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 542' ' ' MET . . . . . 0.629 ' N ' HD13 ' B' ' 541' ' ' LEU . 12.2 ptp -84.51 -28.28 26.81 Favored 'General case' 1 N--CA 1.546 4.326 0 CA-C-O 117.61 -1.186 . . . . 0.0 111.988 -178.939 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 5.7 mp -107.35 -99.14 0.36 Allowed 'General case' 0 N--CA 1.527 3.392 0 CA-C-O 117.111 -1.423 . . . . 0.0 112.759 -176.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 544' ' ' THR . . . . . 0.428 HG23 ' HG3' ' B' ' 547' ' ' GLU . 3.1 t 153.77 147.48 0.0 OUTLIER Pre-proline 1 N--CA 1.574 5.774 0 C-N-CA 126.224 1.809 . . . . 0.0 109.023 -177.855 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -58.67 -34.33 98.84 Favored 'Trans proline' 0 N--CA 1.524 3.301 0 C-N-CA 123.32 2.68 . . . . 0.0 113.502 -179.141 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -57.79 -30.02 65.35 Favored 'General case' 1 N--CA 1.542 4.135 0 CA-C-N 118.508 0.594 . . . . 0.0 111.479 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 547' ' ' GLU . . . . . 0.428 ' HG3' HG23 ' B' ' 544' ' ' THR . 39.4 mt-10 -67.86 -38.5 83.19 Favored 'General case' 0 N--CA 1.526 3.33 0 CA-C-O 118.307 -0.854 . . . . 0.0 110.6 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 548' ' ' ARG . . . . . 0.439 ' HB2' ' HB2' ' A' ' 19' ' ' TRP . 4.2 ptt180 -76.44 -20.85 56.64 Favored 'General case' 0 N--CA 1.529 3.492 0 CA-C-O 118.135 -0.936 . . . . 0.0 111.289 178.037 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -65.57 -49.37 69.08 Favored 'General case' 0 N--CA 1.537 3.908 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 174.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -77.58 -13.88 59.8 Favored 'General case' 0 N--CA 1.511 2.598 0 CA-C-O 117.073 -1.441 . . . . 0.0 111.817 178.059 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 551' ' ' LEU . . . . . 0.663 HD22 ' CE3' ' A' ' 19' ' ' TRP . 11.7 tp -79.13 -30.39 43.66 Favored 'General case' 0 N--CA 1.53 3.529 0 CA-C-N 120.817 1.644 . . . . 0.0 107.73 175.028 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -71.15 -56.9 6.56 Favored Glycine 0 N--CA 1.498 2.783 0 N-CA-C 108.949 -1.661 . . . . 0.0 108.949 178.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 3.1 m -64.43 -31.29 72.44 Favored 'General case' 1 N--CA 1.541 4.092 0 CA-C-O 118.337 -0.839 . . . . 0.0 112.059 -179.169 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -65.5 -50.6 64.69 Favored 'General case' 1 N--CA 1.546 4.369 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 176.432 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 555' ' ' VAL . . . . . 0.44 HG23 ' O ' ' B' ' 551' ' ' LEU . 32.0 t -66.05 -15.98 19.87 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.849 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.03 177.434 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 18.6 mmt180 -79.82 -44.32 20.79 Favored 'General case' 0 N--CA 1.526 3.363 0 CA-C-O 117.327 -1.321 . . . . 0.0 111.319 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 557' ' ' ILE . . . . . 0.47 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -72.81 -24.58 21.41 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.186 0 CA-C-N 121.425 1.921 . . . . 0.0 110.406 -179.757 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 558' ' ' VAL . . . . . 0.47 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.0 OUTLIER -86.22 -53.47 10.3 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.073 0 CA-C-N 119.997 1.271 . . . . 0.0 107.635 -179.739 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -61.36 -22.04 64.58 Favored 'General case' 0 N--CA 1.532 3.636 0 CA-C-O 118.497 -0.763 . . . . 0.0 110.971 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -93.81 -24.78 17.65 Favored 'General case' 0 N--CA 1.523 3.183 0 CA-C-O 118.081 -0.961 . . . . 0.0 110.07 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 14.3 tp -71.01 -53.77 13.6 Favored 'General case' 0 N--CA 1.535 3.813 0 CA-C-N 119.708 1.14 . . . . 0.0 108.255 178.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 36.5 mt -48.62 -30.1 5.04 Favored 'General case' 1 N--CA 1.543 4.218 0 C-N-CA 124.157 0.983 . . . . 0.0 112.583 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 20.5 mmm180 -79.68 -49.89 11.44 Favored 'General case' 0 N--CA 1.53 3.546 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 72.11 89.19 0.13 Allowed Glycine 1 N--CA 1.52 4.274 0 CA-C-O 119.346 -0.697 . . . . 0.0 111.822 178.412 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -155.87 -55.82 0.09 Allowed 'General case' 0 N--CA 1.528 3.428 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 2.1 ptt? -147.84 66.34 1.11 Allowed 'General case' 0 N--CA 1.527 3.388 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 178.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 7.6 t -125.55 -15.41 6.09 Favored 'General case' 0 N--CA 1.519 3.001 0 CA-C-O 117.484 -1.246 . . . . 0.0 114.05 -176.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -98.81 -55.43 2.72 Favored 'General case' 0 N--CA 1.533 3.703 0 CA-C-N 120.803 1.638 . . . . 0.0 111.582 -178.436 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -107.49 -38.48 5.91 Favored 'General case' 0 N--CA 1.532 3.641 0 C-N-CA 123.433 0.693 . . . . 0.0 111.728 -177.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -81.52 -8.71 59.76 Favored 'General case' 0 N--CA 1.518 2.966 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -176.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 571' ' ' LEU . . . . . 0.93 HD23 HD11 ' B' ' 582' ' ' ILE . 26.1 tp -85.85 -48.6 8.61 Favored 'General case' 0 N--CA 1.535 3.783 0 CA-C-N 120.306 1.412 . . . . 0.0 112.973 -177.605 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -45.57 -29.54 1.22 Allowed 'General case' 1 N--CA 1.555 4.784 0 CA-C-N 120.23 1.377 . . . . 0.0 113.866 -177.517 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -67.09 -41.53 86.15 Favored 'General case' 1 N--CA 1.54 4.034 0 CA-C-N 118.819 0.736 . . . . 0.0 110.26 -179.507 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -48.41 -62.22 1.61 Allowed 'General case' 0 N--CA 1.529 3.5 0 C-N-CA 125.167 1.387 . . . . 0.0 113.157 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 575' ' ' LEU . . . . . 0.544 HD11 ' HB2' ' B' ' 577' ' ' ALA . 3.4 pp -119.09 -39.76 2.89 Favored 'General case' 0 N--CA 1.532 3.666 0 CA-C-N 118.736 0.698 . . . . 0.0 111.705 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 120.62 37.24 0.74 Allowed Glycine 1 N--CA 1.527 4.729 0 CA-C-O 118.572 -1.127 . . . . 0.0 111.953 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 577' ' ' ALA . . . . . 0.544 ' HB2' HD11 ' B' ' 575' ' ' LEU . . . -89.23 108.52 19.66 Favored 'General case' 0 N--CA 1.521 3.109 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 177.661 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -43.13 170.33 0.01 OUTLIER Glycine 1 N--CA 1.53 4.903 0 C-N-CA 125.095 1.331 . . . . 0.0 115.685 -177.53 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 579' ' ' ILE . . . . . 0.61 HG21 ' N6 ' ' E' ' 4' ' ' ' DA' . 0.5 OUTLIER -84.14 -15.57 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.642 0 CA-C-O 117.549 -1.215 . . . . 0.0 108.724 177.464 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 580' ' ' ALA . . . . . 0.822 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -70.09 -38.65 75.72 Favored 'General case' 0 N--CA 1.523 3.217 0 CA-C-N 120.213 1.37 . . . . 0.0 108.951 176.796 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -79.66 -36.3 37.93 Favored 'General case' 0 N--CA 1.539 3.996 0 CA-C-N 118.609 0.641 . . . . 0.0 112.247 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 582' ' ' ILE . . . . . 0.93 HD11 HD23 ' B' ' 571' ' ' LEU . 1.6 tt -71.01 -37.67 68.69 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.212 0 C-N-CA 122.9 0.48 . . . . 0.0 111.601 -175.605 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 65.0 p -98.25 -23.56 15.61 Favored 'General case' 0 N--CA 1.512 2.633 0 CA-C-O 117.968 -1.015 . . . . 0.0 111.746 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 13.8 ptt180 -79.7 -22.06 43.85 Favored 'General case' 0 N--CA 1.531 3.622 0 CA-C-N 120.164 1.347 . . . . 0.0 108.355 173.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -65.36 -33.63 87.14 Favored Glycine 1 N--CA 1.519 4.214 0 N-CA-C 108.975 -1.65 . . . . 0.0 108.975 175.807 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 83.0 p -64.1 -32.79 74.48 Favored 'General case' 0 N--CA 1.537 3.9 0 CA-C-N 118.224 1.012 . . . . 0.0 109.97 176.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -62.1 -31.53 71.99 Favored 'General case' 0 N--CA 1.538 3.962 0 C-N-CA 123.501 0.72 . . . . 0.0 110.826 178.463 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 50.3 m -63.17 -43.19 98.95 Favored 'General case' 1 N--CA 1.541 4.096 0 C-N-CA 123.379 0.672 . . . . 0.0 110.318 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 36.1 mt -54.86 -44.74 74.27 Favored 'General case' 0 N--CA 1.527 3.38 0 C-N-CA 124.015 0.926 . . . . 0.0 110.96 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -29.08 66.67 Favored 'General case' 0 N--CA 1.537 3.876 0 CA-C-O 118.76 -0.638 . . . . 0.0 111.135 178.87 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -64.84 -42.9 94.54 Favored 'General case' 0 N--CA 1.528 3.47 0 CA-C-N 118.737 0.699 . . . . 0.0 110.957 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -65.44 162.7 39.41 Favored Pre-proline 0 N--CA 1.534 3.767 0 CA-C-O 118.426 -0.797 . . . . 0.0 112.165 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 593' ' ' PRO . . . . . 0.43 ' O ' ' HB2' ' B' ' 597' ' ' ARG . 37.9 Cg_endo -79.23 179.77 6.13 Favored 'Trans proline' 0 C--N 1.38 2.185 0 C-N-CA 122.02 1.813 . . . . 0.0 111.081 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -94.27 -26.36 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.306 0 CA-C-O 118.01 -0.995 . . . . 0.0 111.495 -178.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -61.39 -45.1 95.77 Favored 'General case' 0 N--CA 1.517 2.898 0 CA-C-N 119.837 1.198 . . . . 0.0 109.47 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 596' ' ' LEU . . . . . 0.456 ' N ' HD12 ' B' ' 596' ' ' LEU . 6.9 mp -97.06 -9.09 28.78 Favored 'General case' 0 N--CA 1.508 2.466 0 C-N-CA 123.233 0.613 . . . . 0.0 111.843 179.086 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 597' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' B' ' 593' ' ' PRO . 0.0 OUTLIER -64.68 -39.18 93.22 Favored 'General case' 1 N--CA 1.548 4.464 0 N-CA-C 102.516 -3.142 . . . . 0.0 102.516 167.456 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -49.84 -36.77 27.96 Favored 'General case' 0 N--CA 1.519 2.985 0 C-N-CA 124.311 1.044 . . . . 0.0 111.676 174.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 599' ' ' TRP . . . . . 0.661 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 39.0 t90 -64.5 -40.67 96.09 Favored 'General case' 0 N--CA 1.528 3.468 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 178.303 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 10.6 mp -54.17 -32.83 56.55 Favored 'General case' 1 N--CA 1.544 4.228 0 CA-C-N 118.92 0.782 . . . . 0.0 109.226 176.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -74.96 -34.56 62.05 Favored 'General case' 0 N--CA 1.528 3.468 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 176.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 602' ' ' GLU . . . . . 0.452 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.5 OUTLIER -63.99 -22.77 67.07 Favored 'General case' 1 N--CA 1.549 4.501 0 C-N-CA 124.903 1.281 . . . . 0.0 111.405 175.969 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' B' B ' 603' ' ' VAL . . . . . 0.546 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.0 OUTLIER -108.8 -20.77 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.611 0 CA-C-O 118.01 -0.995 . . . . 0.0 112.231 -175.067 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 7.2 mp -88.78 -58.68 2.46 Favored 'General case' 0 N--CA 1.523 3.193 0 N-CA-C 105.499 -2.038 . . . . 0.0 105.499 175.309 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -76.3 -66.06 0.85 Allowed 'General case' 0 N--CA 1.528 3.457 0 C-N-CA 123.636 0.774 . . . . 0.0 110.658 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 82.5 mttt 89.48 -52.66 0.02 OUTLIER 'General case' 1 N--CA 1.544 4.248 0 C-N-CA 127.265 2.226 . . . . 0.0 109.061 -177.373 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 7.6 t . . . . . 0 N--CA 1.523 3.2 0 CA-C-O 118.013 -0.994 . . . . 0.0 109.795 179.852 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.166 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 998' ' ' TRP . . . . . 0.443 ' CZ3' HD11 ' B' ' 557' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.17 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.423 -9.543 3 O4'-C1'-N19 119.44 14.55 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.591 5 O4'-C1'-N19 119.902 15.128 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.42 -9.798 3 O4'-C1'-N19 119.732 14.914 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . 0.57 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 6 C3'--C2' 1.416 -10.242 3 O4'-C1'-N19 120.369 15.711 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' E' E ' 5' ' ' ' DC' . . . . . 0.505 ' H41' ' HA ' ' B' ' 580' ' ' ALA . . . . . . . . 5 O3'--C3' 1.564 10.193 3 C4'-C3'-C2' 117.188 13.988 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.406 -11.229 5 O4'-C1'-N19 119.787 14.984 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' E' E ' 7' ' ' ' DA' . . . . . 0.754 H2'' " H5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.4 -11.812 4 C4'-C3'-C2' 114.279 11.079 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' E' E ' 8' ' ' ' DG' . . . . . 0.754 " H5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 O3'--C3' 1.559 9.835 4 O4'-C1'-N19 117.886 12.607 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 O3'--C3' 1.579 11.356 5 O4'-C1'-N19 119.469 14.586 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.404 -11.394 6 O4'-C1'-N19 119.526 14.657 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.402 -11.566 4 O4'-C1'-N19 120.382 15.727 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.505 3 O4'-C1'-N19 120.383 15.728 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.594 4 O4'-C1'-N19 118.886 13.858 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' E' E ' 14' ' ' ' DT' . . . . . 0.777 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 O3'--C3' 1.567 10.489 4 C4'-C3'-C2' 117.012 13.812 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' E' E ' 15' ' ' ' DA' . . . . . 0.853 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.425 -9.347 5 O4'-C1'-N19 119.35 14.438 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.418 -10.002 3 O4'-C1'-N19 120.196 15.495 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.563 10.18 2 O4'-C1'-N19 119.424 14.53 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.604 4 O4'-C1'-N19 120.013 15.266 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.42 -9.784 4 O4'-C1'-N19 119.629 14.786 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.505 6.538 3 O4'-C1'-N19 119.577 14.721 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.179 2 O4'-C1'-N19 119.494 14.618 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.571 10.804 5 C4'-C3'-C2' 116.172 12.972 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -10.047 4 O4'-C1'-N19 120.195 15.493 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' F' F ' 4' ' ' ' DA' . . . . . 0.527 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.415 -10.314 2 O4'-C1'-N19 119.168 14.21 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' F' F ' 5' ' ' ' DC' . . . . . 0.575 ' H41' ' HA ' ' A' ' 80' ' ' ALA . . . . . . . . 6 O3'--C3' 1.574 11.032 5 O4'-C1'-N19 119.309 14.386 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.399 -11.851 5 O4'-C1'-N19 118.825 13.782 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' F' F ' 7' ' ' ' DA' . . . . . 0.873 H2'' H5'' ' F' ' 8' ' ' ' DG' . . . . . . . . 4 O3'--C3' 1.572 10.861 3 N19-C1'-C2' 136.11 13.694 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' F' F ' 8' ' ' ' DG' . . . . . 0.873 H5'' H2'' ' F' ' 7' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.41 -10.752 5 O4'-C1'-N19 120.358 15.698 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.416 -10.203 5 O4'-C1'-N19 119.987 15.233 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.405 -11.285 4 O4'-C1'-N19 119.29 14.363 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.415 -10.321 4 O4'-C1'-N19 121.153 16.692 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.146 2 O4'-C1'-N19 120.315 15.644 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.417 -10.096 5 O4'-C1'-N19 119.054 14.068 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' F' F ' 14' ' ' ' DT' . . . . . 0.599 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.41 -10.818 5 O4'-C1'-N19 119.289 14.361 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' F' F ' 15' ' ' ' DA' . . . . . 0.851 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.428 -9.026 3 O4'-C1'-N19 120.194 15.493 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' F' F ' 16' ' ' ' DG' . . . . . 0.455 ' O6 ' HG22 ' B' ' 579' ' ' ILE . . . . . . . . 5 C3'--C2' 1.419 -9.888 4 O4'-C1'-N19 119.026 14.033 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear build full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.249 5 O4'-C1'-N19 119.497 14.622 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.174 5 O4'-C1'-N19 120.264 15.579 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.574 5 O4'-C1'-N19 120.747 16.184 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.513 7.192 4 O4'-C1'-N19 120.125 15.407 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 . . . . . 0 N--CA 1.501 2.097 0 N-CA-C 110.693 -0.114 . . . . 0.0 110.693 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 88.9 p 52.7 103.8 0.03 OUTLIER Pre-proline 0 N--CA 1.532 3.633 0 C-N-CA 125.078 1.351 . . . . 0.0 112.888 178.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -82.29 141.6 11.55 Favored 'Trans proline' 0 C--N 1.389 2.691 0 C-N-CA 122.918 2.412 . . . . 0.0 110.668 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -106.12 -63.47 1.26 Allowed 'General case' 0 N--CA 1.521 3.092 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 178.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 7.2 t -136.94 119.61 16.11 Favored 'General case' 0 N--CA 1.522 3.148 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -145.5 -50.94 0.25 Allowed 'General case' 0 N--CA 1.52 3.062 0 CA-C-O 119.169 -0.443 . . . . 0.0 111.332 -178.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -100.45 -54.29 2.89 Favored 'General case' 0 N--CA 1.524 3.262 0 CA-C-O 119.262 -0.399 . . . . 0.0 111.348 -178.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 14.1 ttt 67.39 126.45 0.02 OUTLIER 'General case' 1 N--CA 1.54 4.064 0 C-N-CA 124.207 1.003 . . . . 0.0 109.858 -179.21 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -108.06 154.57 21.48 Favored 'General case' 0 N--CA 1.528 3.429 0 C-N-CA 123.162 0.585 . . . . 0.0 111.669 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -83.73 -51.19 7.45 Favored 'General case' 0 N--CA 1.523 3.213 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -108.67 144.26 36.67 Favored 'General case' 0 N--CA 1.53 3.556 0 C-N-CA 123.171 0.588 . . . . 0.0 110.578 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -116.59 126.78 53.77 Favored 'General case' 0 N--CA 1.521 3.087 0 C-N-CA 123.605 0.762 . . . . 0.0 109.314 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.2 t60 60.46 155.64 0.03 OUTLIER 'General case' 1 N--CA 1.54 4.046 0 C-N-CA 124.746 1.218 . . . . 0.0 112.311 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -92.02 149.86 21.29 Favored 'General case' 0 N--CA 1.537 3.908 0 C-N-CA 122.89 0.476 . . . . 0.0 110.762 -179.468 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -115.13 -90.39 0.54 Allowed 'General case' 0 N--CA 1.521 3.092 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.811 ' CE3' HD22 ' B' ' 551' ' ' LEU . 74.4 t-105 -50.62 -39.5 50.37 Favored 'General case' 0 N--CA 1.538 3.945 0 CA-C-N 119.572 1.078 . . . . 0.0 110.969 178.332 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.441 ' N ' HD22 ' A' ' 20' ' ' LEU . 2.2 mm? -81.18 -27.7 35.28 Favored 'General case' 0 N--CA 1.524 3.271 0 CA-C-O 117.792 -1.099 . . . . 0.0 112.387 -174.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.31 -28.12 66.51 Favored 'General case' 1 N--CA 1.54 4.072 0 N-CA-C 106.306 -1.738 . . . . 0.0 106.306 172.338 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.577 ' CG ' HD21 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -82.52 -37.46 25.21 Favored 'General case' 0 N--CA 1.503 2.215 0 CA-C-O 116.755 -1.593 . . . . 0.0 108.822 173.778 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.9 t -67.06 -25.37 34.01 Favored 'Isoleucine or valine' 1 N--CA 1.563 5.215 0 CA-C-N 121.283 1.856 . . . . 0.0 112.444 -176.255 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -78.03 -51.46 10.29 Favored 'General case' 0 N--CA 1.534 3.736 0 CA-C-N 119.901 1.228 . . . . 0.0 107.916 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.94 -19.83 65.79 Favored 'General case' 0 N--CA 1.537 3.889 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 176.04 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.36 -40.4 67.35 Favored 'General case' 0 N--CA 1.515 2.797 0 CA-C-O 117.873 -1.06 . . . . 0.0 108.153 177.465 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.444 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 20.2 mttt -59.77 -20.96 59.9 Favored 'General case' 0 N--CA 1.531 3.603 0 CA-C-O 118.3 -0.857 . . . . 0.0 111.42 176.551 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -73.6 -43.63 59.2 Favored 'General case' 0 N--CA 1.531 3.603 0 CA-C-N 119.273 0.942 . . . . 0.0 108.684 176.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.649 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -89.5 -1.53 58.07 Favored 'General case' 0 N--CA 1.511 2.6 0 CA-C-O 118.818 -0.61 . . . . 0.0 110.843 177.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.444 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -89.03 -34.64 16.73 Favored 'General case' 0 N--CA 1.533 3.683 0 CA-C-N 120.003 1.274 . . . . 0.0 108.594 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -65.04 -40.58 94.98 Favored 'General case' 0 N--CA 1.532 3.635 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 176.387 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 -89.99 -89.46 0.16 Allowed 'General case' 0 N--CA 1.513 2.709 0 N-CA-C 106.766 -1.568 . . . . 0.0 106.766 176.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 p30 153.11 44.64 0.0 OUTLIER 'General case' 1 N--CA 1.561 5.103 0 C-N-CA 127.504 2.322 . . . . 0.0 109.034 177.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.61 HD22 ' CD2' ' B' ' 596' ' ' LEU . 9.1 mt -103.08 15.14 30.16 Favored 'General case' 0 N--CA 1.524 3.268 0 C-N-CA 123.966 0.907 . . . . 0.0 110.901 -179.001 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.597 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 54.5 p-80 -84.91 5.5 28.71 Favored 'General case' 0 CA--C 1.594 2.648 0 C-N-CA 123.38 0.672 . . . . 0.0 109.22 174.844 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.519 HD23 HD12 ' A' ' 39' ' ' LEU . 18.9 mt -95.53 -49.58 0.25 Allowed Pre-proline 0 N--CA 1.508 2.466 0 C-N-CA 125.792 1.637 . . . . 0.0 109.031 -175.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.456 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 4.4 Cg_exo -67.21 -37.32 18.64 Favored 'Trans proline' 0 C--N 1.388 2.64 0 N-CA-C 106.053 -2.326 . . . . 0.0 106.053 169.539 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.597 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 1.9 tm? -60.64 -36.75 79.42 Favored 'General case' 0 N--CA 1.53 3.565 0 C-N-CA 124.058 0.943 . . . . 0.0 108.839 175.539 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.742 HD11 ' CE2' ' B' ' 519' ' ' TRP . 0.5 OUTLIER -59.18 -49.43 77.9 Favored 'General case' 1 N--CA 1.553 4.71 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 176.134 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.5 t30 -59.28 -15.59 16.63 Favored 'General case' 0 N--CA 1.536 3.832 0 CA-C-O 118.113 -0.946 . . . . 0.0 113.52 -178.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.457 HD23 ' HA ' ' A' ' 38' ' ' LEU . 0.7 OUTLIER -103.72 -46.77 4.42 Favored 'General case' 0 N--CA 1.522 3.133 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 -177.178 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.3 ptt? -122.04 14.87 10.71 Favored 'General case' 1 N--CA 1.554 4.748 0 CA-C-N 120.014 1.279 . . . . 0.0 113.016 -174.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.7 mp -123.06 -48.97 1.97 Allowed 'General case' 0 N--CA 1.494 1.725 0 CA-C-O 117.702 -1.142 . . . . 0.0 110.432 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.425 ' CG2' ' HB2' ' B' ' 998' ' ' TRP . 77.5 p 107.27 158.94 0.0 OUTLIER Pre-proline 1 N--CA 1.566 5.333 0 C-N-CA 127.642 2.377 . . . . 0.0 110.919 -179.171 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo -71.86 -32.14 11.8 Favored 'Trans proline' 0 C--N 1.391 2.789 0 C-N-CA 122.145 1.897 . . . . 0.0 107.371 172.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -69.03 -14.79 63.24 Favored 'General case' 0 N--CA 1.521 3.114 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.695 176.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -77.94 -40.74 38.54 Favored 'General case' 0 N--CA 1.514 2.744 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 177.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.9 ptt-85 -83.36 -11.5 57.56 Favored 'General case' 0 N--CA 1.532 3.662 0 CA-C-N 119.253 0.933 . . . . 0.0 109.933 175.144 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -74.12 -39.44 63.34 Favored 'General case' 0 N--CA 1.525 3.302 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 174.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.42 ' HB1' ' CZ ' ' A' ' 54' ' ' ARG . . . -84.24 -31.4 25.02 Favored 'General case' 0 N--CA 1.501 2.102 0 CA-C-O 117.432 -1.271 . . . . 0.0 110.357 -179.572 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.414 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 17.9 tp -70.35 -25.53 63.32 Favored 'General case' 1 N--CA 1.545 4.28 0 CA-C-N 120.961 1.71 . . . . 0.0 106.82 173.426 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.449 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -65.28 -73.45 0.59 Allowed Glycine 0 N--CA 1.507 3.382 0 C-N-CA 125.56 1.552 . . . . 0.0 111.295 176.602 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 m -69.66 -25.56 63.96 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-O 117.736 -1.126 . . . . 0.0 113.159 -177.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.42 ' CZ ' ' HB1' ' A' ' 50' ' ' ALA . 36.7 mtm180 -71.54 -48.34 49.29 Favored 'General case' 0 N--CA 1.53 3.529 0 CA-C-N 120.101 1.319 . . . . 0.0 107.849 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 51' ' ' LEU . 21.6 t -67.06 -18.07 23.64 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.042 0 CA-C-N 119.543 1.065 . . . . 0.0 109.684 175.206 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.82 -48.46 31.16 Favored 'General case' 0 N--CA 1.529 3.52 0 CA-C-N 119.828 1.195 . . . . 0.0 111.559 178.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.416 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -73.93 -24.84 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.555 0 CA-C-N 120.619 1.554 . . . . 0.0 111.378 -178.83 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.56 HG11 HD11 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -85.01 -49.33 15.79 Favored 'Isoleucine or valine' 1 N--CA 1.546 4.354 0 CA-C-N 120.419 1.463 . . . . 0.0 107.666 -179.228 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -62.04 -27.33 68.81 Favored 'General case' 0 N--CA 1.528 3.441 0 CA-C-O 118.917 -0.563 . . . . 0.0 109.961 178.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -91.21 -19.62 22.84 Favored 'General case' 0 N--CA 1.521 3.106 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.683 177.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.2 mt -76.68 -47.09 23.16 Favored 'General case' 0 N--CA 1.537 3.91 0 CA-C-N 119.71 1.141 . . . . 0.0 108.55 178.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 47.4 mt -52.6 -27.6 17.59 Favored 'General case' 0 N--CA 1.539 3.986 0 C-N-CA 124.366 1.066 . . . . 0.0 112.319 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 27.9 mmm180 -92.31 -48.61 6.58 Favored 'General case' 0 N--CA 1.526 3.333 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.4 79.3 0.46 Allowed Glycine 1 N--CA 1.52 4.241 0 CA-C-O 119.433 -0.648 . . . . 0.0 111.933 178.342 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -143.74 -59.44 0.4 Allowed 'General case' 0 N--CA 1.524 3.265 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 38.5 mtt -137.0 70.62 1.4 Allowed 'General case' 0 N--CA 1.522 3.149 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 178.079 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.418 ' HA ' HD22 ' A' ' 71' ' ' LEU . 9.7 t -128.77 -25.39 2.84 Favored 'General case' 0 N--CA 1.524 3.237 0 CA-C-O 117.573 -1.203 . . . . 0.0 113.634 -176.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -104.48 -59.89 1.67 Allowed 'General case' 0 N--CA 1.531 3.589 0 CA-C-N 120.166 1.348 . . . . 0.0 112.352 -176.298 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.79 -62.83 1.37 Allowed 'General case' 0 N--CA 1.527 3.421 0 C-N-CA 122.916 0.486 . . . . 0.0 111.741 -176.693 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -73.7 -3.54 28.91 Favored 'General case' 0 N--CA 1.52 3.033 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -176.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.59 HD23 HG21 ' A' ' 82' ' ' ILE . 46.2 tp -78.51 -51.38 10.06 Favored 'General case' 0 N--CA 1.525 3.308 0 CA-C-N 120.35 1.432 . . . . 0.0 112.683 -178.6 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -44.65 -31.29 1.11 Allowed 'General case' 1 N--CA 1.547 4.418 0 CA-C-N 119.612 1.096 . . . . 0.0 113.787 -176.538 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 25.2 t30 -71.67 -41.09 69.14 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-N 118.389 0.54 . . . . 0.0 110.459 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -62.97 -56.43 17.21 Favored 'General case' 0 N--CA 1.524 3.235 0 C-N-CA 124.076 0.95 . . . . 0.0 112.667 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.402 HD12 HD11 ' A' ' 71' ' ' LEU . 42.7 mt -99.54 -53.44 3.2 Favored 'General case' 0 N--CA 1.531 3.599 0 C-N-CA 123.013 0.525 . . . . 0.0 111.6 -177.561 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 117.23 25.49 3.22 Favored Glycine 1 N--CA 1.525 4.619 0 CA-C-O 118.392 -1.226 . . . . 0.0 111.186 -177.693 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -93.51 119.93 33.17 Favored 'General case' 0 N--CA 1.515 2.804 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 178.285 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -45.24 171.3 0.01 OUTLIER Glycine 1 N--CA 1.533 5.103 0 C-N-CA 124.253 0.93 . . . . 0.0 115.07 -178.063 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.527 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.6 OUTLIER -80.21 -17.1 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.907 0 CA-C-O 117.9 -1.047 . . . . 0.0 108.594 178.126 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.853 ' HB2' ' H62' ' E' ' 15' ' ' ' DA' . . . -69.33 -36.12 76.61 Favored 'General case' 0 N--CA 1.524 3.234 0 CA-C-N 119.584 1.083 . . . . 0.0 110.747 178.058 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.7 p -80.21 -42.16 23.82 Favored 'General case' 0 N--CA 1.536 3.864 0 CA-C-N 119.315 0.961 . . . . 0.0 111.526 -179.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.59 HG21 HD23 ' A' ' 71' ' ' LEU . 4.8 pt -71.68 -17.32 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.903 0 CA-C-O 117.597 -1.192 . . . . 0.0 113.632 -177.171 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 63.3 p -111.85 -28.89 7.88 Favored 'General case' 0 N--CA 1.515 2.821 0 CA-C-N 120.039 1.29 . . . . 0.0 110.833 178.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.6 ptt180 -76.4 -22.01 55.27 Favored 'General case' 0 N--CA 1.524 3.274 0 CA-C-N 119.605 1.093 . . . . 0.0 108.175 174.003 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -62.13 -36.07 92.42 Favored Glycine 1 N--CA 1.516 4.023 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 177.016 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 74.5 p -66.5 -33.09 74.92 Favored 'General case' 0 N--CA 1.535 3.783 0 CA-C-N 118.27 1.035 . . . . 0.0 109.971 176.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -61.21 -32.74 72.51 Favored 'General case' 1 N--CA 1.543 4.179 0 C-N-CA 123.474 0.71 . . . . 0.0 111.307 178.451 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.1 m -58.79 -38.51 78.72 Favored 'General case' 1 N--CA 1.545 4.321 0 C-N-CA 123.5 0.72 . . . . 0.0 111.179 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 12.8 mt -58.86 -41.49 87.12 Favored 'General case' 0 N--CA 1.532 3.647 0 C-N-CA 124.303 1.041 . . . . 0.0 111.084 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.7 -20.54 65.8 Favored 'General case' 1 N--CA 1.539 4.013 0 CA-C-O 118.439 -0.791 . . . . 0.0 112.416 -179.669 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -86.54 -43.7 12.51 Favored 'General case' 0 N--CA 1.514 2.735 0 CA-C-N 118.876 0.762 . . . . 0.0 110.196 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.11 163.9 9.37 Favored Pre-proline 1 N--CA 1.543 4.192 0 CA-C-O 118.09 -0.957 . . . . 0.0 112.508 179.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -84.41 166.74 12.18 Favored 'Trans proline' 0 C--N 1.381 2.268 0 C-N-CA 121.886 1.724 . . . . 0.0 111.131 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 t -91.59 -23.08 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.075 0 CA-C-O 117.663 -1.161 . . . . 0.0 111.374 -179.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -61.15 -42.82 99.24 Favored 'General case' 0 N--CA 1.518 2.955 0 CA-C-N 120.316 1.416 . . . . 0.0 109.894 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.578 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.2 mp -98.08 -13.17 21.15 Favored 'General case' 0 N--CA 1.512 2.647 0 C-N-CA 123.527 0.731 . . . . 0.0 111.851 178.361 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -32.35 73.68 Favored 'General case' 1 N--CA 1.541 4.081 0 N-CA-C 103.397 -2.816 . . . . 0.0 103.397 167.732 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -53.93 -38.53 65.0 Favored 'General case' 0 N--CA 1.515 2.818 0 C-N-CA 124.735 1.214 . . . . 0.0 110.384 174.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.612 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 48.6 t90 -65.32 -37.94 88.63 Favored 'General case' 0 N--CA 1.53 3.542 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 176.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.35 -36.2 52.95 Favored 'General case' 1 N--CA 1.541 4.125 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 176.402 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -70.69 -38.42 73.71 Favored 'General case' 0 N--CA 1.539 3.989 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 175.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.444 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 2.6 mt-10 -58.62 -22.77 57.4 Favored 'General case' 1 N--CA 1.544 4.226 0 C-N-CA 123.938 0.895 . . . . 0.0 110.926 175.473 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.512 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -110.16 -2.68 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.332 0 CA-C-O 117.968 -1.015 . . . . 0.0 113.482 -175.941 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 7.0 mp -114.04 -61.37 1.75 Allowed 'General case' 0 N--CA 1.523 3.188 0 N-CA-C 106.419 -1.697 . . . . 0.0 106.419 174.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.5 tt -47.52 -55.33 9.38 Favored 'General case' 1 N--CA 1.546 4.37 0 C-N-CA 125.056 1.343 . . . . 0.0 112.875 -178.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.72 -58.63 3.16 Favored 'General case' 0 N--CA 1.53 3.531 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 -179.516 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 5.6 t . . . . . 0 N--CA 1.525 3.305 0 CA-C-O 118.119 -0.944 . . . . 0.0 110.314 -179.961 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 19.4 mm100 . . . . . 0 N--CA 1.504 2.232 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 75.6 m -101.9 122.09 48.51 Favored Pre-proline 0 N--CA 1.522 3.161 0 CA-C-O 117.415 -1.278 . . . . 0.0 109.206 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -76.88 -53.42 0.07 OUTLIER 'Trans proline' 0 C--N 1.391 2.816 0 C-N-CA 122.587 2.191 . . . . 0.0 109.528 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -107.05 128.13 54.09 Favored 'General case' 0 N--CA 1.521 3.112 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 37.9 p -147.35 -49.74 0.18 Allowed 'General case' 0 N--CA 1.523 3.203 0 C-N-CA 122.695 0.398 . . . . 0.0 110.134 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . 66.02 136.64 0.02 OUTLIER 'General case' 0 N--CA 1.537 3.876 0 C-N-CA 124.369 1.068 . . . . 0.0 111.148 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -134.37 144.85 48.47 Favored 'General case' 0 N--CA 1.525 3.313 0 C-N-CA 123.231 0.612 . . . . 0.0 111.017 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 35.1 mtt 65.41 135.55 0.02 OUTLIER 'General case' 0 N--CA 1.539 3.997 0 C-N-CA 124.757 1.223 . . . . 0.0 111.255 179.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -140.94 -49.6 0.43 Allowed 'General case' 0 N--CA 1.522 3.166 0 C-N-CA 122.953 0.501 . . . . 0.0 110.564 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -128.9 131.52 47.6 Favored 'General case' 0 N--CA 1.525 3.317 0 C-N-CA 123.014 0.525 . . . . 0.0 110.051 -179.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 -86.11 125.7 33.66 Favored 'General case' 0 N--CA 1.523 3.211 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 178.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 4.9 ttp180 -148.83 143.85 26.57 Favored 'General case' 0 N--CA 1.529 3.501 0 CA-C-N 117.855 0.298 . . . . 0.0 111.223 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 62.1 102.85 0.03 OUTLIER 'General case' 0 N--CA 1.535 3.79 0 C-N-CA 124.538 1.135 . . . . 0.0 110.626 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 23.4 tt0 -115.47 -102.34 0.42 Allowed 'General case' 0 N--CA 1.517 2.91 0 CA-C-O 117.674 -1.155 . . . . 0.0 108.114 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -149.13 -62.88 0.23 Allowed 'General case' 0 N--CA 1.525 3.324 0 CA-C-N 120.481 1.492 . . . . 0.0 108.324 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 519' ' ' TRP . . . . . 0.742 ' CE2' HD11 ' A' ' 39' ' ' LEU . 63.4 t-105 -42.8 -27.58 0.19 Allowed 'General case' 1 N--CA 1.543 4.198 0 C-N-CA 124.213 1.005 . . . . 0.0 113.667 178.828 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 520' ' ' LEU . . . . . 0.53 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.3 mm? -91.83 -33.38 14.98 Favored 'General case' 0 N--CA 1.523 3.221 0 CA-C-O 117.613 -1.184 . . . . 0.0 113.738 -171.037 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 16.0 ttp180 -64.79 -23.08 67.13 Favored 'General case' 0 N--CA 1.531 3.594 0 N-CA-C 106.125 -1.806 . . . . 0.0 106.125 171.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 522' ' ' PHE . . . . . 0.565 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.1 m-85 -78.04 -37.88 45.84 Favored 'General case' 0 N--CA 1.512 2.665 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 173.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 523' ' ' VAL . . . . . 0.423 HG23 ' O ' ' B' ' 519' ' ' TRP . 44.9 t -67.2 -20.09 26.34 Favored 'Isoleucine or valine' 1 N--CA 1.559 4.992 0 CA-C-O 117.799 -1.096 . . . . 0.0 111.352 177.366 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -76.52 -53.2 8.42 Favored 'General case' 0 N--CA 1.531 3.621 0 CA-C-N 120.337 1.426 . . . . 0.0 108.058 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 6.2 mp -67.57 -21.5 65.44 Favored 'General case' 0 N--CA 1.533 3.685 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 175.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 526' ' ' LEU . . . . . 0.421 ' HB2' ' HA ' ' B' ' 523' ' ' VAL . 0.8 OUTLIER -69.78 -36.06 75.41 Favored 'General case' 0 N--CA 1.519 3.02 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 176.507 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 527' ' ' LYS . . . . . 0.408 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 9.6 tttt -67.31 -23.29 65.63 Favored 'General case' 0 N--CA 1.521 3.08 0 CA-C-O 118.409 -0.805 . . . . 0.0 110.905 176.692 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -72.21 -40.87 67.5 Favored 'General case' 0 N--CA 1.533 3.7 0 CA-C-N 119.151 0.887 . . . . 0.0 109.59 178.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 529' ' ' ALA . . . . . 0.612 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -86.79 -13.75 44.24 Favored 'General case' 0 N--CA 1.509 2.49 0 CA-C-O 118.719 -0.658 . . . . 0.0 110.517 178.199 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 530' ' ' TYR . . . . . 0.408 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.8 OUTLIER -74.99 -29.69 60.95 Favored 'General case' 0 N--CA 1.536 3.838 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 177.696 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -61.94 -49.62 75.39 Favored 'General case' 0 N--CA 1.532 3.659 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 177.293 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -91.95 -87.93 0.21 Allowed 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 177.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.6 p30 155.8 51.77 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.84 0 C-N-CA 127.325 2.25 . . . . 0.0 107.54 177.479 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 534' ' ' LEU . . . . . 0.578 HD22 ' CD2' ' A' ' 96' ' ' LEU . 7.1 mt -109.95 11.33 24.12 Favored 'General case' 0 N--CA 1.529 3.523 0 C-N-CA 124.54 1.136 . . . . 0.0 110.988 -178.145 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 535' ' ' HIS . . . . . 0.555 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 40.7 p-80 -82.9 2.53 34.0 Favored 'General case' 0 N--CA 1.515 2.792 0 C-N-CA 123.419 0.688 . . . . 0.0 109.235 175.376 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 536' ' ' LEU . . . . . 0.445 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 36.4 mt -97.15 -50.69 0.23 Allowed Pre-proline 0 N--CA 1.509 2.507 0 CA-C-O 116.854 -1.546 . . . . 0.0 109.22 -175.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 537' ' ' PRO . . . . . 0.445 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 3.9 Cg_exo -68.68 -29.93 28.78 Favored 'Trans proline' 0 C--N 1.391 2.795 0 N-CA-C 106.79 -2.042 . . . . 0.0 106.79 171.086 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 538' ' ' LEU . . . . . 0.456 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 0.6 OUTLIER -65.28 -45.32 84.94 Favored 'General case' 0 N--CA 1.512 2.658 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 175.36 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 1.1 pp -76.52 -7.97 56.24 Favored 'General case' 0 N--CA 1.536 3.861 0 CA-C-N 118.992 0.814 . . . . 0.0 111.828 177.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -84.78 -0.69 54.66 Favored 'General case' 0 N--CA 1.525 3.303 0 CA-C-N 119.195 0.907 . . . . 0.0 109.635 175.253 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 541' ' ' LEU . . . . . 0.621 HD13 ' N ' ' B' ' 542' ' ' MET . 0.0 OUTLIER -118.72 -48.37 2.48 Favored 'General case' 0 N--CA 1.512 2.671 0 C-N-CA 125.039 1.336 . . . . 0.0 108.724 -178.731 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 542' ' ' MET . . . . . 0.621 ' N ' HD13 ' B' ' 541' ' ' LEU . 4.0 ptm -101.3 11.86 38.51 Favored 'General case' 0 N--CA 1.538 3.932 0 CA-C-O 118.584 -0.722 . . . . 0.0 112.83 -178.031 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 543' ' ' LEU . . . . . 0.489 ' O ' HG23 ' B' ' 544' ' ' THR . 0.2 OUTLIER -129.58 -86.24 0.54 Allowed 'General case' 0 N--CA 1.526 3.348 0 CA-C-O 117.322 -1.323 . . . . 0.0 112.182 -179.852 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 544' ' ' THR . . . . . 0.503 HG23 ' HB2' ' A' ' 898' ' ' TRP . 7.8 p 137.08 137.39 0.0 OUTLIER Pre-proline 1 N--CA 1.569 5.515 0 C-N-CA 127.8 2.44 . . . . 0.0 107.289 -178.777 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -62.55 -29.65 78.57 Favored 'Trans proline' 0 N--CA 1.516 2.835 0 C-N-CA 122.839 2.359 . . . . 0.0 112.964 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -62.8 -28.5 70.04 Favored 'General case' 1 N--CA 1.54 4.069 0 CA-C-N 118.744 0.702 . . . . 0.0 111.282 179.415 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -70.72 -41.87 71.32 Favored 'General case' 0 N--CA 1.525 3.322 0 CA-C-O 118.712 -0.661 . . . . 0.0 109.918 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 548' ' ' ARG . . . . . 0.428 ' HB2' ' HB2' ' A' ' 19' ' ' TRP . 28.8 ptt180 -72.9 -21.97 60.82 Favored 'General case' 0 N--CA 1.529 3.494 0 CA-C-O 118.273 -0.87 . . . . 0.0 111.276 177.68 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -66.36 -50.88 62.03 Favored 'General case' 1 N--CA 1.54 4.062 0 N-CA-C 106.614 -1.625 . . . . 0.0 106.614 175.634 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -76.55 -9.86 58.97 Favored 'General case' 0 N--CA 1.508 2.465 0 CA-C-O 117.363 -1.303 . . . . 0.0 111.026 177.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 551' ' ' LEU . . . . . 0.811 HD22 ' CE3' ' A' ' 19' ' ' TRP . 5.8 tp -79.88 -31.5 40.35 Favored 'General case' 0 N--CA 1.516 2.827 0 CA-C-N 120.158 1.344 . . . . 0.0 107.68 174.224 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -70.49 -56.17 7.88 Favored Glycine 0 N--CA 1.51 3.577 0 N-CA-C 108.68 -1.768 . . . . 0.0 108.68 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.5 m -64.88 -27.98 69.23 Favored 'General case' 0 N--CA 1.537 3.882 0 CA-C-O 118.043 -0.979 . . . . 0.0 112.042 -179.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 6.5 mtm180 -69.26 -49.84 52.48 Favored 'General case' 1 N--CA 1.543 4.188 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 176.5 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 555' ' ' VAL . . . . . 0.406 HG23 ' O ' ' B' ' 551' ' ' LEU . 23.6 t -65.71 -16.89 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.679 0 CA-C-O 118.067 -0.968 . . . . 0.0 109.532 176.619 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 11.7 mtt180 -78.16 -47.29 18.45 Favored 'General case' 0 N--CA 1.521 3.113 0 CA-C-O 117.43 -1.271 . . . . 0.0 111.257 178.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 557' ' ' ILE . . . . . 0.462 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -70.75 -22.66 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.527 0 CA-C-N 121.456 1.934 . . . . 0.0 110.918 -179.297 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 558' ' ' VAL . . . . . 0.462 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -85.8 -51.05 13.84 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.002 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 179.979 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -57.26 -26.17 60.37 Favored 'General case' 0 N--CA 1.536 3.835 0 CA-C-O 118.543 -0.742 . . . . 0.0 110.178 177.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -90.39 -28.35 18.73 Favored 'General case' 0 N--CA 1.529 3.512 0 CA-C-O 118.586 -0.721 . . . . 0.0 109.749 177.412 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 6.8 mt -66.37 -44.01 84.34 Favored 'General case' 1 N--CA 1.546 4.342 0 CA-C-N 118.96 0.8 . . . . 0.0 109.552 178.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 14.7 mt -60.7 -22.91 64.44 Favored 'General case' 0 N--CA 1.534 3.761 0 C-N-CA 124.159 0.984 . . . . 0.0 111.795 179.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -82.62 -48.36 11.03 Favored 'General case' 0 N--CA 1.525 3.307 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 66.4 79.56 0.2 Allowed Glycine 1 N--CA 1.526 4.641 0 CA-C-O 119.318 -0.712 . . . . 0.0 111.663 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -155.8 -51.57 0.08 Allowed 'General case' 0 N--CA 1.527 3.388 0 CA-C-N 117.463 0.632 . . . . 0.0 109.56 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 10.5 ptt? -152.99 63.33 0.78 Allowed 'General case' 0 N--CA 1.527 3.419 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 78.6 p -130.63 3.19 4.54 Favored 'General case' 0 N--CA 1.522 3.131 0 CA-C-N 115.166 -0.924 . . . . 0.0 113.257 -176.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 42.4 mm-40 -110.02 -55.16 2.48 Favored 'General case' 0 N--CA 1.522 3.157 0 CA-C-N 119.579 1.081 . . . . 0.0 111.873 -178.53 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.94 -58.87 1.8 Allowed 'General case' 0 N--CA 1.529 3.52 0 CA-C-N 118.125 0.42 . . . . 0.0 111.875 -177.006 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -73.64 0.44 12.76 Favored 'General case' 0 N--CA 1.517 2.904 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -176.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 571' ' ' LEU . . . . . 0.706 HD23 HD11 ' B' ' 582' ' ' ILE . 15.7 tp -77.67 -45.59 24.48 Favored 'General case' 0 N--CA 1.524 3.227 0 CA-C-N 120.299 1.409 . . . . 0.0 110.515 -179.452 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 572' ' ' LYS . . . . . 0.589 ' NZ ' HD13 ' B' ' 579' ' ' ILE . 0.7 OUTLIER -54.65 -37.01 65.17 Favored 'General case' 1 N--CA 1.544 4.233 0 CA-C-N 120.002 1.274 . . . . 0.0 110.889 178.303 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 31.0 t30 -61.71 -38.54 88.24 Favored 'General case' 0 N--CA 1.535 3.788 0 C-N-CA 123.154 0.581 . . . . 0.0 110.109 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -65.01 -64.01 0.97 Allowed 'General case' 0 N--CA 1.518 2.93 0 C-N-CA 124.078 0.951 . . . . 0.0 110.663 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 5.5 mp -97.81 -68.2 0.81 Allowed 'General case' 0 N--CA 1.522 3.13 0 C-N-CA 123.374 0.67 . . . . 0.0 111.044 -179.189 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 133.05 50.16 0.09 OUTLIER Glycine 1 N--CA 1.517 4.083 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 -178.376 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -111.18 114.72 28.16 Favored 'General case' 0 N--CA 1.52 3.067 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 178.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -41.88 167.34 0.01 OUTLIER Glycine 1 N--CA 1.535 5.267 0 C-N-CA 124.819 1.2 . . . . 0.0 115.914 -176.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 579' ' ' ILE . . . . . 0.589 HD13 ' NZ ' ' B' ' 572' ' ' LYS . 1.1 mp -81.86 -16.94 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.094 0 CA-C-O 117.643 -1.17 . . . . 0.0 108.438 176.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 580' ' ' ALA . . . . . 0.851 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -68.74 -37.92 79.78 Favored 'General case' 0 N--CA 1.526 3.371 0 CA-C-N 120.047 1.294 . . . . 0.0 108.87 176.058 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 581' ' ' THR . . . . . 0.455 HG21 ' OP2' ' F' ' 14' ' ' ' DT' . 1.1 p -79.7 -37.24 36.14 Favored 'General case' 0 N--CA 1.534 3.733 0 C-N-CA 123.191 0.597 . . . . 0.0 112.544 178.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 582' ' ' ILE . . . . . 0.706 HD11 HD23 ' B' ' 571' ' ' LEU . 0.4 OUTLIER -70.86 -37.73 69.62 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.35 0 C-N-CA 123.336 0.654 . . . . 0.0 111.343 -175.096 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 82.3 p -95.22 -28.78 14.85 Favored 'General case' 0 N--CA 1.513 2.699 0 CA-C-O 117.987 -1.006 . . . . 0.0 111.003 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 14.2 ptt180 -74.65 -21.58 59.35 Favored 'General case' 0 N--CA 1.528 3.469 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 173.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -69.11 -26.49 74.62 Favored Glycine 1 N--CA 1.517 4.071 0 N-CA-C 108.464 -1.854 . . . . 0.0 108.464 173.355 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 16.4 m -68.41 -36.78 79.58 Favored 'General case' 1 N--CA 1.539 4.01 0 CA-C-N 118.293 1.046 . . . . 0.0 108.862 176.365 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -62.19 -22.35 65.84 Favored 'General case' 0 N--CA 1.539 3.977 0 C-N-CA 123.182 0.593 . . . . 0.0 110.478 176.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 62.4 m -47.63 -47.54 29.05 Favored 'General case' 1 N--CA 1.544 4.226 0 C-N-CA 124.97 1.308 . . . . 0.0 111.091 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 28.0 mt -69.58 -41.14 76.19 Favored 'General case' 0 N--CA 1.519 2.986 0 C-N-CA 123.655 0.782 . . . . 0.0 109.974 178.137 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 12.1 mmpt? -55.3 -29.11 57.57 Favored 'General case' 1 N--CA 1.545 4.297 0 C-N-CA 123.684 0.794 . . . . 0.0 112.361 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -82.81 -44.8 15.1 Favored 'General case' 0 N--CA 1.515 2.792 0 C-N-CA 123.104 0.562 . . . . 0.0 110.586 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -70.08 158.9 86.26 Favored Pre-proline 0 N--CA 1.53 3.544 0 CA-C-O 118.518 -0.753 . . . . 0.0 112.496 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -81.2 176.29 8.94 Favored 'Trans proline' 0 C--N 1.379 2.142 0 C-N-CA 122.273 1.982 . . . . 0.0 111.064 178.139 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.1 t -89.81 -26.71 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.522 3.149 0 CA-C-O 117.708 -1.139 . . . . 0.0 111.609 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -62.75 -39.17 93.29 Favored 'General case' 0 N--CA 1.516 2.852 0 CA-C-N 120.159 1.345 . . . . 0.0 109.872 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 596' ' ' LEU . . . . . 0.61 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.7 mp -100.26 -11.04 20.7 Favored 'General case' 0 N--CA 1.514 2.74 0 C-N-CA 123.564 0.746 . . . . 0.0 112.103 177.578 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -33.3 75.36 Favored 'General case' 1 N--CA 1.543 4.207 0 N-CA-C 102.344 -3.206 . . . . 0.0 102.344 165.996 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -56.63 -36.57 69.64 Favored 'General case' 0 N--CA 1.52 3.043 0 C-N-CA 124.712 1.205 . . . . 0.0 110.465 174.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 599' ' ' TRP . . . . . 0.649 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 35.4 t90 -63.25 -37.06 85.75 Favored 'General case' 1 N--CA 1.54 4.053 0 N-CA-C 107.092 -1.447 . . . . 0.0 107.092 176.439 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.79 -35.89 57.35 Favored 'General case' 0 N--CA 1.538 3.957 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 176.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -71.28 -37.0 71.89 Favored 'General case' 1 N--CA 1.541 4.111 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 175.366 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -60.34 -22.87 63.74 Favored 'General case' 1 N--CA 1.544 4.247 0 C-N-CA 123.5 0.72 . . . . 0.0 109.861 174.656 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 603' ' ' VAL . . . . . 0.551 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.0 OUTLIER -115.48 1.65 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.407 0 CA-C-O 118.423 -0.798 . . . . 0.0 112.471 -177.356 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 42.8 mt -108.28 -64.85 1.18 Allowed 'General case' 0 N--CA 1.523 3.212 0 N-CA-C 104.666 -2.346 . . . . 0.0 104.666 174.3 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 6.4 tp -48.57 -34.9 12.34 Favored 'General case' 0 N--CA 1.537 3.875 0 C-N-CA 125.442 1.497 . . . . 0.0 111.912 178.461 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt 86.87 -36.84 0.03 OUTLIER 'General case' 1 N--CA 1.541 4.103 0 C-N-CA 125.999 1.72 . . . . 0.0 111.608 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 60.1 m . . . . . 1 N--CA 1.542 4.126 0 C-N-CA 124.573 1.149 . . . . 0.0 111.257 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 898' ' ' TRP . . . . . 0.503 ' HB2' HG23 ' B' ' 544' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.135 0 CA-C-O 118.27 -0.871 . . . . 0.0 109.581 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 998' ' ' TRP . . . . . 0.425 ' HB2' ' CG2' ' A' ' 44' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.188 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.559 9.869 2 O4'-C1'-N19 119.777 14.971 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.448 6 O4'-C1'-N19 119.285 14.356 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.79 2 C4'-C3'-C2' 117.359 14.159 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . 0.659 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 4 C3'--C2' 1.422 -9.616 5 O4'-C1'-N19 120.564 15.955 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' E' E ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.577 11.238 5 C4'-C3'-C2' 116.291 13.091 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.405 -11.292 4 O4'-C1'-N19 118.42 13.276 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' E' E ' 7' ' ' ' DA' . . . . . 0.666 H2'' " H5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.396 -12.219 5 C4'-C3'-C2' 111.87 8.67 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' E' E ' 8' ' ' ' DG' . . . . . 0.666 " H5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 O3'--C3' 1.578 11.289 4 O4'-C1'-N19 118.154 12.942 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.408 -10.95 5 O4'-C1'-N19 119.416 14.52 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.412 -10.563 4 O4'-C1'-N19 119.929 15.161 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.396 3 O4'-C1'-N19 119.764 14.954 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.283 4 O4'-C1'-N19 118.701 13.627 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.414 -10.4 5 O4'-C1'-N19 118.989 13.986 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' E' E ' 14' ' ' ' DT' . . . . . 0.735 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.415 -10.258 3 O4'-C1'-N19 119.109 14.136 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' E' E ' 15' ' ' ' DA' . . . . . 0.974 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 4 C3'--C2' 1.426 -9.155 5 O4'-C1'-N19 119.818 15.023 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.419 -9.886 5 O4'-C1'-N19 119.24 14.3 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.569 10.6 4 O4'-C1'-N19 120.038 15.297 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.616 5 O4'-C1'-N19 120.14 15.425 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.409 -10.91 4 O4'-C1'-N19 120.729 16.161 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.512 7.077 4 O4'-C1'-N19 118.908 13.885 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.568 10.516 3 C4'-C3'-C2' 116.521 13.321 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.412 -10.591 5 O4'-C1'-N19 119.282 14.353 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.554 4 O4'-C1'-N19 120.178 15.472 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' F' F ' 4' ' ' ' DA' . . . . . 0.568 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.419 -9.868 5 O4'-C1'-N19 119.438 14.547 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' F' F ' 5' ' ' ' DC' . . . . . 0.589 ' H41' ' HA ' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.417 -10.148 4 O4'-C1'-N19 119.639 14.799 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -10.979 5 O4'-C1'-N19 119.309 14.386 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.425 -10.328 3 C4'-C3'-C2' 113.65 10.45 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.422 -9.589 4 O4'-C1'-N19 119.476 14.595 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.594 5 O4'-C1'-N19 119.621 14.777 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.406 -11.17 4 O4'-C1'-N19 118.391 13.239 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.421 -9.746 4 O4'-C1'-N19 120.803 16.254 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.564 10.225 2 O4'-C1'-N19 120.384 15.73 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.403 -11.525 5 O4'-C1'-N19 118.092 12.865 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' F' F ' 14' ' ' ' DT' . . . . . 0.669 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 7 C3'--C2' 1.413 -10.525 3 O4'-C1'-N19 118.676 13.595 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' F' F ' 15' ' ' ' DA' . . . . . 0.675 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.415 -10.34 6 O4'-C1'-N19 119.99 15.237 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' F' F ' 16' ' ' ' DG' . . . . . 0.426 ' O6 ' ' HB ' ' B' ' 579' ' ' ILE . . . . . . . . 5 C3'--C2' 1.419 -9.938 5 O4'-C1'-N19 120.089 15.362 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear build full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.421 -9.73 3 O4'-C1'-N19 119.422 14.527 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.568 4 O4'-C1'-N19 119.347 14.434 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.778 5 O4'-C1'-N19 119.916 15.145 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.514 7.244 3 O4'-C1'-N19 119.669 14.836 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 . . . . . 0 N--CA 1.502 2.15 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.5 t -116.3 145.71 35.69 Favored Pre-proline 0 N--CA 1.527 3.422 0 CA-C-O 118.061 -0.971 . . . . 0.0 111.33 -179.033 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -68.29 136.35 36.9 Favored 'Trans proline' 0 C--N 1.394 2.955 0 C-N-CA 122.759 2.306 . . . . 0.0 112.306 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -122.87 -55.67 1.79 Allowed 'General case' 0 N--CA 1.517 2.887 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 72.5 m -131.56 121.8 25.02 Favored 'General case' 0 N--CA 1.518 2.938 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 178.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -106.06 125.14 50.64 Favored 'General case' 0 N--CA 1.518 2.97 0 C-N-CA 122.831 0.453 . . . . 0.0 109.868 -178.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -162.69 129.73 3.63 Favored 'General case' 0 N--CA 1.527 3.391 0 C-N-CA 122.808 0.443 . . . . 0.0 110.442 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 72.3 mtp -107.94 -68.56 0.9 Allowed 'General case' 0 N--CA 1.523 3.198 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -164.51 144.58 7.66 Favored 'General case' 0 N--CA 1.53 3.529 0 CA-C-N 118.444 0.565 . . . . 0.0 111.832 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -127.15 -60.55 1.2 Allowed 'General case' 0 N--CA 1.519 3.011 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 178.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -140.9 114.45 8.82 Favored 'General case' 0 N--CA 1.523 3.197 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 178.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.7 mmt180 -134.92 -53.4 0.8 Allowed 'General case' 0 N--CA 1.523 3.215 0 CA-C-O 119.178 -0.439 . . . . 0.0 110.045 -178.334 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -110.8 130.05 55.68 Favored 'General case' 0 N--CA 1.528 3.427 0 C-N-CA 123.054 0.541 . . . . 0.0 109.58 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -106.34 119.29 38.87 Favored 'General case' 0 N--CA 1.519 3.005 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -126.81 -82.06 0.61 Allowed 'General case' 0 N--CA 1.52 3.064 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.625 ' CZ3' HD22 ' B' ' 551' ' ' LEU . 76.4 t-105 -51.03 -42.35 60.41 Favored 'General case' 0 N--CA 1.532 3.625 0 C-N-CA 123.359 0.664 . . . . 0.0 110.085 176.228 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.432 ' N ' HD22 ' A' ' 20' ' ' LEU . 2.9 mm? -77.77 -28.18 50.49 Favored 'General case' 0 N--CA 1.516 2.833 0 O-C-N 124.925 1.391 . . . . 0.0 112.112 -176.019 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 27.7 tpt180 -57.9 -27.76 63.6 Favored 'General case' 1 N--CA 1.539 4.005 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 173.58 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.516 ' CG ' HD21 ' B' ' 551' ' ' LEU . 0.1 OUTLIER -81.6 -39.56 24.33 Favored 'General case' 0 N--CA 1.509 2.495 0 CA-C-O 117.092 -1.432 . . . . 0.0 108.829 172.876 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 26.3 t -66.97 -38.67 81.83 Favored 'Isoleucine or valine' 1 N--CA 1.561 5.085 0 CA-C-N 120.207 1.367 . . . . 0.0 113.478 -174.794 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -67.79 -50.87 54.61 Favored 'General case' 1 N--CA 1.542 4.135 0 CA-C-N 120.027 1.285 . . . . 0.0 109.349 -178.58 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.1 mp -69.86 -17.47 63.37 Favored 'General case' 0 N--CA 1.533 3.709 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 175.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.08 -37.82 84.64 Favored 'General case' 0 N--CA 1.519 3.004 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 175.488 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.443 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 23.9 ttmt -63.44 -23.48 67.42 Favored 'General case' 0 N--CA 1.526 3.348 0 CA-C-O 118.303 -0.856 . . . . 0.0 111.385 177.386 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -70.88 -41.89 70.74 Favored 'General case' 0 N--CA 1.534 3.751 0 CA-C-N 119.221 0.919 . . . . 0.0 108.525 176.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.65 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -89.24 -3.28 58.61 Favored 'General case' 0 CA--C 1.581 2.153 0 CA-C-O 118.446 -0.788 . . . . 0.0 110.672 177.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.443 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -86.5 -36.72 18.84 Favored 'General case' 0 N--CA 1.534 3.739 0 CA-C-N 120.513 1.506 . . . . 0.0 108.832 179.991 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -59.78 -44.33 93.97 Favored 'General case' 0 N--CA 1.536 3.853 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 177.091 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -87.44 -86.47 0.16 Allowed 'General case' 0 N--CA 1.514 2.741 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 176.557 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 p30 149.31 45.15 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.912 0 C-N-CA 127.656 2.382 . . . . 0.0 109.109 177.75 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.51 HD22 ' CD2' ' B' ' 596' ' ' LEU . 5.7 mt -104.79 15.33 28.07 Favored 'General case' 0 N--CA 1.528 3.436 0 C-N-CA 124.177 0.991 . . . . 0.0 110.25 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.556 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 48.9 p-80 -84.7 6.64 23.42 Favored 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 175.115 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.675 ' HA ' HD23 ' A' ' 39' ' ' LEU . 26.7 mt -95.58 -52.29 0.23 Allowed Pre-proline 0 N--CA 1.501 2.097 0 CA-C-O 116.942 -1.504 . . . . 0.0 108.633 -175.712 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.496 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 4.3 Cg_exo -67.16 -33.5 31.06 Favored 'Trans proline' 0 C--N 1.39 2.726 0 N-CA-C 106.64 -2.1 . . . . 0.0 106.64 170.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.556 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.6 OUTLIER -63.45 -40.64 97.68 Favored 'General case' 0 N--CA 1.517 2.884 0 CA-C-O 118.01 -0.995 . . . . 0.0 109.203 176.887 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.675 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -75.91 -18.45 59.37 Favored 'General case' 1 N--CA 1.544 4.231 0 CA-C-N 119.921 1.237 . . . . 0.0 110.46 177.333 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -80.09 -7.39 58.86 Favored 'General case' 0 N--CA 1.525 3.325 0 CA-C-N 119.45 1.023 . . . . 0.0 110.062 175.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.549 HD13 ' N ' ' A' ' 42' ' ' MET . 0.8 OUTLIER -106.46 -60.26 1.68 Allowed 'General case' 0 N--CA 1.521 3.112 0 C-N-CA 124.019 0.927 . . . . 0.0 111.58 -178.487 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.549 ' N ' HD13 ' A' ' 41' ' ' LEU . 13.5 ptt? -93.47 3.76 55.05 Favored 'General case' 1 N--CA 1.546 4.353 0 CA-C-N 119.442 1.019 . . . . 0.0 113.504 -177.056 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.532 HD11 HD11 ' B' ' 551' ' ' LEU . 5.1 mp -120.73 -94.63 0.5 Allowed 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 178.139 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.685 HG23 ' HB2' ' B' ' 998' ' ' TRP . 0.7 OUTLIER 156.55 169.82 0.01 OUTLIER Pre-proline 1 N--CA 1.575 5.801 0 C-N-CA 125.747 1.619 . . . . 0.0 109.685 179.706 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -68.29 -37.37 14.02 Favored 'Trans proline' 0 C--N 1.392 2.841 0 C-N-CA 121.918 1.745 . . . . 0.0 108.099 174.581 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -64.25 -22.33 66.91 Favored 'General case' 0 N--CA 1.527 3.404 0 C-N-CA 123.518 0.727 . . . . 0.0 110.418 176.174 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -70.22 -38.45 75.25 Favored 'General case' 0 N--CA 1.524 3.257 0 CA-C-O 117.438 -1.267 . . . . 0.0 109.867 178.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 26.1 ptt180 -80.91 -17.34 50.92 Favored 'General case' 0 N--CA 1.539 3.986 0 CA-C-N 119.992 1.269 . . . . 0.0 108.32 173.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -74.47 -18.63 60.6 Favored 'General case' 0 N--CA 1.52 3.045 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 172.56 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 54' ' ' ARG . . . -90.14 -46.81 8.21 Favored 'General case' 0 N--CA 1.504 2.264 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 178.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.494 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 23.6 tp -66.81 -21.12 66.04 Favored 'General case' 1 N--CA 1.546 4.357 0 CA-C-N 120.613 1.551 . . . . 0.0 108.005 173.966 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.454 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -71.04 -72.21 0.93 Allowed Glycine 0 N--CA 1.502 3.089 0 C-N-CA 125.707 1.623 . . . . 0.0 111.421 177.524 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.9 m -70.18 -25.21 63.32 Favored 'General case' 0 N--CA 1.532 3.659 0 CA-C-O 117.639 -1.172 . . . . 0.0 112.526 -177.276 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 2.5 mpt_? -73.61 -51.8 15.59 Favored 'General case' 0 N--CA 1.53 3.539 0 CA-C-N 120.213 1.37 . . . . 0.0 107.545 177.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.2 t -62.23 -18.41 19.97 Favored 'Isoleucine or valine' 1 N--CA 1.545 4.309 0 CA-C-N 119.472 1.033 . . . . 0.0 109.853 175.067 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.6 mmm180 -75.86 -48.48 21.3 Favored 'General case' 0 N--CA 1.517 2.897 0 CA-C-O 117.343 -1.313 . . . . 0.0 111.903 178.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -71.32 -21.63 21.89 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.439 0 CA-C-N 121.171 1.805 . . . . 0.0 111.303 -178.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -87.69 -52.01 11.97 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.011 0 CA-C-N 119.96 1.255 . . . . 0.0 107.869 -178.91 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -62.73 -21.6 65.92 Favored 'General case' 0 N--CA 1.528 3.474 0 CA-C-O 118.58 -0.724 . . . . 0.0 110.202 177.415 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -91.86 -23.96 19.49 Favored 'General case' 0 N--CA 1.526 3.338 0 CA-C-O 118.082 -0.961 . . . . 0.0 110.273 177.279 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.6 mt -77.62 -61.86 1.85 Allowed 'General case' 0 N--CA 1.535 3.801 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 178.02 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.3 tt -43.4 -37.85 2.51 Favored 'General case' 1 N--CA 1.545 4.321 0 C-N-CA 125.98 1.712 . . . . 0.0 112.798 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -87.99 -62.64 1.45 Allowed 'General case' 0 N--CA 1.524 3.269 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.608 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.17 83.29 1.43 Allowed Glycine 0 N--CA 1.513 3.821 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 179.432 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -131.21 -58.3 1.0 Allowed 'General case' 0 N--CA 1.521 3.12 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 15.1 ptt? -154.4 82.32 1.12 Allowed 'General case' 0 N--CA 1.522 3.159 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 178.186 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.4 ' HA ' HD22 ' A' ' 71' ' ' LEU . 3.8 t -130.0 -9.52 4.35 Favored 'General case' 0 N--CA 1.523 3.214 0 CA-C-O 117.993 -1.003 . . . . 0.0 113.464 -176.459 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -106.75 -65.27 1.1 Allowed 'General case' 0 N--CA 1.533 3.71 0 CA-C-N 120.437 1.472 . . . . 0.0 111.54 -177.607 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.4 mtt180 -104.71 -45.88 4.48 Favored 'General case' 0 N--CA 1.53 3.533 0 C-N-CA 123.148 0.579 . . . . 0.0 109.843 -178.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -66.82 -10.35 46.96 Favored 'General case' 0 N--CA 1.52 3.062 0 CA-C-O 118.376 -0.821 . . . . 0.0 112.962 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.644 HD23 HG21 ' A' ' 82' ' ' ILE . 28.6 tp -88.73 -55.44 3.71 Favored 'General case' 0 N--CA 1.524 3.234 0 CA-C-N 119.748 1.158 . . . . 0.0 113.186 -177.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -37.99 -37.47 0.26 Allowed 'General case' 1 N--CA 1.552 4.664 0 N-CA-C 114.217 1.192 . . . . 0.0 114.217 -177.118 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -73.72 -44.11 57.3 Favored 'General case' 0 N--CA 1.533 3.687 0 CA-C-N 118.158 0.435 . . . . 0.0 110.411 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -46.57 -49.51 18.69 Favored 'General case' 0 N--CA 1.533 3.692 0 C-N-CA 124.888 1.275 . . . . 0.0 113.49 -179.136 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.4 pp -132.34 -43.0 0.95 Allowed 'General case' 0 N--CA 1.532 3.656 0 CA-C-O 118.803 -0.618 . . . . 0.0 111.974 -178.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 111.62 74.88 0.74 Allowed Glycine 1 N--CA 1.525 4.61 0 N-CA-C 110.588 -1.005 . . . . 0.0 110.588 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.68 -37.48 5.9 Favored 'General case' 0 N--CA 1.526 3.334 0 C-N-CA 123.409 0.684 . . . . 0.0 110.528 179.047 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 100.16 163.8 28.66 Favored Glycine 1 N--CA 1.523 4.459 0 N-CA-C 109.429 -1.468 . . . . 0.0 109.429 -177.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.568 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 3.0 mt -86.57 -11.49 11.1 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.664 0 CA-C-N 119.403 1.602 . . . . 0.0 109.296 178.209 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.974 ' HB2' ' H62' ' E' ' 15' ' ' ' DA' . . . -72.34 -36.93 68.95 Favored 'General case' 0 N--CA 1.526 3.326 0 CA-C-N 119.93 1.241 . . . . 0.0 110.49 176.732 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.468 HG21 ' OP2' ' E' ' 14' ' ' ' DT' . 2.2 p -83.93 -39.18 20.1 Favored 'General case' 1 N--CA 1.541 4.081 0 CA-C-N 119.517 1.053 . . . . 0.0 112.227 -179.02 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.644 HG21 HD23 ' A' ' 71' ' ' LEU . 1.8 pt -73.28 -14.79 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.718 0 CA-C-O 117.85 -1.071 . . . . 0.0 112.938 -177.763 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 50.3 p -112.6 -33.18 6.22 Favored 'General case' 0 N--CA 1.514 2.755 0 CA-C-N 119.951 1.251 . . . . 0.0 110.184 178.123 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 13.8 ptt180 -72.81 -21.46 60.97 Favored 'General case' 0 N--CA 1.532 3.659 0 CA-C-N 119.464 1.029 . . . . 0.0 108.426 174.193 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -64.73 -33.49 87.37 Favored Glycine 1 N--CA 1.52 4.249 0 N-CA-C 109.313 -1.515 . . . . 0.0 109.313 175.612 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.6 t -63.96 -33.18 75.15 Favored 'General case' 1 N--CA 1.539 4.021 0 CA-C-N 118.282 1.041 . . . . 0.0 109.748 176.798 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -55.65 -33.8 64.39 Favored 'General case' 1 N--CA 1.547 4.376 0 C-N-CA 123.335 0.654 . . . . 0.0 111.285 177.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.7 m -62.15 -34.71 76.91 Favored 'General case' 1 N--CA 1.54 4.043 0 C-N-CA 123.728 0.811 . . . . 0.0 112.114 -179.56 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.3 mt -56.13 -42.32 76.73 Favored 'General case' 0 N--CA 1.536 3.831 0 C-N-CA 123.892 0.877 . . . . 0.0 111.166 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -21.53 61.49 Favored 'General case' 0 N--CA 1.534 3.739 0 CA-C-O 118.244 -0.884 . . . . 0.0 112.116 -179.401 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.76 -41.65 26.17 Favored 'General case' 0 N--CA 1.517 2.892 0 CA-C-N 119.157 0.889 . . . . 0.0 111.669 -179.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.17 159.9 13.56 Favored Pre-proline 1 N--CA 1.543 4.203 0 CA-C-O 118.471 -0.776 . . . . 0.0 113.079 -178.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -85.1 157.22 11.32 Favored 'Trans proline' 0 C--N 1.379 2.183 0 C-N-CA 122.285 1.99 . . . . 0.0 110.261 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 t -78.54 -27.71 14.22 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.114 0 CA-C-O 117.873 -1.061 . . . . 0.0 111.102 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -58.82 -44.21 90.79 Favored 'General case' 0 N--CA 1.518 2.932 0 CA-C-N 120.173 1.351 . . . . 0.0 109.949 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.769 HD21 HD22 ' B' ' 534' ' ' LEU . 7.7 mp -100.18 -7.46 24.73 Favored 'General case' 0 N--CA 1.512 2.667 0 CA-C-O 118.362 -0.827 . . . . 0.0 112.71 177.65 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -35.86 81.9 Favored 'General case' 0 N--CA 1.539 3.979 0 N-CA-C 102.361 -3.2 . . . . 0.0 102.361 168.048 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.59 -40.39 65.64 Favored 'General case' 0 N--CA 1.515 2.794 0 C-N-CA 124.492 1.117 . . . . 0.0 111.332 174.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.67 ' CH2' ' HB2' ' B' ' 529' ' ' ALA . 51.5 t90 -64.47 -35.59 81.44 Favored 'General case' 1 N--CA 1.541 4.09 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 177.601 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.57 -37.69 63.17 Favored 'General case' 0 N--CA 1.533 3.681 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 176.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -69.0 -37.24 78.6 Favored 'General case' 1 N--CA 1.539 4.016 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 175.5 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.15 -25.31 61.32 Favored 'General case' 1 N--CA 1.542 4.156 0 C-N-CA 123.089 0.556 . . . . 0.0 110.067 175.575 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.524 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.3 OUTLIER -120.37 5.51 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.482 0 C-N-CA 123.592 0.757 . . . . 0.0 112.792 -176.845 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -125.45 -56.85 1.5 Allowed 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 178.474 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 4.1 tt -46.99 -66.99 0.32 Allowed 'General case' 1 N--CA 1.544 4.273 0 C-N-CA 124.914 1.286 . . . . 0.0 113.524 -179.136 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 72.0 tttt -106.61 -66.99 0.97 Allowed 'General case' 0 N--CA 1.526 3.375 0 CA-C-N 118.649 0.659 . . . . 0.0 111.525 -177.371 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 49.1 p . . . . . 0 N--CA 1.532 3.643 0 CA-C-O 118.104 -0.95 . . . . 0.0 111.41 -178.078 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 . . . . . 0 N--CA 1.501 2.102 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 5.3 t -114.24 127.95 26.31 Favored Pre-proline 0 N--CA 1.523 3.211 0 CA-C-O 117.411 -1.281 . . . . 0.0 108.97 179.172 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -63.73 117.97 4.93 Favored 'Trans proline' 0 C--N 1.395 3.022 0 C-N-CA 122.748 2.299 . . . . 0.0 111.922 -179.034 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -153.65 119.8 5.43 Favored 'General case' 0 N--CA 1.521 3.087 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 73.4 m -124.47 130.52 52.62 Favored 'General case' 0 N--CA 1.52 3.067 0 C-N-CA 122.933 0.493 . . . . 0.0 110.007 -178.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -106.12 -44.69 4.51 Favored 'General case' 0 N--CA 1.519 2.994 0 C-N-CA 123.093 0.557 . . . . 0.0 109.886 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -113.88 128.61 56.48 Favored 'General case' 0 N--CA 1.518 2.931 0 C-N-CA 123.217 0.607 . . . . 0.0 110.338 -179.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 46.9 ttm -147.31 -55.96 0.24 Allowed 'General case' 0 N--CA 1.522 3.172 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -113.82 -45.44 3.09 Favored 'General case' 0 N--CA 1.518 2.956 0 C-N-CA 123.728 0.811 . . . . 0.0 109.076 178.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -106.82 128.37 54.2 Favored 'General case' 0 N--CA 1.523 3.178 0 C-N-CA 123.257 0.623 . . . . 0.0 109.772 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -110.3 -56.62 2.31 Favored 'General case' 0 N--CA 1.518 2.957 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -145.85 124.53 12.56 Favored 'General case' 0 N--CA 1.532 3.638 0 C-N-CA 123.262 0.625 . . . . 0.0 109.835 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 33.8 p-80 -78.01 131.03 37.18 Favored 'General case' 0 N--CA 1.533 3.709 0 C-N-CA 122.654 0.382 . . . . 0.0 110.59 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 -102.45 127.68 49.38 Favored 'General case' 0 N--CA 1.523 3.207 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -149.66 -78.4 0.14 Allowed 'General case' 0 N--CA 1.523 3.212 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.512 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 519' ' ' TRP . . . . . 0.664 ' CE2' HD22 ' A' ' 39' ' ' LEU . 71.7 t-105 -43.07 -28.66 0.29 Allowed 'General case' 1 N--CA 1.55 4.555 0 C-N-CA 124.279 1.032 . . . . 0.0 113.424 179.855 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 520' ' ' LEU . . . . . 0.587 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.3 mm? -95.76 -31.43 13.2 Favored 'General case' 0 N--CA 1.526 3.373 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.693 -173.262 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.11 -22.92 65.1 Favored 'General case' 0 N--CA 1.539 3.994 0 N-CA-C 106.904 -1.517 . . . . 0.0 106.904 171.753 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 522' ' ' PHE . . . . . 0.515 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.6 m-85 -81.82 -40.16 22.94 Favored 'General case' 0 N--CA 1.509 2.494 0 N-CA-C 107.208 -1.404 . . . . 0.0 107.208 174.167 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 20.4 t -58.88 -44.81 91.56 Favored 'Isoleucine or valine' 1 N--CA 1.565 5.313 0 CA-C-O 117.603 -1.189 . . . . 0.0 113.292 -179.059 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -61.05 -46.11 92.01 Favored 'General case' 1 N--CA 1.548 4.462 0 CA-C-N 120.641 1.564 . . . . 0.0 110.038 -178.484 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 1.7 tp -67.38 -26.52 66.5 Favored 'General case' 0 N--CA 1.536 3.829 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 176.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 526' ' ' LEU . . . . . 0.441 HD23 ' O ' ' B' ' 522' ' ' PHE . 1.6 mm? -68.06 -31.78 71.67 Favored 'General case' 0 N--CA 1.522 3.141 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 176.745 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 527' ' ' LYS . . . . . 0.484 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 15.2 tttt -67.79 -23.3 65.19 Favored 'General case' 0 N--CA 1.521 3.118 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.833 177.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -71.99 -41.27 67.83 Favored 'General case' 0 N--CA 1.534 3.744 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 176.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 529' ' ' ALA . . . . . 0.67 ' HB2' ' CH2' ' A' ' 99' ' ' TRP . . . -88.6 -7.34 56.59 Favored 'General case' 0 N--CA 1.503 2.219 0 CA-C-O 118.427 -0.797 . . . . 0.0 110.569 177.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 530' ' ' TYR . . . . . 0.484 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.5 OUTLIER -82.07 -35.68 28.44 Favored 'General case' 0 N--CA 1.532 3.671 0 CA-C-N 120.309 1.413 . . . . 0.0 108.737 179.798 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -60.7 -45.07 95.6 Favored 'General case' 0 N--CA 1.538 3.932 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.033 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -90.67 -84.0 0.25 Allowed 'General case' 0 N--CA 1.515 2.805 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 177.415 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.0 p30 149.31 47.34 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.88 0 C-N-CA 128.105 2.562 . . . . 0.0 108.104 178.633 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 534' ' ' LEU . . . . . 0.769 HD22 HD21 ' A' ' 96' ' ' LEU . 7.3 mt -102.89 9.13 39.0 Favored 'General case' 0 N--CA 1.529 3.523 0 C-N-CA 124.095 0.958 . . . . 0.0 111.606 -178.552 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 535' ' ' HIS . . . . . 0.623 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 49.2 p-80 -80.76 0.38 34.95 Favored 'General case' 0 N--CA 1.512 2.657 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 175.006 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 536' ' ' LEU . . . . . 0.441 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 33.8 mt -94.01 -51.43 0.26 Allowed Pre-proline 0 N--CA 1.505 2.303 0 CA-C-O 116.343 -1.789 . . . . 0.0 109.067 -175.686 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 537' ' ' PRO . . . . . 0.441 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 3.7 Cg_exo -64.57 -37.42 37.71 Favored 'Trans proline' 0 C--N 1.396 3.048 0 N-CA-C 107.071 -1.934 . . . . 0.0 107.071 170.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 538' ' ' LEU . . . . . 0.437 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 1.2 tm? -60.28 -41.53 93.51 Favored 'General case' 0 N--CA 1.527 3.387 0 C-N-CA 124.332 1.053 . . . . 0.0 108.736 175.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 11.0 mt -71.78 -25.04 61.86 Favored 'General case' 0 N--CA 1.536 3.836 0 CA-C-O 118.247 -0.883 . . . . 0.0 111.452 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -77.88 -8.05 57.54 Favored 'General case' 0 N--CA 1.53 3.526 0 CA-C-N 119.31 0.959 . . . . 0.0 110.187 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 541' ' ' LEU . . . . . 0.497 HD22 ' O ' ' B' ' 541' ' ' LEU . 0.0 OUTLIER -103.6 -42.17 5.74 Favored 'General case' 0 N--CA 1.512 2.656 0 C-N-CA 124.033 0.933 . . . . 0.0 109.779 -179.388 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 542' ' ' MET . . . . . 0.48 ' N ' HD13 ' B' ' 541' ' ' LEU . 15.1 ptp -85.2 -28.08 25.69 Favored 'General case' 0 N--CA 1.534 3.764 0 CA-C-O 117.439 -1.267 . . . . 0.0 113.252 -177.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 1.8 tt -131.54 -110.27 0.25 Allowed 'General case' 0 N--CA 1.533 3.691 0 CA-C-O 116.967 -1.492 . . . . 0.0 112.886 -177.132 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 24.3 p -163.75 162.81 16.57 Favored Pre-proline 1 N--CA 1.542 4.168 0 CA-C-N 120.754 1.615 . . . . 0.0 111.823 -177.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -76.43 -32.09 4.06 Favored 'Trans proline' 0 CA--C 1.578 2.677 0 C-N-CA 122.792 2.328 . . . . 0.0 109.551 174.201 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -55.63 -36.41 66.97 Favored 'General case' 1 N--CA 1.546 4.338 0 C-N-CA 123.876 0.87 . . . . 0.0 111.523 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -71.66 -32.57 68.03 Favored 'General case' 0 N--CA 1.523 3.191 0 CA-C-O 117.637 -1.173 . . . . 0.0 110.778 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 20.5 ptt180 -74.16 -21.21 59.94 Favored 'General case' 0 N--CA 1.534 3.731 0 CA-C-N 120.027 1.285 . . . . 0.0 109.618 175.379 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -65.19 -44.43 88.41 Favored 'General case' 0 N--CA 1.536 3.832 0 N-CA-C 106.184 -1.784 . . . . 0.0 106.184 173.142 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -72.22 -20.29 61.59 Favored 'General case' 0 N--CA 1.517 2.915 0 CA-C-O 117.198 -1.382 . . . . 0.0 110.764 176.442 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 551' ' ' LEU . . . . . 0.625 HD22 ' CZ3' ' A' ' 19' ' ' TRP . 12.3 tp -80.42 -20.26 44.32 Favored 'General case' 0 N--CA 1.524 3.238 0 CA-C-N 120.582 1.537 . . . . 0.0 109.168 175.481 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -77.35 -52.18 5.73 Favored Glycine 0 N--CA 1.507 3.401 0 N-CA-C 108.333 -1.907 . . . . 0.0 108.333 177.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.5 m -70.32 -32.54 70.33 Favored 'General case' 0 N--CA 1.535 3.825 0 CA-C-O 118.703 -0.665 . . . . 0.0 110.842 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -63.9 -54.64 31.56 Favored 'General case' 1 N--CA 1.539 4.007 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 176.733 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 38.9 t -66.28 -14.9 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.531 0 CA-C-O 117.759 -1.115 . . . . 0.0 110.995 177.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.77 -44.39 20.77 Favored 'General case' 0 N--CA 1.526 3.374 0 CA-C-N 120.168 1.349 . . . . 0.0 111.539 178.359 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 557' ' ' ILE . . . . . 0.451 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -71.94 -22.49 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.278 0 CA-C-N 120.724 1.602 . . . . 0.0 110.213 -179.669 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 558' ' ' VAL . . . . . 0.451 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -88.44 -52.49 11.09 Favored 'Isoleucine or valine' 1 N--CA 1.543 4.181 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 -179.789 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -57.72 -24.28 56.12 Favored 'General case' 0 N--CA 1.536 3.826 0 CA-C-O 118.895 -0.574 . . . . 0.0 110.487 177.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -98.07 -22.81 16.04 Favored 'General case' 0 N--CA 1.527 3.377 0 CA-C-O 118.059 -0.972 . . . . 0.0 111.363 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 16.6 tp -78.72 -63.17 1.47 Allowed 'General case' 0 N--CA 1.537 3.878 0 CA-C-N 119.637 1.108 . . . . 0.0 108.473 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 25.9 mt -41.82 -31.38 0.31 Allowed 'General case' 1 N--CA 1.547 4.422 0 C-N-CA 125.303 1.441 . . . . 0.0 113.513 -178.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 11.4 mmm180 -75.75 -51.01 13.61 Favored 'General case' 0 N--CA 1.527 3.398 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 80.67 93.47 0.44 Allowed Glycine 1 N--CA 1.516 4.02 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 177.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -161.54 -53.34 0.05 OUTLIER 'General case' 0 N--CA 1.529 3.508 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.129 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 48.1 mtt -153.31 77.8 1.14 Allowed 'General case' 0 N--CA 1.522 3.151 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 95.1 p -136.34 4.59 2.92 Favored 'General case' 0 N--CA 1.519 2.979 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -175.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -110.99 -69.69 0.85 Allowed 'General case' 0 N--CA 1.529 3.491 0 CA-C-N 120.153 1.342 . . . . 0.0 111.592 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.98 -45.4 6.94 Favored 'General case' 0 N--CA 1.53 3.559 0 CA-C-N 118.538 0.608 . . . . 0.0 111.806 -176.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -80.05 -5.13 55.28 Favored 'General case' 0 N--CA 1.522 3.172 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 -177.056 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 571' ' ' LEU . . . . . 0.815 HD23 HD11 ' B' ' 582' ' ' ILE . 27.9 tp -83.42 -48.49 10.3 Favored 'General case' 0 N--CA 1.531 3.594 0 CA-C-N 120.165 1.348 . . . . 0.0 112.555 -177.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -47.06 -30.61 2.81 Favored 'General case' 1 N--CA 1.552 4.628 0 CA-C-N 119.855 1.207 . . . . 0.0 113.82 -178.682 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -68.84 -38.08 79.56 Favored 'General case' 0 N--CA 1.537 3.92 0 CA-C-N 118.724 0.693 . . . . 0.0 110.881 -178.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -49.96 -61.25 2.25 Favored 'General case' 0 N--CA 1.53 3.549 0 C-N-CA 124.769 1.228 . . . . 0.0 113.0 -179.343 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.0 -36.56 3.25 Favored 'General case' 0 N--CA 1.534 3.747 0 CA-C-O 118.511 -0.756 . . . . 0.0 111.905 -178.626 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 115.25 57.71 0.35 Allowed Glycine 1 N--CA 1.525 4.57 0 CA-C-N 119.144 0.883 . . . . 0.0 111.039 179.577 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -114.54 103.16 10.75 Favored 'General case' 0 N--CA 1.52 3.069 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 177.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -39.0 164.28 0.01 OUTLIER Glycine 1 N--CA 1.544 5.834 0 C-N-CA 125.441 1.496 . . . . 0.0 115.311 -176.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 579' ' ' ILE . . . . . 0.659 HG21 ' N6 ' ' E' ' 4' ' ' ' DA' 0.262 10.9 mt -81.89 -12.24 12.4 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.333 0 CA-C-N 118.888 1.344 . . . . 0.0 109.341 178.383 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 580' ' ' ALA . . . . . 0.675 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -70.05 -41.64 73.94 Favored 'General case' 0 N--CA 1.531 3.577 0 CA-C-N 120.363 1.438 . . . . 0.0 109.285 175.444 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -77.4 -37.71 51.37 Favored 'General case' 1 N--CA 1.54 4.03 0 CA-C-N 118.909 0.777 . . . . 0.0 111.877 179.144 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 582' ' ' ILE . . . . . 0.815 HD11 HD23 ' B' ' 571' ' ' LEU . 1.0 OUTLIER -66.57 -40.04 85.35 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.375 0 C-N-CA 123.421 0.688 . . . . 0.0 111.722 -176.101 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 583' ' ' THR . . . . . 0.537 HG23 ' CG2' ' B' ' 582' ' ' ILE . 44.2 p -99.89 -18.36 17.15 Favored 'General case' 0 N--CA 1.506 2.368 0 CA-C-O 117.744 -1.122 . . . . 0.0 112.057 -178.199 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -81.64 -20.95 38.58 Favored 'General case' 0 N--CA 1.528 3.475 0 CA-C-N 120.265 1.393 . . . . 0.0 107.909 173.22 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -66.33 -35.49 90.32 Favored Glycine 1 N--CA 1.518 4.116 0 N-CA-C 108.785 -1.726 . . . . 0.0 108.785 176.084 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 88.8 p -66.55 -32.6 74.04 Favored 'General case' 0 N--CA 1.534 3.769 0 CA-C-N 117.803 0.802 . . . . 0.0 111.188 177.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -64.14 -31.32 72.47 Favored 'General case' 0 N--CA 1.53 3.544 0 C-N-CA 123.566 0.747 . . . . 0.0 110.778 178.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 52.9 m -62.95 -41.07 99.39 Favored 'General case' 1 N--CA 1.54 4.047 0 C-N-CA 123.5 0.72 . . . . 0.0 110.77 178.81 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 57.2 mt -52.78 -48.49 66.79 Favored 'General case' 0 N--CA 1.531 3.578 0 C-N-CA 124.46 1.104 . . . . 0.0 111.956 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -61.03 -29.81 69.94 Favored 'General case' 1 N--CA 1.54 4.049 0 CA-C-O 118.691 -0.671 . . . . 0.0 112.349 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -71.39 -41.61 69.43 Favored 'General case' 0 N--CA 1.52 3.03 0 CA-C-N 118.391 0.541 . . . . 0.0 110.806 179.399 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -57.72 162.52 4.91 Favored Pre-proline 1 N--CA 1.542 4.15 0 CA-C-O 118.194 -0.908 . . . . 0.0 112.132 179.228 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -78.97 -177.98 4.31 Favored 'Trans proline' 0 C--N 1.379 2.134 0 C-N-CA 121.439 1.426 . . . . 0.0 110.514 178.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.1 t -99.36 -29.2 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.098 0 CA-C-O 117.757 -1.116 . . . . 0.0 111.286 -179.133 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -63.4 -41.32 98.75 Favored 'General case' 0 N--CA 1.517 2.882 0 CA-C-N 119.761 1.164 . . . . 0.0 110.535 -178.352 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 596' ' ' LEU . . . . . 0.51 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.7 mp -99.52 -15.88 18.5 Favored 'General case' 0 N--CA 1.511 2.582 0 C-N-CA 123.331 0.653 . . . . 0.0 111.762 179.099 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 597' ' ' ARG . . . . . 0.408 ' HA ' HD13 ' B' ' 600' ' ' LEU . 0.1 OUTLIER -67.48 -29.68 69.19 Favored 'General case' 0 N--CA 1.531 3.617 0 N-CA-C 103.119 -2.919 . . . . 0.0 103.119 167.851 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -56.36 -36.91 69.33 Favored 'General case' 0 N--CA 1.521 3.094 0 C-N-CA 124.302 1.041 . . . . 0.0 110.388 173.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 599' ' ' TRP . . . . . 0.65 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 50.4 t90 -63.59 -35.61 81.07 Favored 'General case' 0 N--CA 1.53 3.558 0 CA-C-O 117.657 -1.164 . . . . 0.0 108.112 178.288 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 600' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' B' ' 597' ' ' ARG . 6.2 mp -54.93 -37.03 65.9 Favored 'General case' 1 N--CA 1.544 4.245 0 CA-C-N 119.37 0.986 . . . . 0.0 108.429 176.501 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -70.81 -34.18 71.47 Favored 'General case' 0 N--CA 1.532 3.634 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 176.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 602' ' ' GLU . . . . . 0.406 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.5 OUTLIER -62.2 -24.4 67.2 Favored 'General case' 1 N--CA 1.546 4.363 0 C-N-CA 123.491 0.716 . . . . 0.0 109.88 174.868 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' B' B ' 603' ' ' VAL . . . . . 0.564 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.5 OUTLIER -121.46 13.73 6.06 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.448 0 C-N-CA 123.851 0.861 . . . . 0.0 111.888 -177.565 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 45.0 mt -126.6 -61.95 1.16 Allowed 'General case' 0 N--CA 1.528 3.426 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 176.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.29 -48.67 68.15 Favored 'General case' 0 N--CA 1.539 3.989 0 C-N-CA 124.573 1.149 . . . . 0.0 111.295 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 42.4 mtpt 70.85 96.45 0.07 Allowed 'General case' 0 N--CA 1.531 3.6 0 C-N-CA 124.768 1.227 . . . . 0.0 109.479 -179.422 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 75.6 m . . . . . 0 N--CA 1.522 3.129 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.961 -179.46 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.128 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 998' ' ' TRP . . . . . 0.685 ' HB2' HG23 ' A' ' 44' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.193 0 CA-C-O 118.523 -0.751 . . . . 0.0 109.283 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.413 -10.547 4 O4'-C1'-N19 120.014 15.267 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.275 4 O4'-C1'-N19 119.178 14.223 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.943 4 O4'-C1'-N19 119.397 14.496 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . 0.568 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 6 C3'--C2' 1.416 -10.225 3 O4'-C1'-N19 120.242 15.553 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' E' E ' 5' ' ' ' DC' . . . . . 0.568 ' H41' ' HA ' ' B' ' 580' ' ' ALA . . . . . . . . 6 O3'--C3' 1.576 11.172 3 C4'-C3'-C2' 116.52 13.32 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.405 -11.335 4 O4'-C1'-N19 118.556 13.445 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' E' E ' 7' ' ' ' DA' . . . . . 0.714 H2'' " H5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.389 -12.904 4 C4'-C3'-C2' 111.952 8.752 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' E' E ' 8' ' ' ' DG' . . . . . 0.714 " H5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 O3'--C3' 1.563 10.176 4 O4'-C1'-N19 119.827 15.033 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.574 11.029 4 O4'-C1'-N19 118.632 13.541 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.414 -10.403 3 O4'-C1'-N19 119.483 14.604 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.409 -10.938 5 O4'-C1'-N19 119.599 14.749 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.407 -11.081 2 O4'-C1'-N19 120.06 15.325 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.411 -10.696 4 O4'-C1'-N19 119.276 14.345 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' E' E ' 14' ' ' ' DT' . . . . . 0.733 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 7 C3'--C2' 1.413 -10.497 3 C4'-C3'-C2' 117.125 13.925 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' E' E ' 15' ' ' ' DA' . . . . . 0.91 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.418 -10.002 6 O4'-C1'-N19 119.523 14.653 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.418 -10.008 6 O4'-C1'-N19 119.683 14.854 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.573 10.946 4 O4'-C1'-N19 119.53 14.663 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.407 -11.105 5 O4'-C1'-N19 120.257 15.572 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.107 2 O4'-C1'-N19 120.019 15.274 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.507 6.686 5 O4'-C1'-N19 118.922 13.902 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.564 10.223 3 C4'-C3'-C2' 116.992 13.792 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.411 -10.747 3 O4'-C1'-N19 119.76 14.95 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.407 -11.082 5 O4'-C1'-N19 120.312 15.64 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' F' F ' 4' ' ' ' DA' . . . . . 0.673 ' H62' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.416 -10.164 2 O4'-C1'-N19 119.184 14.23 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' F' F ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.134 5 C4'-C3'-C2' 116.028 12.828 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -11.001 4 O4'-C1'-N19 118.357 13.196 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.402 -12.608 4 N19-C1'-C2' 129.924 9.827 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.416 -10.232 5 O4'-C1'-N19 119.348 14.435 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.566 10.358 3 O4'-C1'-N19 118.846 13.807 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.616 4 O4'-C1'-N19 118.575 13.469 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.414 -10.401 4 O4'-C1'-N19 121.153 16.691 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -11.013 5 O4'-C1'-N19 120.102 15.378 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.409 -10.891 3 O4'-C1'-N19 119.806 15.008 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' F' F ' 14' ' ' ' DT' . . . . . 0.915 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.417 -10.138 5 O4'-C1'-N19 118.62 13.524 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' F' F ' 15' ' ' ' DA' . . . . . 0.968 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.43 -8.788 4 O4'-C1'-N19 119.401 14.501 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear build full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.416 -10.16 4 O4'-C1'-N19 119.772 14.965 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.362 5 O4'-C1'-N19 119.098 14.122 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -10.027 3 O4'-C1'-N19 120.096 15.37 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.423 -9.505 3 O4'-C1'-N19 120.407 15.759 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 O4'--C1' 1.51 6.947 4 O4'-C1'-N19 118.791 13.739 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 . . . . . 0 N--CA 1.499 2.002 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 55.6 m -135.13 138.2 28.67 Favored Pre-proline 0 N--CA 1.521 3.124 0 CA-C-O 117.785 -1.102 . . . . 0.0 110.34 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -69.1 -52.53 0.37 Allowed 'Trans proline' 0 C--N 1.387 2.575 0 C-N-CA 122.809 2.339 . . . . 0.0 112.907 -178.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -92.18 -33.43 14.71 Favored 'General case' 0 N--CA 1.532 3.643 0 CA-C-O 118.281 -0.866 . . . . 0.0 112.369 -177.34 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 21.3 m -66.23 -34.73 78.67 Favored 'General case' 1 N--CA 1.539 4.024 0 CA-C-N 119.172 0.897 . . . . 0.0 112.242 -177.804 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -143.56 128.77 18.76 Favored 'General case' 0 N--CA 1.52 3.056 0 CA-C-N 118.609 0.641 . . . . 0.0 110.782 -179.538 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -130.67 -53.5 1.07 Allowed 'General case' 0 N--CA 1.52 3.06 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 179.36 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 19.3 ptm -155.28 125.22 6.58 Favored 'General case' 0 N--CA 1.526 3.347 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 178.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.98 144.1 48.98 Favored 'General case' 0 N--CA 1.534 3.74 0 C-N-CA 122.705 0.402 . . . . 0.0 111.892 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -121.0 117.58 27.65 Favored 'General case' 0 N--CA 1.52 3.067 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.486 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -161.98 124.87 2.99 Favored 'General case' 0 N--CA 1.533 3.713 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -179.807 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.0 ttt180 -153.82 144.84 22.78 Favored 'General case' 0 N--CA 1.524 3.243 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -177.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 38.8 m-70 -119.26 129.4 54.9 Favored 'General case' 0 N--CA 1.521 3.12 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 178.247 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -83.07 100.74 10.69 Favored 'General case' 0 N--CA 1.526 3.334 0 CA-C-O 121.295 0.569 . . . . 0.0 111.683 -177.587 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -148.54 -67.36 0.23 Allowed 'General case' 0 N--CA 1.534 3.737 0 N-CA-C 105.777 -1.935 . . . . 0.0 105.777 177.657 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.423 ' CE3' HD23 ' B' ' 551' ' ' LEU . 59.1 t-105 -51.03 -37.18 43.7 Favored 'General case' 1 N--CA 1.543 4.192 0 C-N-CA 124.253 1.021 . . . . 0.0 109.182 174.125 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.507 ' N ' HD22 ' A' ' 20' ' ' LEU . 2.9 mm? -90.34 -25.95 20.2 Favored 'General case' 0 N--CA 1.526 3.345 0 CA-C-O 117.852 -1.07 . . . . 0.0 111.089 -178.79 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.2 mtt-85 -53.69 -28.34 33.16 Favored 'General case' 1 N--CA 1.539 4.002 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 173.223 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.614 ' HB2' HG21 ' B' ' 555' ' ' VAL . 47.7 t80 -87.11 -39.04 15.92 Favored 'General case' 0 N--CA 1.501 2.125 0 CA-C-O 115.907 -1.997 . . . . 0.0 109.276 172.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 91.1 t -66.15 -58.26 7.36 Favored 'Isoleucine or valine' 1 N--CA 1.577 5.905 0 CA-C-N 122.462 2.392 . . . . 0.0 112.704 -177.182 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -55.7 -45.84 77.79 Favored 'General case' 1 N--CA 1.548 4.451 0 CA-C-N 119.957 1.253 . . . . 0.0 110.914 -177.739 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.7 mp -71.71 -24.34 61.79 Favored 'General case' 0 N--CA 1.531 3.603 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.23 177.399 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.501 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -66.85 -33.5 75.75 Favored 'General case' 0 N--CA 1.519 3.016 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 176.172 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -65.33 -26.91 68.25 Favored 'General case' 0 N--CA 1.518 2.956 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.679 177.259 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -69.7 -39.71 76.74 Favored 'General case' 0 N--CA 1.53 3.54 0 CA-C-N 119.167 0.894 . . . . 0.0 109.031 177.012 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.582 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -84.41 -8.9 58.83 Favored 'General case' 0 N--CA 1.504 2.232 0 CA-C-O 118.489 -0.767 . . . . 0.0 110.633 177.485 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -80.63 -32.79 36.17 Favored 'General case' 0 N--CA 1.529 3.522 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 176.293 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -56.02 -46.49 78.78 Favored 'General case' 0 N--CA 1.533 3.679 0 C-N-CA 124.2 1.0 . . . . 0.0 108.591 176.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -96.26 -83.48 0.37 Allowed 'General case' 0 N--CA 1.517 2.922 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 178.311 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p30 150.32 49.7 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.888 0 C-N-CA 127.875 2.47 . . . . 0.0 108.045 177.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.581 HD22 ' CD2' ' B' ' 596' ' ' LEU . 11.5 mt -103.16 9.49 38.28 Favored 'General case' 0 N--CA 1.526 3.326 0 C-N-CA 124.099 0.96 . . . . 0.0 111.156 -178.586 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.483 ' HA ' ' HB2' ' A' ' 38' ' ' LEU . 48.5 p-80 -81.17 3.86 22.18 Favored 'General case' 0 N--CA 1.513 2.711 0 C-N-CA 123.224 0.61 . . . . 0.0 109.558 174.547 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.513 HD23 HD12 ' A' ' 39' ' ' LEU . 17.7 mt -95.84 -49.94 0.24 Allowed Pre-proline 0 N--CA 1.512 2.649 0 C-N-CA 125.374 1.47 . . . . 0.0 109.373 -175.327 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.433 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 7.0 Cg_exo -62.87 -37.97 51.14 Favored 'Trans proline' 0 N--CA 1.513 2.638 0 N-CA-C 105.703 -2.46 . . . . 0.0 105.703 169.682 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.483 ' HB2' ' HA ' ' A' ' 35' ' ' HIS . 0.9 OUTLIER -54.44 -44.36 72.41 Favored 'General case' 0 N--CA 1.536 3.874 0 C-N-CA 124.442 1.097 . . . . 0.0 109.38 174.151 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.739 HD11 ' CE2' ' B' ' 519' ' ' TRP . 0.4 OUTLIER -54.79 -52.77 61.61 Favored 'General case' 1 N--CA 1.561 5.087 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.626 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -58.48 -17.1 18.38 Favored 'General case' 1 N--CA 1.543 4.194 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -179.233 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.639 HD22 ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -107.27 -35.23 6.87 Favored 'General case' 0 N--CA 1.529 3.496 0 CA-C-O 117.738 -1.125 . . . . 0.0 112.971 -176.611 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.423 ' N ' HD13 ' A' ' 41' ' ' LEU . 18.0 ptp -125.48 21.87 7.77 Favored 'General case' 1 N--CA 1.549 4.485 0 CA-C-N 120.505 1.502 . . . . 0.0 112.641 -177.958 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -137.76 -68.75 0.46 Allowed 'General case' 0 N--CA 1.515 2.804 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.295 177.174 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.4 p 122.82 157.25 0.0 OUTLIER Pre-proline 1 N--CA 1.568 5.439 0 C-N-CA 128.528 2.731 . . . . 0.0 109.534 -179.526 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -67.28 -30.49 37.14 Favored 'Trans proline' 0 C--N 1.393 2.875 0 C-N-CA 122.316 2.011 . . . . 0.0 109.429 175.393 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -68.35 -27.07 65.93 Favored 'General case' 0 N--CA 1.531 3.575 0 CA-C-O 118.208 -0.901 . . . . 0.0 109.55 176.456 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -70.65 -30.47 67.1 Favored 'General case' 0 N--CA 1.52 3.069 0 CA-C-O 117.588 -1.196 . . . . 0.0 109.935 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 -85.76 -18.0 34.25 Favored 'General case' 0 N--CA 1.537 3.88 0 CA-C-N 119.617 1.098 . . . . 0.0 108.394 174.165 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -75.86 -22.91 55.72 Favored 'General case' 0 N--CA 1.523 3.179 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 172.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.79 -35.24 15.81 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 117.729 -1.129 . . . . 0.0 109.252 179.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.481 ' O ' HG23 ' A' ' 55' ' ' VAL . 31.2 tp -74.16 -20.0 60.37 Favored 'General case' 0 N--CA 1.534 3.741 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 172.691 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.405 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -67.95 -70.51 1.12 Allowed Glycine 0 N--CA 1.496 2.687 0 C-N-CA 125.161 1.363 . . . . 0.0 110.627 177.593 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.6 m -73.54 -25.43 60.39 Favored 'General case' 0 N--CA 1.531 3.607 0 CA-C-O 117.759 -1.115 . . . . 0.0 112.46 -178.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -69.62 -51.4 35.37 Favored 'General case' 0 N--CA 1.536 3.866 0 CA-C-N 120.269 1.395 . . . . 0.0 107.914 177.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.551 HG22 ' HE2' ' B' ' 542' ' ' MET . 21.5 t -61.82 -20.22 23.08 Favored 'Isoleucine or valine' 1 N--CA 1.543 4.199 0 O-C-N 120.977 -1.077 . . . . 0.0 109.402 175.13 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.5 mmm180 -74.55 -44.08 52.76 Favored 'General case' 0 N--CA 1.522 3.147 0 CA-C-O 117.098 -1.429 . . . . 0.0 112.082 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.417 HD13 ' N ' ' A' ' 58' ' ' VAL . 0.0 OUTLIER -74.15 -23.87 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.507 0 CA-C-N 121.942 2.155 . . . . 0.0 111.161 -179.866 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.417 ' N ' HD13 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -88.36 -50.56 13.4 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.107 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 -178.153 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -62.26 -25.46 67.85 Favored 'General case' 0 N--CA 1.532 3.653 0 CA-C-O 118.818 -0.611 . . . . 0.0 109.976 178.296 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -95.05 -21.39 18.6 Favored 'General case' 0 N--CA 1.524 3.258 0 CA-C-O 117.828 -1.082 . . . . 0.0 111.113 178.553 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -78.08 -46.14 21.61 Favored 'General case' 0 N--CA 1.533 3.678 0 CA-C-N 120.011 1.278 . . . . 0.0 108.026 178.247 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 30.9 mt -51.84 -26.32 9.7 Favored 'General case' 0 N--CA 1.539 3.987 0 C-N-CA 124.546 1.139 . . . . 0.0 112.203 178.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -90.23 -52.08 5.12 Favored 'General case' 0 N--CA 1.521 3.075 0 N-CA-C 107.397 -1.335 . . . . 0.0 107.397 178.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.1 94.41 0.26 Allowed Glycine 0 N--CA 1.514 3.854 0 CA-C-O 119.442 -0.643 . . . . 0.0 112.424 177.337 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -160.23 -59.05 0.06 Allowed 'General case' 0 N--CA 1.529 3.504 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 177.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 59.0 mtt -140.19 74.1 1.45 Allowed 'General case' 0 N--CA 1.526 3.351 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 178.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 8.4 t -136.08 -14.59 1.79 Allowed 'General case' 0 N--CA 1.525 3.296 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -176.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -106.7 -56.49 2.18 Favored 'General case' 0 N--CA 1.529 3.492 0 CA-C-N 120.284 1.402 . . . . 0.0 112.122 -176.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 1.9 ttm180 -102.57 -54.03 2.75 Favored 'General case' 0 N--CA 1.53 3.535 0 C-N-CA 123.294 0.638 . . . . 0.0 111.469 -176.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.39 -8.54 56.29 Favored 'General case' 0 N--CA 1.518 2.947 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -176.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.56 HD23 HG21 ' A' ' 82' ' ' ILE . 37.0 tp -80.91 -51.33 8.68 Favored 'General case' 0 N--CA 1.528 3.45 0 CA-C-O 117.6 -1.19 . . . . 0.0 113.061 -178.017 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.06 -31.85 0.14 Allowed 'General case' 1 N--CA 1.552 4.669 0 N-CA-C 115.038 1.496 . . . . 0.0 115.038 -176.937 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -72.78 -44.24 61.81 Favored 'General case' 0 N--CA 1.536 3.847 0 CA-C-N 119.18 0.9 . . . . 0.0 110.048 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -53.26 -50.14 65.44 Favored 'General case' 0 N--CA 1.529 3.504 0 C-N-CA 124.631 1.172 . . . . 0.0 112.903 -179.255 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 56.7 mt -110.54 -51.33 2.88 Favored 'General case' 0 N--CA 1.526 3.365 0 C-N-CA 122.973 0.509 . . . . 0.0 111.646 -177.23 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 117.59 17.94 5.44 Favored Glycine 1 N--CA 1.527 4.724 0 CA-C-O 118.095 -1.392 . . . . 0.0 111.867 -178.089 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -89.21 112.74 23.84 Favored 'General case' 0 N--CA 1.512 2.643 0 CA-C-N 119.594 1.697 . . . . 0.0 106.508 178.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -42.67 173.95 0.01 OUTLIER Glycine 1 N--CA 1.535 5.299 0 C-N-CA 125.25 1.405 . . . . 0.0 115.253 -177.759 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.673 HG21 ' H62' ' F' ' 4' ' ' ' DA' . 3.8 mt -80.06 -17.29 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.707 0 CA-C-N 118.5 1.15 . . . . 0.0 107.984 177.552 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.91 ' HB2' ' H62' ' E' ' 15' ' ' ' DA' . . . -71.86 -6.63 43.12 Favored 'General case' 0 N--CA 1.521 3.121 0 CA-C-O 117.403 -1.284 . . . . 0.0 111.223 174.715 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.505 HG22 ' CZ2' ' A' ' 898' ' ' TRP . 0.8 OUTLIER -104.17 -44.28 5.02 Favored 'General case' 0 N--CA 1.53 3.539 0 CA-C-N 120.77 1.623 . . . . 0.0 110.26 177.292 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.56 HG21 HD23 ' A' ' 71' ' ' LEU . 0.1 OUTLIER -72.23 -38.71 62.92 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.652 0 CA-C-N 119.307 0.958 . . . . 0.0 111.202 -177.771 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 44.3 p -82.15 -25.65 34.17 Favored 'General case' 0 N--CA 1.521 3.104 0 CA-C-O 118.865 -0.588 . . . . 0.0 109.917 178.065 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.9 ttp180 -67.71 -35.54 78.97 Favored 'General case' 1 N--CA 1.54 4.044 0 N-CA-C 107.319 -1.363 . . . . 0.0 107.319 173.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -69.94 -26.24 74.59 Favored Glycine 1 N--CA 1.516 4.025 0 CA-C-O 118.094 -1.392 . . . . 0.0 111.916 178.214 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 89.7 p -66.14 -25.5 67.0 Favored 'General case' 1 N--CA 1.543 4.222 0 CA-C-N 119.537 1.669 . . . . 0.0 110.754 178.534 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -54.81 -25.28 27.3 Favored 'General case' 1 N--CA 1.545 4.287 0 C-N-CA 123.281 0.632 . . . . 0.0 110.752 176.732 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.9 m -49.88 -42.85 48.74 Favored 'General case' 1 N--CA 1.547 4.382 0 C-N-CA 124.837 1.255 . . . . 0.0 111.467 178.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 37.8 mt -65.02 -41.98 94.8 Favored 'General case' 0 N--CA 1.519 2.99 0 C-N-CA 123.324 0.65 . . . . 0.0 110.259 178.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.11 0.06 55.88 Favored 'General case' 0 N--CA 1.532 3.643 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -179.45 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -113.18 -64.0 1.37 Allowed 'General case' 0 N--CA 1.518 2.958 0 CA-C-N 120.047 1.294 . . . . 0.0 111.741 -179.206 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -49.73 159.31 0.74 Allowed Pre-proline 1 N--CA 1.548 4.461 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -178.528 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.407 ' O ' ' HB2' ' A' ' 97' ' ' ARG . 39.8 Cg_endo -78.01 -179.31 5.33 Favored 'Trans proline' 0 C--N 1.384 2.427 0 C-N-CA 121.735 1.623 . . . . 0.0 110.248 177.823 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.1 t -98.75 -27.15 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.117 0 CA-C-O 117.545 -1.217 . . . . 0.0 111.69 -178.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -61.9 -43.51 98.69 Favored 'General case' 0 N--CA 1.518 2.936 0 CA-C-N 120.189 1.359 . . . . 0.0 110.459 -178.342 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.423 ' CD2' HD22 ' B' ' 534' ' ' LEU . 6.9 mp -98.57 -16.07 19.26 Favored 'General case' 0 N--CA 1.509 2.52 0 CA-C-O 118.676 -0.678 . . . . 0.0 112.149 179.545 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -67.76 -29.65 68.91 Favored 'General case' 0 N--CA 1.538 3.948 0 N-CA-C 103.591 -2.744 . . . . 0.0 103.591 168.51 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -55.24 -39.1 69.34 Favored 'General case' 0 N--CA 1.518 2.971 0 C-N-CA 123.892 0.877 . . . . 0.0 110.259 174.02 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.632 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 54.9 t90 -66.22 -34.67 78.53 Favored 'General case' 0 N--CA 1.528 3.462 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 177.246 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.1 -35.29 59.46 Favored 'General case' 0 N--CA 1.537 3.916 0 CA-C-N 118.923 0.783 . . . . 0.0 108.905 175.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -71.76 -37.12 70.56 Favored 'General case' 1 N--CA 1.539 4.002 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 175.461 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.451 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 3.0 mt-10 -60.51 -22.27 63.38 Favored 'General case' 1 N--CA 1.544 4.251 0 C-N-CA 123.607 0.763 . . . . 0.0 110.636 175.047 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.517 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -118.05 6.46 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.514 0 CA-C-O 118.744 -0.646 . . . . 0.0 112.215 -177.017 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.2 mt -111.67 -62.05 1.61 Allowed 'General case' 0 N--CA 1.525 3.281 0 N-CA-C 105.793 -1.929 . . . . 0.0 105.793 175.201 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.0 tt -46.42 -48.69 18.72 Favored 'General case' 1 N--CA 1.54 4.049 0 C-N-CA 125.572 1.549 . . . . 0.0 112.287 -179.113 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -94.37 -58.45 2.21 Favored 'General case' 0 N--CA 1.524 3.241 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 89.7 p . . . . . 0 N--CA 1.534 3.764 0 C-N-CA 125.35 1.46 . . . . 0.0 112.724 179.956 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 . . . . . 0 N--CA 1.499 2.01 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 8.4 t -140.63 125.93 11.2 Favored Pre-proline 0 N--CA 1.521 3.095 0 CA-C-O 117.389 -1.291 . . . . 0.0 109.489 179.805 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -75.18 -47.3 0.2 Allowed 'Trans proline' 0 C--N 1.388 2.635 0 C-N-CA 122.58 2.187 . . . . 0.0 110.411 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -89.78 155.63 19.05 Favored 'General case' 0 N--CA 1.533 3.709 0 C-N-CA 122.969 0.507 . . . . 0.0 111.149 -178.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 62.5 m -80.5 133.82 35.88 Favored 'General case' 0 N--CA 1.525 3.306 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.984 -179.056 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -100.41 -41.08 7.16 Favored 'General case' 0 N--CA 1.523 3.225 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.075 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . 64.22 142.66 0.02 OUTLIER 'General case' 0 N--CA 1.534 3.763 0 C-N-CA 124.722 1.209 . . . . 0.0 112.487 178.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 5.4 tpt -82.9 -44.4 15.42 Favored 'General case' 0 N--CA 1.521 3.084 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.742 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -113.4 137.62 51.27 Favored 'General case' 0 N--CA 1.525 3.284 0 C-N-CA 123.582 0.753 . . . . 0.0 110.544 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -117.08 -42.27 2.94 Favored 'General case' 0 N--CA 1.527 3.378 0 C-N-CA 123.305 0.642 . . . . 0.0 110.589 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 76.87 -98.82 0.02 OUTLIER 'General case' 0 N--CA 1.533 3.715 0 CA-C-O 117.612 -1.185 . . . . 0.0 108.597 -178.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -144.55 -66.03 0.34 Allowed 'General case' 0 N--CA 1.531 3.579 0 CA-C-N 120.921 1.691 . . . . 0.0 109.518 179.338 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 9.3 m170 -157.17 160.45 38.77 Favored 'General case' 0 N--CA 1.53 3.54 0 CA-C-N 118.422 0.556 . . . . 0.0 111.953 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -108.71 126.17 52.71 Favored 'General case' 0 N--CA 1.52 3.07 0 C-N-CA 123.404 0.682 . . . . 0.0 109.607 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -104.02 -67.55 0.89 Allowed 'General case' 0 N--CA 1.521 3.091 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 519' ' ' TRP . . . . . 0.739 ' CE2' HD11 ' A' ' 39' ' ' LEU . 64.2 t-105 -42.43 -29.54 0.28 Allowed 'General case' 1 N--CA 1.549 4.482 0 C-N-CA 123.954 0.901 . . . . 0.0 113.335 179.166 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 520' ' ' LEU . . . . . 0.55 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.2 mm? -93.98 -31.64 14.18 Favored 'General case' 0 N--CA 1.524 3.274 0 CA-C-O 117.696 -1.145 . . . . 0.0 113.879 -172.197 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 54.3 mtt-85 -61.7 -25.76 67.62 Favored 'General case' 1 N--CA 1.546 4.361 0 N-CA-C 105.729 -1.952 . . . . 0.0 105.729 171.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 522' ' ' PHE . . . . . 0.53 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 2.0 m-85 -76.24 -43.24 42.97 Favored 'General case' 0 N--CA 1.511 2.602 0 CA-C-O 117.287 -1.34 . . . . 0.0 107.401 173.641 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 523' ' ' VAL . . . . . 0.451 HG23 ' O ' ' B' ' 519' ' ' TRP . 54.1 t -65.82 -17.29 21.95 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.24 0 CA-C-O 117.717 -1.135 . . . . 0.0 112.246 179.549 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -77.62 -52.59 8.77 Favored 'General case' 0 N--CA 1.527 3.419 0 CA-C-N 120.396 1.453 . . . . 0.0 107.885 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 525' ' ' LEU . . . . . 0.509 HD23 ' HB ' ' A' ' 103' ' ' VAL . 5.1 mp -75.35 -14.6 60.49 Favored 'General case' 0 N--CA 1.53 3.547 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 175.798 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.23 -35.92 68.97 Favored 'General case' 0 N--CA 1.521 3.102 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 174.153 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 30.7 ttmt -68.73 -21.96 64.36 Favored 'General case' 0 N--CA 1.512 2.644 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.633 176.183 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -67.55 -40.17 84.96 Favored 'General case' 0 N--CA 1.535 3.82 0 CA-C-N 119.365 0.984 . . . . 0.0 108.465 176.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 529' ' ' ALA . . . . . 0.632 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -90.22 -13.46 35.41 Favored 'General case' 0 N--CA 1.504 2.24 0 CA-C-O 117.968 -1.015 . . . . 0.0 111.637 178.71 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.29 -28.64 42.25 Favored 'General case' 0 N--CA 1.537 3.908 0 CA-C-N 120.787 1.63 . . . . 0.0 107.461 177.478 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -61.7 -47.77 83.81 Favored 'General case' 0 N--CA 1.527 3.415 0 C-N-CA 124.421 1.089 . . . . 0.0 108.425 176.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -91.4 -85.33 0.24 Allowed 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 177.256 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.8 p30 152.58 51.76 0.0 OUTLIER 'General case' 1 N--CA 1.555 4.825 0 C-N-CA 127.339 2.256 . . . . 0.0 108.263 176.456 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 534' ' ' LEU . . . . . 0.423 HD22 ' CD2' ' A' ' 96' ' ' LEU . 7.0 mt -109.89 12.16 23.95 Favored 'General case' 0 N--CA 1.519 2.997 0 C-N-CA 125.249 1.42 . . . . 0.0 109.924 -179.435 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 535' ' ' HIS . . . . . 0.493 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 24.6 p-80 -86.38 9.09 19.08 Favored 'General case' 0 N--CA 1.516 2.871 0 C-N-CA 124.146 0.979 . . . . 0.0 108.873 175.461 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 536' ' ' LEU . . . . . 0.526 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 20.3 mt -97.05 -52.04 0.22 Allowed Pre-proline 0 N--CA 1.502 2.173 0 CA-C-O 116.589 -1.672 . . . . 0.0 107.794 -176.314 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 537' ' ' PRO . . . . . 0.526 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 2.7 Cg_exo -65.8 -34.1 41.22 Favored 'Trans proline' 0 C--N 1.401 3.308 0 N-CA-C 106.693 -2.08 . . . . 0.0 106.693 170.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.47 -51.68 68.83 Favored 'General case' 0 N--CA 1.523 3.211 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 174.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 40.1 mt -77.45 -6.81 54.79 Favored 'General case' 0 N--CA 1.535 3.811 0 CA-C-O 118.441 -0.79 . . . . 0.0 112.599 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -75.36 -22.67 57.36 Favored 'General case' 0 N--CA 1.518 2.963 0 CA-C-O 117.601 -1.19 . . . . 0.0 111.576 179.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 541' ' ' LEU . . . . . 0.408 HD13 ' O ' ' B' ' 541' ' ' LEU . 0.2 OUTLIER -127.58 -27.47 2.86 Favored 'General case' 0 N--CA 1.524 3.256 0 CA-C-O 117.214 -1.374 . . . . 0.0 113.648 -179.839 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 542' ' ' MET . . . . . 0.551 ' HE2' HG22 ' A' ' 55' ' ' VAL . 2.2 ptp -79.77 9.68 4.92 Favored 'General case' 1 N--CA 1.543 4.221 0 CA-C-N 121.663 2.028 . . . . 0.0 110.583 177.42 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 1.6 tp -132.78 -89.36 0.42 Allowed 'General case' 0 N--CA 1.519 2.985 0 CA-C-N 120.183 1.356 . . . . 0.0 111.823 178.591 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 544' ' ' THR . . . . . 0.626 HG23 ' HB2' ' A' ' 898' ' ' TRP . 0.1 OUTLIER 162.56 175.45 0.04 OUTLIER Pre-proline 1 N--CA 1.578 5.967 0 C-N-CA 125.12 1.368 . . . . 0.0 109.971 -177.682 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -64.73 -21.45 64.93 Favored 'Trans proline' 0 N--CA 1.527 3.475 0 C-N-CA 122.25 1.967 . . . . 0.0 109.834 173.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -72.29 8.87 1.17 Allowed 'General case' 0 N--CA 1.517 2.908 0 C-N-CA 123.38 0.672 . . . . 0.0 110.728 175.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.6 -57.91 3.96 Favored 'General case' 0 N--CA 1.51 2.568 0 CA-C-O 117.493 -1.241 . . . . 0.0 108.326 178.474 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 -93.65 -5.98 47.42 Favored 'General case' 0 N--CA 1.527 3.422 0 CA-C-N 120.303 1.41 . . . . 0.0 111.507 175.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -74.35 -45.89 44.2 Favored 'General case' 0 N--CA 1.535 3.777 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 173.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -90.34 -23.33 21.16 Favored 'General case' 0 N--CA 1.521 3.108 0 CA-C-O 117.652 -1.166 . . . . 0.0 112.363 179.239 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 551' ' ' LEU . . . . . 0.423 HD23 ' CE3' ' A' ' 19' ' ' TRP . 17.4 tp -80.86 -33.28 34.6 Favored 'General case' 1 N--CA 1.54 4.071 0 CA-C-N 120.657 1.571 . . . . 0.0 107.707 176.539 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -73.49 -52.76 8.11 Favored Glycine 0 N--CA 1.496 2.676 0 N-CA-C 109.905 -1.278 . . . . 0.0 109.905 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 1.8 m -71.97 -33.8 68.45 Favored 'General case' 0 N--CA 1.536 3.873 0 CA-C-N 118.415 1.108 . . . . 0.0 112.574 -177.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -67.23 -52.64 38.54 Favored 'General case' 1 N--CA 1.54 4.052 0 N-CA-C 106.916 -1.512 . . . . 0.0 106.916 176.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 555' ' ' VAL . . . . . 0.614 HG21 ' HB2' ' A' ' 22' ' ' PHE . 42.8 t -61.25 -18.43 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.66 0 CA-C-O 117.938 -1.03 . . . . 0.0 110.485 177.406 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 -79.25 -42.21 26.41 Favored 'General case' 0 N--CA 1.525 3.291 0 CA-C-O 116.869 -1.539 . . . . 0.0 111.152 177.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 557' ' ' ILE . . . . . 0.537 ' HB ' HG22 ' B' ' 582' ' ' ILE . 0.0 OUTLIER -71.83 -22.04 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.946 0 CA-C-N 122.178 2.263 . . . . 0.0 110.742 179.911 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 558' ' ' VAL . . . . . 0.542 ' CG1' HD21 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -87.14 -52.1 12.06 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.746 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 -178.784 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -67.1 -17.0 64.68 Favored 'General case' 0 N--CA 1.523 3.188 0 CA-C-O 118.599 -0.715 . . . . 0.0 110.975 178.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -96.97 -23.9 16.07 Favored 'General case' 0 N--CA 1.528 3.445 0 CA-C-O 118.277 -0.868 . . . . 0.0 109.946 176.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 21.2 tp -78.47 -56.66 4.27 Favored 'General case' 0 N--CA 1.534 3.742 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 178.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 6.7 tp -45.18 -30.11 1.1 Allowed 'General case' 0 N--CA 1.537 3.914 0 C-N-CA 125.196 1.398 . . . . 0.0 112.82 -179.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.14 -50.22 7.59 Favored 'General case' 0 N--CA 1.527 3.392 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 177.341 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 77.7 94.55 0.24 Allowed Glycine 0 N--CA 1.514 3.862 0 CA-C-O 119.616 -0.547 . . . . 0.0 113.51 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -165.86 -57.95 0.03 OUTLIER 'General case' 0 N--CA 1.531 3.608 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 177.179 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 47.4 mtt -131.18 69.9 1.47 Allowed 'General case' 0 N--CA 1.519 3.0 0 N-CA-C 106.564 -1.643 . . . . 0.0 106.564 178.623 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 567' ' ' SER . . . . . 0.43 ' HA ' HD22 ' B' ' 571' ' ' LEU . 6.1 t -126.25 -8.52 6.44 Favored 'General case' 0 N--CA 1.523 3.209 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -177.071 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -113.47 -70.67 0.79 Allowed 'General case' 0 N--CA 1.526 3.366 0 CA-C-N 120.042 1.292 . . . . 0.0 111.843 -178.135 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 24.0 mtt180 -91.43 -52.37 4.82 Favored 'General case' 0 N--CA 1.53 3.532 0 CA-C-N 118.853 0.751 . . . . 0.0 110.38 -178.207 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -68.68 -12.16 61.05 Favored 'General case' 0 N--CA 1.519 3.0 0 CA-C-O 118.183 -0.913 . . . . 0.0 112.613 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 571' ' ' LEU . . . . . 0.598 HD23 HG21 ' B' ' 582' ' ' ILE . 24.2 tp -80.72 -54.72 5.38 Favored 'General case' 0 N--CA 1.517 2.912 0 CA-C-N 119.554 1.07 . . . . 0.0 109.798 179.586 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -45.88 -32.35 2.6 Favored 'General case' 1 N--CA 1.545 4.281 0 CA-C-N 119.229 0.922 . . . . 0.0 112.507 -179.716 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -72.65 -42.12 64.72 Favored 'General case' 0 N--CA 1.534 3.757 0 C-N-CA 122.988 0.515 . . . . 0.0 110.61 -179.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -43.97 -56.57 3.86 Favored 'General case' 1 N--CA 1.539 4.002 0 C-N-CA 125.137 1.375 . . . . 0.0 113.568 -179.165 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -137.43 -41.74 0.56 Allowed 'General case' 0 N--CA 1.528 3.447 0 CA-C-O 118.814 -0.612 . . . . 0.0 111.579 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 125.66 98.78 1.15 Allowed Glycine 1 N--CA 1.517 4.047 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -126.72 -47.34 1.54 Allowed 'General case' 0 N--CA 1.525 3.311 0 C-N-CA 123.529 0.732 . . . . 0.0 109.44 178.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 108.14 161.05 20.65 Favored Glycine 1 N--CA 1.519 4.22 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -178.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 579' ' ' ILE . . . . . 0.568 HG21 ' N6 ' ' E' ' 4' ' ' ' DA' . 0.9 OUTLIER -84.01 -18.0 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.861 0 CA-C-N 119.219 1.51 . . . . 0.0 108.062 177.93 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 580' ' ' ALA . . . . . 0.968 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -71.01 -38.33 72.63 Favored 'General case' 0 N--CA 1.522 3.149 0 CA-C-N 119.843 1.201 . . . . 0.0 110.301 177.318 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 4.2 p -78.07 -46.86 19.7 Favored 'General case' 0 N--CA 1.536 3.855 0 CA-C-N 119.689 1.131 . . . . 0.0 111.659 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 582' ' ' ILE . . . . . 0.598 HG21 HD23 ' B' ' 571' ' ' LEU . 1.4 pt -68.49 -22.36 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.932 0 CA-C-O 117.854 -1.07 . . . . 0.0 113.289 -177.319 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 31.0 p -108.74 -21.55 12.63 Favored 'General case' 0 N--CA 1.521 3.095 0 CA-C-N 119.728 1.149 . . . . 0.0 111.95 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 11.3 ptt180 -82.75 -21.55 34.65 Favored 'General case' 0 N--CA 1.531 3.592 0 CA-C-N 119.98 1.264 . . . . 0.0 107.875 173.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -67.66 -31.87 77.09 Favored Glycine 0 N--CA 1.514 3.853 0 N-CA-C 109.703 -1.359 . . . . 0.0 109.703 176.181 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 88.2 p -65.92 -34.83 79.01 Favored 'General case' 1 N--CA 1.54 4.044 0 CA-C-N 118.537 1.168 . . . . 0.0 110.053 177.408 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -58.06 -29.04 65.08 Favored 'General case' 1 N--CA 1.539 4.01 0 C-N-CA 123.888 0.875 . . . . 0.0 111.306 178.773 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.31 -35.43 80.99 Favored 'General case' 0 N--CA 1.537 3.917 0 C-N-CA 123.26 0.624 . . . . 0.0 110.507 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 23.6 mt -73.14 -45.76 54.86 Favored 'General case' 0 N--CA 1.518 2.954 0 C-N-CA 123.651 0.78 . . . . 0.0 110.699 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.46 -30.71 31.19 Favored 'General case' 1 N--CA 1.552 4.631 0 C-N-CA 123.672 0.789 . . . . 0.0 112.351 -179.608 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -96.61 -35.22 11.13 Favored 'General case' 0 N--CA 1.519 3.013 0 C-N-CA 123.301 0.64 . . . . 0.0 111.259 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 592' ' ' ALA . . . . . 0.403 ' HB1' ' HD2' ' B' ' 593' ' ' PRO . . . -51.72 164.32 0.55 Allowed Pre-proline 1 N--CA 1.543 4.191 0 CA-C-O 118.197 -0.906 . . . . 0.0 112.941 -179.818 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 593' ' ' PRO . . . . . 0.403 ' HD2' ' HB1' ' B' ' 592' ' ' ALA . 38.4 Cg_endo -76.09 147.64 30.27 Favored 'Trans proline' 0 C--N 1.38 2.212 0 C-N-CA 121.873 1.715 . . . . 0.0 110.028 178.349 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.7 t -84.6 -26.24 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.745 0 CA-C-O 117.442 -1.266 . . . . 0.0 112.016 -178.117 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -65.17 -35.6 81.6 Favored 'General case' 0 N--CA 1.518 2.925 0 CA-C-N 120.282 1.401 . . . . 0.0 110.596 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 596' ' ' LEU . . . . . 0.581 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.8 mp -97.75 -21.23 17.09 Favored 'General case' 0 N--CA 1.517 2.879 0 C-N-CA 123.929 0.892 . . . . 0.0 110.423 178.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.51 -35.36 77.49 Favored 'General case' 1 N--CA 1.55 4.527 0 N-CA-C 103.764 -2.68 . . . . 0.0 103.764 168.503 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -57.36 -40.46 78.13 Favored 'General case' 0 N--CA 1.52 3.046 0 C-N-CA 125.358 1.463 . . . . 0.0 111.278 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 599' ' ' TRP . . . . . 0.582 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 57.5 t90 -57.97 -34.44 69.94 Favored 'General case' 1 N--CA 1.54 4.064 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 179.387 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 54.1 mt -53.68 -42.38 67.88 Favored 'General case' 0 N--CA 1.538 3.962 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 176.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -68.07 -33.76 75.16 Favored 'General case' 0 N--CA 1.53 3.545 0 O-C-N 123.802 0.689 . . . . 0.0 109.42 176.703 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 602' ' ' GLU . . . . . 0.418 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.6 OUTLIER -61.29 -25.02 66.83 Favored 'General case' 1 N--CA 1.542 4.149 0 C-N-CA 123.362 0.665 . . . . 0.0 110.148 175.27 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' B' B ' 603' ' ' VAL . . . . . 0.546 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.2 OUTLIER -120.59 7.61 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.463 0 C-N-CA 123.747 0.819 . . . . 0.0 112.772 -177.003 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.73 -57.06 1.92 Allowed 'General case' 0 N--CA 1.512 2.643 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 178.075 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.7 -65.33 0.65 Allowed 'General case' 0 N--CA 1.533 3.677 0 C-N-CA 124.869 1.268 . . . . 0.0 113.51 -177.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -96.16 -32.14 12.63 Favored 'General case' 0 N--CA 1.534 3.753 0 CA-C-O 118.678 -0.677 . . . . 0.0 112.11 -177.028 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 14.7 m . . . . . 1 N--CA 1.542 4.165 0 CA-C-N 119.106 0.866 . . . . 0.0 110.617 -179.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 898' ' ' TRP . . . . . 0.626 ' HB2' HG23 ' B' ' 544' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.133 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.102 0 CA-C-O 117.841 -1.076 . . . . 0.0 109.604 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.419 -9.949 3 O4'-C1'-N19 118.788 13.735 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.594 4 O4'-C1'-N19 119.81 15.012 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.423 -9.505 3 O4'-C1'-N19 119.632 14.791 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . 0.488 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 6 C3'--C2' 1.412 -10.587 5 O4'-C1'-N19 119.375 14.468 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' E' E ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.578 11.272 4 O4'-C1'-N19 118.648 13.56 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.408 -11.024 4 C4'-C3'-C2' 116.282 13.082 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' E' E ' 7' ' ' ' DA' . . . . . 0.69 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.391 -12.723 4 C4'-C3'-C2' 112.204 9.004 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' E' E ' 8' ' ' ' DG' . . . . . 0.69 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.413 -10.505 3 O4'-C1'-N19 120.458 15.823 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.573 10.925 5 O4'-C1'-N19 118.927 13.909 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.403 -11.464 5 O4'-C1'-N19 119.383 14.478 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.569 10.585 3 O4'-C1'-N19 121.876 17.595 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.678 6 O4'-C1'-N19 118.961 13.951 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 4 O3'--C3' 1.551 9.257 4 O4'-C1'-N19 119.604 14.755 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' E' E ' 14' ' ' ' DT' . . . . . 0.815 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.413 -10.517 6 O4'-C1'-N19 118.897 13.871 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' E' E ' 15' ' ' ' DA' . . . . . 0.893 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.429 -8.938 4 O4'-C1'-N19 119.354 14.442 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.415 -10.276 4 O4'-C1'-N19 120.445 15.806 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.572 10.838 4 O4'-C1'-N19 119.269 14.336 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.565 4 O4'-C1'-N19 119.949 15.186 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.427 -9.081 3 O4'-C1'-N19 119.261 14.326 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.51 6.939 4 O4'-C1'-N19 119.904 15.13 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.564 10.215 2 O4'-C1'-N19 118.641 13.551 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.412 -10.576 3 O4'-C1'-N19 119.025 14.031 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.408 -11.033 5 O4'-C1'-N19 120.531 15.913 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' F' F ' 4' ' ' ' DA' . . . . . 0.491 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.418 -9.964 3 O4'-C1'-N19 120.488 15.86 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' F' F ' 5' ' ' ' DC' . . . . . 0.544 ' H41' ' HA ' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.407 -11.052 5 O4'-C1'-N19 119.642 14.802 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.708 3 O4'-C1'-N19 119.731 14.914 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' F' F ' 7' ' ' ' DA' . . . . . 0.806 H2'' H5'' ' F' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.398 -12.019 5 N19-C1'-C2' 131.947 11.092 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' F' F ' 8' ' ' ' DG' . . . . . 0.806 H5'' H2'' ' F' ' 7' ' ' ' DA' . . . . . . . . 5 C3'--C2' 1.41 -10.784 4 O4'-C1'-N19 119.244 14.305 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' F' F ' 9' ' ' ' DT' . . . . . 0.504 " H4'" ' OP1' ' F' ' 10' ' ' ' DT' . . . . . . . . 6 O3'--C3' 1.572 10.823 4 O4'-C1'-N19 119.284 14.355 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' F' F ' 10' ' ' ' DT' . . . . . 0.504 ' OP1' " H4'" ' F' ' 9' ' ' ' DT' . . . . . . . . 6 O3'--C3' 1.568 10.56 3 O4'-C1'-N19 118.981 13.977 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.411 -10.658 5 O4'-C1'-N19 120.374 15.717 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.175 5 O4'-C1'-N19 118.879 13.849 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' F' F ' 13' ' ' ' DC' . . . . . 0.423 " H4'" ' OP1' ' F' ' 14' ' ' ' DT' . . . . . . . . 6 O3'--C3' 1.565 10.346 3 O4'-C1'-N19 120.251 15.564 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' F' F ' 14' ' ' ' DT' . . . . . 0.52 ' C7 ' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.408 -11.045 3 O4'-C1'-N19 118.773 13.717 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' F' F ' 15' ' ' ' DA' . . . . . 0.776 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.417 -10.079 5 O4'-C1'-N19 119.565 14.706 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.413 -10.493 5 O4'-C1'-N19 119.831 15.039 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.492 5 O4'-C1'-N19 119.44 14.551 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.288 5 O4'-C1'-N19 120.306 15.632 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.418 5 O4'-C1'-N19 120.033 15.291 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.512 7.041 4 O4'-C1'-N19 120.37 15.712 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 . . . . . 0 N--CA 1.514 2.772 0 N-CA-C 110.83 -0.063 . . . . 0.0 110.83 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 57.8 m -109.99 119.28 47.8 Favored Pre-proline 0 N--CA 1.518 2.96 0 CA-C-O 117.683 -1.151 . . . . 0.0 109.025 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -66.15 137.9 49.75 Favored 'Trans proline' 0 C--N 1.396 3.074 0 C-N-CA 122.717 2.278 . . . . 0.0 111.417 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -127.85 126.45 41.64 Favored 'General case' 0 N--CA 1.527 3.382 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 75.5 m -139.9 -51.02 0.5 Allowed 'General case' 0 N--CA 1.521 3.124 0 C-N-CA 122.692 0.397 . . . . 0.0 109.974 -179.572 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 70.88 115.38 0.05 OUTLIER 'General case' 0 N--CA 1.531 3.584 0 C-N-CA 124.208 1.003 . . . . 0.0 110.32 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -148.79 125.98 11.44 Favored 'General case' 0 N--CA 1.523 3.218 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 43.3 mtp 66.86 130.24 0.02 OUTLIER 'General case' 1 N--CA 1.541 4.124 0 C-N-CA 124.51 1.124 . . . . 0.0 110.033 -178.529 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.73 155.09 28.12 Favored 'General case' 0 N--CA 1.53 3.543 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.536 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -86.16 140.32 30.28 Favored 'General case' 0 N--CA 1.53 3.569 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 59.5 mm-40 -94.6 139.15 31.58 Favored 'General case' 0 N--CA 1.533 3.695 0 C-N-CA 122.881 0.473 . . . . 0.0 111.469 -178.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.7 mmt180 -110.15 -54.1 2.61 Favored 'General case' 0 N--CA 1.525 3.309 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 74.5 m80 -140.74 122.76 15.58 Favored 'General case' 0 N--CA 1.526 3.327 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.186 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -111.44 -94.0 0.44 Allowed 'General case' 0 N--CA 1.524 3.229 0 CA-C-O 117.971 -1.014 . . . . 0.0 111.066 -177.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -136.41 -72.89 0.44 Allowed 'General case' 0 N--CA 1.526 3.375 0 CA-C-N 120.271 1.396 . . . . 0.0 108.098 -179.167 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.683 ' CZ3' HD22 ' B' ' 551' ' ' LEU . 76.7 t-105 -51.35 -39.96 58.14 Favored 'General case' 1 N--CA 1.541 4.085 0 C-N-CA 123.034 0.534 . . . . 0.0 109.664 176.376 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.482 ' N ' HD22 ' A' ' 20' ' ' LEU . 2.6 mm? -81.5 -26.91 34.77 Favored 'General case' 0 N--CA 1.519 2.987 0 O-C-N 124.699 1.249 . . . . 0.0 111.633 -176.861 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.0 ttm180 -56.27 -29.17 60.75 Favored 'General case' 0 N--CA 1.539 3.982 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 173.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.561 ' CG ' HD21 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -86.03 -36.47 19.71 Favored 'General case' 0 N--CA 1.508 2.441 0 CA-C-O 116.218 -1.849 . . . . 0.0 108.784 173.6 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.5 t -68.73 -26.0 31.89 Favored 'Isoleucine or valine' 1 N--CA 1.571 5.606 0 CA-C-N 121.364 1.893 . . . . 0.0 112.645 -176.332 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -76.1 -50.32 15.0 Favored 'General case' 0 N--CA 1.534 3.737 0 CA-C-N 120.017 1.281 . . . . 0.0 107.588 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.7 mp -70.79 -16.46 62.74 Favored 'General case' 0 N--CA 1.527 3.386 0 O-C-N 123.428 0.455 . . . . 0.0 110.013 175.106 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -72.16 -36.7 69.37 Favored 'General case' 0 N--CA 1.519 2.997 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 175.762 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.451 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 22.1 tttt -66.02 -20.87 66.33 Favored 'General case' 0 N--CA 1.518 2.939 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.658 176.288 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -71.75 -40.97 68.99 Favored 'General case' 0 N--CA 1.529 3.485 0 CA-C-N 119.275 0.943 . . . . 0.0 108.722 176.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.604 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -87.89 -8.75 55.36 Favored 'General case' 0 N--CA 1.507 2.382 0 CA-C-O 118.566 -0.73 . . . . 0.0 110.699 177.69 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.451 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -83.02 -28.51 29.59 Favored 'General case' 0 N--CA 1.532 3.64 0 CA-C-N 120.017 1.28 . . . . 0.0 107.768 177.994 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -64.13 -45.59 87.88 Favored 'General case' 0 N--CA 1.525 3.298 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 176.332 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -93.31 -89.64 0.2 Allowed 'General case' 0 N--CA 1.513 2.677 0 N-CA-C 106.434 -1.691 . . . . 0.0 106.434 176.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 p30 156.36 51.27 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.918 0 C-N-CA 126.825 2.05 . . . . 0.0 107.877 177.447 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.574 HD22 ' CD2' ' B' ' 596' ' ' LEU . 8.8 mt -109.88 12.44 23.87 Favored 'General case' 0 N--CA 1.525 3.289 0 C-N-CA 124.388 1.075 . . . . 0.0 110.669 -178.501 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.52 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 39.2 p-80 -81.86 2.59 29.65 Favored 'General case' 0 N--CA 1.516 2.841 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 174.888 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.479 HD23 HD12 ' A' ' 39' ' ' LEU . 22.6 mt -95.84 -51.11 0.24 Allowed Pre-proline 0 N--CA 1.508 2.43 0 CA-C-O 117.212 -1.375 . . . . 0.0 109.638 -175.538 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.445 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 4.8 Cg_exo -65.82 -35.23 36.87 Favored 'Trans proline' 0 CA--C 1.574 2.485 0 N-CA-C 105.975 -2.356 . . . . 0.0 105.975 170.259 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.52 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 1.9 tm? -59.64 -38.34 81.14 Favored 'General case' 0 N--CA 1.521 3.109 0 C-N-CA 124.149 0.98 . . . . 0.0 108.946 175.597 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.698 HD21 ' CZ2' ' B' ' 519' ' ' TRP . 2.1 mt -59.95 -44.67 94.26 Favored 'General case' 1 N--CA 1.559 5.005 0 CA-C-N 119.236 0.926 . . . . 0.0 108.903 177.108 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -61.71 -17.75 56.95 Favored 'General case' 1 N--CA 1.542 4.148 0 CA-C-O 118.642 -0.694 . . . . 0.0 112.834 -179.833 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.496 HD11 HG11 ' B' ' 558' ' ' VAL . 0.7 OUTLIER -97.61 -50.52 4.46 Favored 'General case' 0 N--CA 1.525 3.289 0 CA-C-O 118.067 -0.968 . . . . 0.0 113.115 -177.335 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.415 ' N ' HD13 ' A' ' 41' ' ' LEU . 2.9 ptt? -115.36 18.68 15.95 Favored 'General case' 1 N--CA 1.556 4.851 0 CA-C-N 119.829 1.195 . . . . 0.0 113.792 -175.935 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.495 ' O ' HG23 ' A' ' 44' ' ' THR . 4.8 tp -130.44 -80.78 0.54 Allowed 'General case' 0 N--CA 1.52 3.071 0 CA-C-O 117.481 -1.247 . . . . 0.0 110.233 176.671 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.534 HG23 ' HB2' ' B' ' 998' ' ' TRP . 4.6 p 140.73 156.47 0.0 OUTLIER Pre-proline 1 N--CA 1.57 5.538 0 C-N-CA 127.178 2.191 . . . . 0.0 109.271 179.583 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -67.13 -37.84 17.54 Favored 'Trans proline' 0 N--CA 1.517 2.893 0 C-N-CA 123.167 2.578 . . . . 0.0 110.627 177.525 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -64.02 -21.98 66.73 Favored 'General case' 0 N--CA 1.532 3.651 0 CA-C-O 118.666 -0.683 . . . . 0.0 110.755 178.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -73.39 -28.97 62.3 Favored 'General case' 0 N--CA 1.52 3.045 0 CA-C-O 117.368 -1.301 . . . . 0.0 110.513 179.018 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 24.1 ptt180 -83.34 -24.55 32.05 Favored 'General case' 0 N--CA 1.537 3.907 0 CA-C-N 120.175 1.352 . . . . 0.0 107.703 174.318 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -67.58 -26.41 66.27 Favored 'General case' 1 N--CA 1.542 4.17 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 172.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -92.53 -28.74 16.59 Favored 'General case' 0 N--CA 1.511 2.592 0 C-N-CA 124.809 1.244 . . . . 0.0 111.316 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.457 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 34.8 tp -78.08 -20.05 53.03 Favored 'General case' 0 N--CA 1.537 3.894 0 N-CA-C 105.501 -2.037 . . . . 0.0 105.501 172.137 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.431 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -69.97 -70.96 1.07 Allowed Glycine 0 C--N 1.374 2.686 0 C-N-CA 125.311 1.434 . . . . 0.0 109.557 177.386 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.6 m -66.18 -25.35 66.9 Favored 'General case' 0 N--CA 1.531 3.607 0 CA-C-O 117.744 -1.122 . . . . 0.0 112.85 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -70.77 -52.07 23.02 Favored 'General case' 0 N--CA 1.534 3.754 0 CA-C-N 120.063 1.302 . . . . 0.0 108.417 177.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 23.0 t -64.42 -16.19 18.85 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.171 0 O-C-N 120.871 -1.143 . . . . 0.0 109.61 175.599 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -76.75 -46.46 25.17 Favored 'General case' 0 N--CA 1.523 3.199 0 CA-C-N 120.001 1.273 . . . . 0.0 111.793 178.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.451 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -72.58 -23.26 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.41 0 CA-C-N 120.843 1.656 . . . . 0.0 111.297 -179.216 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -88.69 -52.53 10.94 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.846 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -58.02 -24.67 59.22 Favored 'General case' 1 N--CA 1.54 4.034 0 CA-C-O 118.871 -0.585 . . . . 0.0 110.138 178.145 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -88.35 -32.25 18.5 Favored 'General case' 0 N--CA 1.519 3.009 0 CA-C-O 118.345 -0.836 . . . . 0.0 109.555 177.208 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 16.8 tp -64.09 -58.24 7.24 Favored 'General case' 0 N--CA 1.539 4.0 0 CA-C-N 119.3 0.955 . . . . 0.0 110.463 -179.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 33.1 mt -49.17 -26.7 3.0 Favored 'General case' 1 N--CA 1.542 4.132 0 C-N-CA 123.72 0.808 . . . . 0.0 112.891 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 26.9 mmm180 -88.01 -42.32 12.52 Favored 'General case' 0 N--CA 1.527 3.421 0 CA-C-N 118.474 0.579 . . . . 0.0 110.216 -179.548 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 67.17 88.09 0.07 OUTLIER Glycine 1 N--CA 1.525 4.602 0 CA-C-O 119.134 -0.814 . . . . 0.0 111.703 178.687 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -160.45 -54.24 0.05 Allowed 'General case' 0 N--CA 1.53 3.563 0 CA-C-N 117.714 0.757 . . . . 0.0 110.468 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 9.0 ptt? -142.32 73.76 1.42 Allowed 'General case' 0 N--CA 1.531 3.622 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.434 ' HA ' HD22 ' A' ' 71' ' ' LEU . 18.1 m -133.38 -13.94 2.62 Favored 'General case' 0 N--CA 1.522 3.126 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 -173.71 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -111.98 -67.82 0.97 Allowed 'General case' 0 N--CA 1.529 3.482 0 CA-C-N 120.179 1.354 . . . . 0.0 112.776 -177.499 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 11.0 mtt180 -94.94 -47.1 6.57 Favored 'General case' 0 N--CA 1.532 3.642 0 CA-C-N 118.83 0.741 . . . . 0.0 111.097 -177.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -72.95 -12.17 60.85 Favored 'General case' 0 N--CA 1.517 2.906 0 CA-C-O 118.438 -0.792 . . . . 0.0 112.759 -179.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.608 HD23 HG21 ' A' ' 82' ' ' ILE . 26.0 tp -80.21 -54.54 5.65 Favored 'General case' 0 N--CA 1.527 3.401 0 CA-C-O 117.735 -1.126 . . . . 0.0 113.429 -177.287 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -40.11 -48.7 2.53 Favored 'General case' 1 N--CA 1.558 4.94 0 CA-C-N 119.943 1.247 . . . . 0.0 114.162 -177.39 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -68.88 -34.88 76.16 Favored 'General case' 0 N--CA 1.535 3.782 0 CA-C-O 118.967 -0.54 . . . . 0.0 112.154 -177.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -53.12 -52.67 57.94 Favored 'General case' 0 N--CA 1.534 3.753 0 C-N-CA 124.196 0.998 . . . . 0.0 113.023 -178.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.9 pp -121.6 -41.45 2.48 Favored 'General case' 0 N--CA 1.534 3.733 0 CA-C-O 118.895 -0.574 . . . . 0.0 111.326 -178.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 122.25 64.55 0.22 Allowed Glycine 1 N--CA 1.523 4.463 0 N-CA-C 110.81 -0.916 . . . . 0.0 110.81 179.341 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -133.3 109.6 9.49 Favored 'General case' 0 N--CA 1.518 2.957 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 178.518 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -45.14 171.61 0.01 OUTLIER Glycine 1 N--CA 1.546 5.983 0 C-N-CA 124.448 1.023 . . . . 0.0 114.388 -177.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.491 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 1.6 mt -82.13 -14.35 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.666 0 CA-C-N 118.69 1.245 . . . . 0.0 108.9 178.468 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.893 ' HB2' ' H62' ' E' ' 15' ' ' ' DA' . . . -70.03 -31.72 69.49 Favored 'General case' 0 N--CA 1.523 3.188 0 CA-C-N 119.821 1.191 . . . . 0.0 110.675 176.756 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.493 HG21 ' OP2' ' E' ' 14' ' ' ' DT' . 1.3 p -83.51 -42.61 16.67 Favored 'General case' 1 N--CA 1.541 4.115 0 CA-C-N 119.926 1.239 . . . . 0.0 111.636 -179.702 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.608 HG21 HD23 ' A' ' 71' ' ' LEU . 0.7 OUTLIER -70.61 -23.42 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.873 0 CA-C-O 118.043 -0.98 . . . . 0.0 112.587 -178.18 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 70.8 p -105.5 -25.32 12.37 Favored 'General case' 0 N--CA 1.517 2.901 0 CA-C-N 119.605 1.093 . . . . 0.0 111.321 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.9 ptt180 -79.11 -22.51 45.1 Favored 'General case' 0 N--CA 1.535 3.811 0 CA-C-N 120.105 1.321 . . . . 0.0 108.116 174.261 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.49 -32.29 82.91 Favored Glycine 1 N--CA 1.516 4.005 0 N-CA-C 110.009 -1.237 . . . . 0.0 110.009 176.682 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 60.2 p -68.07 -32.3 72.54 Favored 'General case' 0 N--CA 1.537 3.91 0 CA-C-N 118.577 1.189 . . . . 0.0 110.031 177.025 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -60.15 -30.66 69.45 Favored 'General case' 1 N--CA 1.541 4.093 0 C-N-CA 123.726 0.81 . . . . 0.0 111.132 178.224 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.432 ' HB3' ' HA ' ' B' ' 541' ' ' LEU . 18.4 m -61.04 -42.0 97.65 Favored 'General case' 0 N--CA 1.537 3.909 0 C-N-CA 123.813 0.845 . . . . 0.0 111.578 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 22.1 mt -57.54 -39.72 77.24 Favored 'General case' 0 N--CA 1.531 3.585 0 C-N-CA 124.064 0.946 . . . . 0.0 111.42 -179.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 12.1 mmpt? -59.3 -20.82 57.58 Favored 'General case' 1 N--CA 1.542 4.131 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -178.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -95.88 -48.15 5.85 Favored 'General case' 0 N--CA 1.52 3.044 0 CA-C-N 119.083 0.856 . . . . 0.0 111.864 -178.464 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.35 160.7 0.35 Allowed Pre-proline 1 N--CA 1.553 4.716 0 CA-C-O 118.14 -0.933 . . . . 0.0 113.486 -178.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -79.68 174.62 11.52 Favored 'Trans proline' 0 C--N 1.381 2.286 0 C-N-CA 121.661 1.574 . . . . 0.0 110.444 179.091 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -98.82 -28.65 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.972 0 CA-C-O 117.484 -1.246 . . . . 0.0 111.779 -178.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -63.64 -40.61 97.31 Favored 'General case' 0 N--CA 1.515 2.804 0 CA-C-N 119.966 1.257 . . . . 0.0 110.468 -178.478 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.467 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.5 mp -98.13 -18.29 18.58 Favored 'General case' 0 N--CA 1.512 2.641 0 C-N-CA 123.337 0.655 . . . . 0.0 111.517 178.701 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.53 -29.18 69.21 Favored 'General case' 1 N--CA 1.547 4.397 0 N-CA-C 103.293 -2.854 . . . . 0.0 103.293 169.029 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -57.36 -39.72 76.58 Favored 'General case' 0 N--CA 1.515 2.797 0 C-N-CA 124.29 1.036 . . . . 0.0 110.335 174.716 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.63 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 53.0 t90 -64.03 -34.98 79.25 Favored 'General case' 0 N--CA 1.533 3.701 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 177.018 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.78 -38.25 60.8 Favored 'General case' 1 N--CA 1.54 4.056 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 176.408 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -68.03 -38.69 82.85 Favored 'General case' 1 N--CA 1.54 4.062 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 175.772 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -61.58 -22.33 65.11 Favored 'General case' 1 N--CA 1.544 4.263 0 C-N-CA 123.45 0.7 . . . . 0.0 110.983 176.6 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.507 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -118.97 6.32 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.543 0 CA-C-N 118.481 0.582 . . . . 0.0 112.192 -177.785 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -108.27 -56.28 2.27 Favored 'General case' 0 N--CA 1.514 2.757 0 N-CA-C 106.028 -1.842 . . . . 0.0 106.028 176.288 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 35.2 mt -47.11 -53.74 12.13 Favored 'General case' 1 N--CA 1.544 4.248 0 C-N-CA 125.708 1.603 . . . . 0.0 111.712 179.072 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 47.1 mttp -104.33 55.42 0.72 Allowed 'General case' 0 N--CA 1.516 2.842 0 CA-C-O 122.046 0.927 . . . . 0.0 108.54 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.6 t . . . . . 0 N--CA 1.517 2.9 0 CA-C-O 118.041 -0.98 . . . . 0.0 109.36 179.568 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 . . . . . 0 N--CA 1.502 2.156 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 37.7 p -143.02 136.57 14.21 Favored Pre-proline 0 N--CA 1.528 3.436 0 CA-C-O 117.429 -1.272 . . . . 0.0 110.284 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -76.62 133.69 14.47 Favored 'Trans proline' 0 C--N 1.387 2.585 0 C-N-CA 122.362 2.041 . . . . 0.0 111.16 -179.161 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -93.18 -48.7 6.33 Favored 'General case' 0 N--CA 1.523 3.22 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 178.029 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 23.8 m -107.43 -57.53 2.07 Favored 'General case' 0 N--CA 1.514 2.762 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 178.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -170.69 136.51 1.22 Allowed 'General case' 0 N--CA 1.535 3.78 0 C-N-CA 122.999 0.52 . . . . 0.0 111.134 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -141.77 133.08 26.5 Favored 'General case' 0 N--CA 1.525 3.306 0 C-N-CA 122.896 0.478 . . . . 0.0 110.371 179.496 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 12.1 tpt -92.49 102.95 15.41 Favored 'General case' 0 N--CA 1.521 3.111 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 179.1 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -165.43 133.75 3.17 Favored 'General case' 0 N--CA 1.529 3.517 0 C-N-CA 122.69 0.396 . . . . 0.0 110.979 -178.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -127.67 108.21 10.56 Favored 'General case' 0 N--CA 1.519 2.992 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 178.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -127.01 -26.8 3.09 Favored 'General case' 0 N--CA 1.53 3.537 0 CA-C-O 118.28 -0.867 . . . . 0.0 112.104 -177.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 55.0 mtt-85 -90.39 176.21 6.8 Favored 'General case' 0 N--CA 1.537 3.884 0 CA-C-N 119.286 0.948 . . . . 0.0 112.277 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 79.6 m80 62.72 122.04 0.01 OUTLIER 'General case' 0 N--CA 1.528 3.461 0 C-N-CA 125.256 1.423 . . . . 0.0 112.134 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -114.0 151.91 31.71 Favored 'General case' 0 N--CA 1.531 3.584 0 C-N-CA 123.684 0.794 . . . . 0.0 110.097 178.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -94.69 -72.53 0.62 Allowed 'General case' 0 N--CA 1.525 3.295 0 CA-C-O 118.947 -0.549 . . . . 0.0 109.749 179.653 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 519' ' ' TRP . . . . . 0.698 ' CZ2' HD21 ' A' ' 39' ' ' LEU . 64.6 t-105 -40.64 -32.47 0.21 Allowed 'General case' 1 N--CA 1.548 4.449 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -179.297 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 520' ' ' LEU . . . . . 0.534 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.3 mm? -90.12 -31.06 17.26 Favored 'General case' 0 N--CA 1.525 3.298 0 CA-C-O 117.867 -1.063 . . . . 0.0 113.418 -172.601 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 31.6 ttt180 -61.51 -23.09 65.67 Favored 'General case' 1 N--CA 1.544 4.269 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 171.803 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 522' ' ' PHE . . . . . 0.546 ' O ' HD23 ' B' ' 526' ' ' LEU . 1.1 m-85 -82.02 -39.36 23.65 Favored 'General case' 0 N--CA 1.513 2.722 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 174.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 41.2 t -64.99 -22.45 31.46 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.228 0 CA-C-O 117.911 -1.042 . . . . 0.0 112.08 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -76.62 -52.8 9.01 Favored 'General case' 0 N--CA 1.534 3.761 0 CA-C-N 120.116 1.326 . . . . 0.0 107.963 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 7.4 mp -66.74 -21.64 66.06 Favored 'General case' 0 N--CA 1.533 3.722 0 CA-C-O 119.401 -0.333 . . . . 0.0 110.273 176.293 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 526' ' ' LEU . . . . . 0.546 HD23 ' O ' ' B' ' 522' ' ' PHE . 1.8 mm? -70.06 -37.16 75.44 Favored 'General case' 0 N--CA 1.52 3.036 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 176.419 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 10.3 ttmt -66.68 -24.56 66.28 Favored 'General case' 0 N--CA 1.517 2.888 0 CA-C-O 118.153 -0.927 . . . . 0.0 110.695 176.339 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -69.21 -38.2 78.46 Favored 'General case' 1 N--CA 1.541 4.08 0 CA-C-N 119.544 1.065 . . . . 0.0 109.017 176.819 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 529' ' ' ALA . . . . . 0.63 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -91.68 -9.02 45.4 Favored 'General case' 0 N--CA 1.499 1.983 0 CA-C-O 118.019 -0.991 . . . . 0.0 111.242 178.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -81.72 -30.79 32.39 Favored 'General case' 0 N--CA 1.53 3.549 0 CA-C-N 120.73 1.605 . . . . 0.0 108.595 179.106 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -61.53 -42.87 99.45 Favored 'General case' 0 N--CA 1.538 3.928 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 176.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -95.71 -86.72 0.3 Allowed 'General case' 0 N--CA 1.518 2.969 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 177.371 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.8 p30 151.26 52.87 0.0 OUTLIER 'General case' 1 N--CA 1.558 4.94 0 C-N-CA 127.755 2.422 . . . . 0.0 107.59 177.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 534' ' ' LEU . . . . . 0.467 HD22 ' CD2' ' A' ' 96' ' ' LEU . 6.2 mt -111.11 8.02 21.59 Favored 'General case' 0 N--CA 1.532 3.675 0 C-N-CA 124.161 0.985 . . . . 0.0 111.703 -178.226 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 535' ' ' HIS . . . . . 0.607 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 53.3 p-80 -81.98 -1.82 49.45 Favored 'General case' 0 N--CA 1.513 2.712 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 175.361 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 536' ' ' LEU . . . . . 0.442 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 46.3 mt -91.87 -50.32 0.31 Allowed Pre-proline 0 N--CA 1.507 2.388 0 CA-C-O 116.346 -1.787 . . . . 0.0 109.092 -176.446 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 537' ' ' PRO . . . . . 0.442 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 3.3 Cg_exo -64.48 -37.13 40.06 Favored 'Trans proline' 0 C--N 1.394 2.959 0 N-CA-C 107.225 -1.875 . . . . 0.0 107.225 171.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 538' ' ' LEU . . . . . 0.4 ' C ' HD13 ' B' ' 538' ' ' LEU . 0.2 OUTLIER -61.94 -41.3 97.8 Favored 'General case' 0 N--CA 1.527 3.394 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 175.39 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 8.1 mt -70.15 -24.11 63.11 Favored 'General case' 0 N--CA 1.536 3.84 0 CA-C-O 118.045 -0.979 . . . . 0.0 111.448 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -78.34 -6.76 56.07 Favored 'General case' 0 N--CA 1.526 3.365 0 CA-C-N 119.405 1.002 . . . . 0.0 110.645 178.523 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 541' ' ' LEU . . . . . 0.608 HD13 ' N ' ' B' ' 542' ' ' MET . 0.0 OUTLIER -106.67 -43.22 4.77 Favored 'General case' 0 N--CA 1.513 2.718 0 C-N-CA 124.159 0.984 . . . . 0.0 109.212 -179.587 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 542' ' ' MET . . . . . 0.608 ' N ' HD13 ' B' ' 541' ' ' LEU . 7.8 ptt? -94.84 -3.44 48.89 Favored 'General case' 0 N--CA 1.53 3.571 0 CA-C-O 117.78 -1.105 . . . . 0.0 112.728 -179.286 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.67 -108.17 0.3 Allowed 'General case' 0 N--CA 1.526 3.34 0 CA-C-N 120.386 1.448 . . . . 0.0 112.236 -177.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 3.9 t 157.07 140.2 0.0 OUTLIER Pre-proline 1 N--CA 1.567 5.406 0 C-N-CA 126.654 1.982 . . . . 0.0 108.332 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -52.27 -29.57 38.79 Favored 'Trans proline' 0 N--CA 1.524 3.276 0 C-N-CA 123.818 3.012 . . . . 0.0 115.891 -176.716 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -58.85 -31.48 68.56 Favored 'General case' 1 N--CA 1.545 4.285 0 CA-C-N 118.898 0.772 . . . . 0.0 112.514 -177.626 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.72 -31.28 63.3 Favored 'General case' 0 N--CA 1.524 3.239 0 CA-C-O 117.947 -1.025 . . . . 0.0 110.782 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -79.57 -20.18 47.62 Favored 'General case' 0 N--CA 1.527 3.41 0 CA-C-N 119.574 1.079 . . . . 0.0 110.633 177.111 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -70.07 -47.44 61.9 Favored 'General case' 0 N--CA 1.534 3.768 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 174.197 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -77.5 -11.67 59.88 Favored 'General case' 0 N--CA 1.512 2.664 0 CA-C-O 117.295 -1.335 . . . . 0.0 111.288 176.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 551' ' ' LEU . . . . . 0.683 HD22 ' CZ3' ' A' ' 19' ' ' TRP . 13.3 tp -81.5 -33.95 31.58 Favored 'General case' 0 N--CA 1.527 3.4 0 CA-C-N 120.722 1.601 . . . . 0.0 107.486 175.384 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -68.47 -52.45 26.1 Favored Glycine 0 N--CA 1.509 3.518 0 N-CA-C 108.732 -1.747 . . . . 0.0 108.732 178.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.9 m -67.34 -30.61 70.48 Favored 'General case' 0 N--CA 1.532 3.628 0 CA-C-O 118.205 -0.902 . . . . 0.0 111.891 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 11.5 mtm180 -67.49 -46.74 72.06 Favored 'General case' 1 N--CA 1.545 4.32 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 176.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 555' ' ' VAL . . . . . 0.411 HG23 ' O ' ' B' ' 551' ' ' LEU . 19.6 t -69.81 -15.64 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.681 0 CA-C-O 118.158 -0.925 . . . . 0.0 109.5 176.752 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 6.8 mtm-85 -80.04 -40.82 26.94 Favored 'General case' 0 N--CA 1.523 3.217 0 CA-C-O 117.583 -1.199 . . . . 0.0 111.202 178.004 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 557' ' ' ILE . . . . . 0.459 ' HB ' HG22 ' B' ' 582' ' ' ILE . 0.0 OUTLIER -74.36 -25.1 19.27 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.557 0 CA-C-N 121.115 1.78 . . . . 0.0 110.236 -179.547 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 558' ' ' VAL . . . . . 0.496 HG11 HD11 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -85.56 -50.92 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.928 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 179.74 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -58.8 -26.6 64.24 Favored 'General case' 0 N--CA 1.537 3.879 0 CA-C-O 118.985 -0.531 . . . . 0.0 110.377 178.399 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -95.03 -21.87 18.29 Favored 'General case' 0 N--CA 1.525 3.31 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.854 178.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 27.7 tp -71.44 -47.36 56.35 Favored 'General case' 0 N--CA 1.537 3.914 0 CA-C-N 119.751 1.16 . . . . 0.0 108.617 178.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 51.7 mt -59.26 -18.5 37.94 Favored 'General case' 0 N--CA 1.536 3.839 0 CA-C-O 118.143 -0.932 . . . . 0.0 113.157 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -94.21 -46.53 7.04 Favored 'General case' 0 N--CA 1.526 3.369 0 CA-C-N 119.359 0.982 . . . . 0.0 108.971 179.33 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 68.42 66.75 2.19 Favored Glycine 1 N--CA 1.52 4.262 0 CA-C-O 119.374 -0.681 . . . . 0.0 112.364 178.583 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -118.31 -59.56 1.88 Allowed 'General case' 0 N--CA 1.525 3.316 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 178.177 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 75.1 mtm -152.65 80.64 1.22 Allowed 'General case' 0 N--CA 1.522 3.138 0 N-CA-C 105.25 -2.13 . . . . 0.0 105.25 178.038 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 567' ' ' SER . . . . . 0.425 ' HA ' ' HB2' ' B' ' 571' ' ' LEU . 50.0 m -131.63 -9.0 3.62 Favored 'General case' 0 N--CA 1.524 3.248 0 N-CA-C 114.049 1.129 . . . . 0.0 114.049 -173.698 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -117.27 -56.15 2.26 Favored 'General case' 0 N--CA 1.526 3.325 0 CA-C-N 119.852 1.205 . . . . 0.0 110.989 -179.017 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -89.74 -62.8 1.39 Allowed 'General case' 0 N--CA 1.526 3.375 0 C-N-CA 122.661 0.385 . . . . 0.0 111.538 -178.071 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -80.59 -0.45 37.93 Favored 'General case' 0 N--CA 1.521 3.076 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -176.016 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 571' ' ' LEU . . . . . 0.601 HD23 HG21 ' B' ' 582' ' ' ILE . 21.4 tp -78.84 -45.81 20.01 Favored 'General case' 0 N--CA 1.526 3.337 0 CA-C-N 120.207 1.367 . . . . 0.0 110.398 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -45.81 -28.75 1.14 Allowed 'General case' 0 N--CA 1.534 3.771 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 -177.573 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -73.25 -41.33 63.82 Favored 'General case' 0 N--CA 1.532 3.666 0 CA-C-N 118.283 0.492 . . . . 0.0 111.358 -178.459 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -47.29 -51.58 18.73 Favored 'General case' 0 N--CA 1.536 3.836 0 C-N-CA 124.591 1.157 . . . . 0.0 113.672 -178.156 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -130.07 -39.75 1.36 Allowed 'General case' 0 N--CA 1.535 3.811 0 CA-C-O 118.662 -0.685 . . . . 0.0 111.857 -179.048 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 107.31 76.02 0.96 Allowed Glycine 1 N--CA 1.52 4.262 0 N-CA-C 110.331 -1.107 . . . . 0.0 110.331 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -114.23 -1.88 13.51 Favored 'General case' 0 N--CA 1.526 3.374 0 C-N-CA 123.463 0.705 . . . . 0.0 111.47 178.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 578' ' ' GLY . . . . . 0.4 ' HA3' " H2'" ' F' ' 14' ' ' ' DT' . . . 72.49 169.24 12.95 Favored Glycine 1 N--CA 1.52 4.272 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -178.859 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 579' ' ' ILE . . . . . 0.488 HG21 ' N6 ' ' E' ' 4' ' ' ' DA' . 1.0 OUTLIER -90.4 -13.18 9.31 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.812 0 CA-C-N 118.554 1.177 . . . . 0.0 108.966 177.937 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 580' ' ' ALA . . . . . 0.776 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -64.98 -37.65 88.35 Favored 'General case' 0 N--CA 1.526 3.346 0 CA-C-N 120.154 1.343 . . . . 0.0 111.583 178.618 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 2.8 p -82.97 -41.98 18.13 Favored 'General case' 1 N--CA 1.542 4.145 0 CA-C-N 120.1 1.318 . . . . 0.0 111.839 -179.378 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 582' ' ' ILE . . . . . 0.601 HG21 HD23 ' B' ' 571' ' ' LEU . 17.2 pt -70.25 -18.11 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.959 0 CA-C-O 117.685 -1.15 . . . . 0.0 113.385 -177.371 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 80.0 p -112.76 -27.49 8.13 Favored 'General case' 0 N--CA 1.514 2.774 0 CA-C-N 119.962 1.255 . . . . 0.0 111.038 177.536 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -75.57 -20.31 58.71 Favored 'General case' 0 N--CA 1.535 3.775 0 CA-C-N 120.049 1.295 . . . . 0.0 108.491 174.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -65.12 -36.59 93.12 Favored Glycine 1 N--CA 1.517 4.037 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 176.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 68.4 p -64.95 -33.85 77.02 Favored 'General case' 1 N--CA 1.541 4.119 0 CA-C-N 118.399 1.099 . . . . 0.0 110.325 177.564 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -56.52 -35.06 67.62 Favored 'General case' 1 N--CA 1.545 4.289 0 C-N-CA 123.819 0.848 . . . . 0.0 111.134 178.679 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 28.5 m -57.55 -42.84 83.79 Favored 'General case' 1 N--CA 1.541 4.096 0 C-N-CA 123.651 0.78 . . . . 0.0 111.153 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 19.8 mt -56.46 -44.82 80.9 Favored 'General case' 0 N--CA 1.528 3.447 0 C-N-CA 124.03 0.932 . . . . 0.0 111.63 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 20.9 mmmt -57.46 -26.47 61.27 Favored 'General case' 1 N--CA 1.544 4.229 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -86.86 -39.98 15.33 Favored 'General case' 0 N--CA 1.515 2.801 0 CA-C-N 118.493 0.588 . . . . 0.0 110.728 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.6 162.3 28.42 Favored Pre-proline 1 N--CA 1.542 4.136 0 CA-C-O 118.346 -0.835 . . . . 0.0 111.974 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -84.98 172.07 8.92 Favored 'Trans proline' 0 C--N 1.377 2.068 0 C-N-CA 122.045 1.83 . . . . 0.0 111.309 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.2 t -92.31 -24.64 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.118 0 CA-C-O 117.818 -1.087 . . . . 0.0 111.497 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -62.9 -40.66 98.24 Favored 'General case' 0 N--CA 1.516 2.866 0 CA-C-N 120.004 1.275 . . . . 0.0 110.437 -179.087 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 596' ' ' LEU . . . . . 0.574 ' CD2' HD22 ' A' ' 34' ' ' LEU . 7.1 mp -102.14 -12.54 17.99 Favored 'General case' 0 N--CA 1.511 2.59 0 C-N-CA 123.388 0.675 . . . . 0.0 112.188 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -31.46 71.46 Favored 'General case' 1 N--CA 1.544 4.241 0 N-CA-C 102.572 -3.122 . . . . 0.0 102.572 167.055 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.47 -38.29 68.91 Favored 'General case' 0 N--CA 1.52 3.054 0 C-N-CA 124.937 1.295 . . . . 0.0 110.289 174.598 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 599' ' ' TRP . . . . . 0.604 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 53.2 t90 -64.72 -35.84 82.37 Favored 'General case' 0 N--CA 1.538 3.946 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 176.798 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.37 -37.44 62.41 Favored 'General case' 0 N--CA 1.535 3.822 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 176.282 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -68.91 -37.53 79.02 Favored 'General case' 1 N--CA 1.544 4.248 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 175.273 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 602' ' ' GLU . . . . . 0.409 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 3.1 mm-40 -60.88 -21.75 63.6 Favored 'General case' 1 N--CA 1.543 4.192 0 C-N-CA 123.362 0.665 . . . . 0.0 110.494 175.867 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 603' ' ' VAL . . . . . 0.546 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.2 OUTLIER -123.9 6.99 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.536 0 C-N-CA 123.269 0.628 . . . . 0.0 112.439 -177.618 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -111.11 -59.43 1.97 Allowed 'General case' 0 N--CA 1.514 2.74 0 N-CA-C 105.385 -2.08 . . . . 0.0 105.385 176.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 12.6 tp -48.99 -31.57 7.7 Favored 'General case' 0 N--CA 1.537 3.917 0 C-N-CA 125.085 1.354 . . . . 0.0 111.546 177.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -82.75 -63.68 1.32 Allowed 'General case' 0 N--CA 1.52 3.038 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 -179.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 41.3 p . . . . . 0 N--CA 1.527 3.388 0 CA-C-O 118.568 -0.73 . . . . 0.0 110.249 -179.281 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.153 0 CA-C-O 118.286 -0.864 . . . . 0.0 108.718 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 998' ' ' TRP . . . . . 0.534 ' HB2' HG23 ' A' ' 44' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.106 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.425 -9.258 3 O4'-C1'-N19 119.513 14.641 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear build full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.709 5 O4'-C1'-N19 120.418 15.772 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear build full ' E' E ' 3' ' ' ' DT' . . . . . 0.429 " H1'" ' C8 ' ' E' ' 4' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.416 -10.241 3 O4'-C1'-N19 120.228 15.535 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . 0.553 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 4 C3'--C2' 1.42 -9.775 4 O4'-C1'-N19 120.422 15.778 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' E' E ' 5' ' ' ' DC' . . . . . 0.561 ' H41' ' HA ' ' B' ' 580' ' ' ALA . . . . . . . . 6 O3'--C3' 1.575 11.081 5 O4'-C1'-N19 118.612 13.515 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.404 -11.351 5 O4'-C1'-N19 120.328 15.66 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear build full ' E' E ' 7' ' ' ' DA' . . . . . 0.615 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.399 -11.923 3 C4'-C3'-C2' 113.495 10.295 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' E' E ' 8' ' ' ' DG' . . . . . 0.615 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 O3'--C3' 1.575 11.109 4 O4'-C1'-N19 119.784 14.98 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.576 11.185 5 O4'-C1'-N19 118.848 13.811 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear build full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.411 -10.695 3 O4'-C1'-N19 118.966 13.958 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.412 -10.593 5 O4'-C1'-N19 119.614 14.768 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear build full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.311 2 O4'-C1'-N19 119.406 14.507 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear build full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.41 -10.782 5 O4'-C1'-N19 118.942 13.928 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear build full ' E' E ' 14' ' ' ' DT' . . . . . 0.941 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.413 -10.503 5 O4'-C1'-N19 118.73 13.662 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' E' E ' 15' ' ' ' DA' . . . . . 0.913 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.433 -8.523 4 O4'-C1'-N19 119.35 14.437 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.417 -10.064 4 O4'-C1'-N19 119.961 15.201 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear build full ' E' E ' 17' ' ' ' DT' . . . . . 0.408 H2'' H5'' ' E' ' 18' ' ' ' DA' . . . . . . . . 6 O3'--C3' 1.573 10.959 3 O4'-C1'-N19 120.19 15.487 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' E' E ' 18' ' ' ' DA' . . . . . 0.408 H5'' H2'' ' E' ' 17' ' ' ' DT' . . . . . . . . 6 C3'--C2' 1.412 -10.608 5 O4'-C1'-N19 119.905 15.131 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.419 -9.945 5 O4'-C1'-N19 119.558 14.698 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear build full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.51 6.944 4 O4'-C1'-N19 120.051 15.313 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear build full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.556 3 O4'-C1'-N19 118.939 13.923 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear build full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.415 -10.312 3 O4'-C1'-N19 118.865 13.831 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear build full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.406 -11.177 5 O4'-C1'-N19 120.12 15.399 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear build full ' F' F ' 4' ' ' ' DA' . . . . . 0.541 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.419 -9.92 4 O4'-C1'-N19 119.548 14.685 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' F' F ' 5' ' ' ' DC' . . . . . 0.421 ' H41' ' HA ' ' A' ' 80' ' ' ALA . . . . . . . . 6 O3'--C3' 1.574 11.007 4 C4'-C3'-C2' 116.069 12.869 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.41 -10.81 4 O4'-C1'-N19 118.815 13.769 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear build full ' F' F ' 7' ' ' ' DA' . . . . . 0.838 H2'' H5'' ' F' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.382 -13.637 5 N19-C1'-C2' 129.539 9.587 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' F' F ' 8' ' ' ' DG' . . . . . 0.838 H5'' H2'' ' F' ' 7' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.41 -10.767 4 O4'-C1'-N19 118.116 12.895 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' F' F ' 9' ' ' ' DT' . . . . . 0.428 H2'' H5'' ' F' ' 10' ' ' ' DT' . . . . . . . . 6 C3'--C2' 1.411 -10.744 3 O4'-C1'-N19 119.821 15.026 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' F' F ' 10' ' ' ' DT' . . . . . 0.428 H5'' H2'' ' F' ' 9' ' ' ' DT' . . . . . . . . 6 C3'--C2' 1.413 -10.459 3 O4'-C1'-N19 119.094 14.117 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.407 -11.119 3 O4'-C1'-N19 120.192 15.489 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear build full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.435 4 O4'-C1'-N19 119.026 14.032 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear build full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.574 11.033 5 O4'-C1'-N19 119.54 14.675 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear build full ' F' F ' 14' ' ' ' DT' . . . . . 0.663 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.413 -10.478 3 O4'-C1'-N19 118.931 13.913 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' F' F ' 15' ' ' ' DA' . . . . . 0.877 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.425 -9.255 5 O4'-C1'-N19 119.808 15.01 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.286 5 O4'-C1'-N19 119.619 14.774 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear build full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.421 -9.678 3 O4'-C1'-N19 119.443 14.554 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear build full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -9.952 4 O4'-C1'-N19 119.83 15.038 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -11.013 4 O4'-C1'-N19 120.252 15.565 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear build full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.513 7.119 5 O4'-C1'-N19 119.895 15.119 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 17.0 tt0 . . . . . 0 N--CA 1.501 2.099 0 CA-C-O 119.139 -0.458 . . . . 0.0 110.083 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.5 t -155.65 135.3 8.11 Favored Pre-proline 0 N--CA 1.524 3.252 0 CA-C-O 117.353 -1.308 . . . . 0.0 111.143 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -76.04 156.76 38.51 Favored 'Trans proline' 0 C--N 1.386 2.54 0 C-N-CA 122.685 2.257 . . . . 0.0 110.816 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -122.76 -56.74 1.76 Allowed 'General case' 0 N--CA 1.525 3.321 0 CA-C-O 118.96 -0.543 . . . . 0.0 110.405 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 59.8 p -146.77 151.35 37.01 Favored 'General case' 0 N--CA 1.528 3.431 0 N-CA-C 113.045 0.758 . . . . 0.0 113.045 -177.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -105.18 -49.22 3.51 Favored 'General case' 0 N--CA 1.515 2.82 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.263 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 60.73 157.58 0.04 OUTLIER 'General case' 0 N--CA 1.537 3.893 0 C-N-CA 124.381 1.072 . . . . 0.0 112.923 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.5 ttt -117.64 -56.76 2.18 Favored 'General case' 0 N--CA 1.514 2.746 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -158.22 125.34 4.97 Favored 'General case' 0 N--CA 1.52 3.03 0 O-C-N 123.037 0.211 . . . . 0.0 110.996 179.397 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -127.48 -51.89 1.38 Allowed 'General case' 0 N--CA 1.521 3.111 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 179.385 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 65.52 106.13 0.04 OUTLIER 'General case' 0 N--CA 1.526 3.374 0 C-N-CA 124.674 1.189 . . . . 0.0 111.926 178.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -120.89 -36.12 3.21 Favored 'General case' 0 N--CA 1.527 3.411 0 C-N-CA 123.788 0.835 . . . . 0.0 109.732 178.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 69.36 119.66 0.03 OUTLIER 'General case' 0 N--CA 1.531 3.609 0 C-N-CA 125.283 1.433 . . . . 0.0 111.414 178.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -113.65 102.62 10.44 Favored 'General case' 0 N--CA 1.516 2.837 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -125.36 -73.1 0.64 Allowed 'General case' 0 N--CA 1.516 2.832 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.82 ' CE3' HD22 ' B' ' 551' ' ' LEU . 66.6 t-105 -53.42 -39.46 64.36 Favored 'General case' 0 N--CA 1.536 3.85 0 C-N-CA 123.042 0.537 . . . . 0.0 109.64 175.804 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.45 ' N ' HD22 ' A' ' 20' ' ' LEU . 2.5 mm? -79.93 -27.29 39.86 Favored 'General case' 0 N--CA 1.517 2.898 0 CA-C-O 117.372 -1.299 . . . . 0.0 112.259 -175.557 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.8 mtt-85 -57.6 -31.72 66.49 Favored 'General case' 1 N--CA 1.547 4.406 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 172.126 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.58 ' CG ' HD21 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -80.78 -36.81 31.31 Favored 'General case' 0 N--CA 1.504 2.247 0 CA-C-O 116.22 -1.847 . . . . 0.0 109.668 174.615 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.7 t -69.98 -22.83 24.87 Favored 'Isoleucine or valine' 1 N--CA 1.565 5.289 0 CA-C-N 121.373 1.897 . . . . 0.0 112.498 -176.147 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -78.21 -48.56 15.56 Favored 'General case' 0 N--CA 1.535 3.781 0 CA-C-N 120.418 1.463 . . . . 0.0 107.496 178.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.2 mp -70.38 -17.9 63.04 Favored 'General case' 0 N--CA 1.535 3.818 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 175.195 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.429 HD23 ' CE2' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -72.53 -38.56 67.99 Favored 'General case' 0 N--CA 1.517 2.907 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 176.793 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.51 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 32.6 tttt -66.61 -16.94 64.55 Favored 'General case' 0 N--CA 1.514 2.727 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.025 176.594 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -74.14 -40.08 62.86 Favored 'General case' 0 N--CA 1.528 3.457 0 N-CA-C 108.32 -0.992 . . . . 0.0 108.32 175.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.611 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -89.92 -4.5 57.48 Favored 'General case' 0 N--CA 1.505 2.321 0 CA-C-O 118.701 -0.666 . . . . 0.0 110.434 177.23 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.51 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -87.55 -33.98 18.73 Favored 'General case' 0 N--CA 1.529 3.518 0 CA-C-N 120.364 1.438 . . . . 0.0 108.381 179.34 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -61.64 -41.82 98.03 Favored 'General case' 0 N--CA 1.537 3.907 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -92.55 -85.38 0.26 Allowed 'General case' 0 N--CA 1.511 2.612 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 177.282 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p30 150.47 46.84 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.071 0 C-N-CA 127.673 2.389 . . . . 0.0 108.56 177.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.474 HD22 ' CD2' ' B' ' 596' ' ' LEU . 7.8 mt -106.02 16.19 25.41 Favored 'General case' 0 N--CA 1.522 3.171 0 C-N-CA 124.557 1.143 . . . . 0.0 110.365 -178.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.562 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 42.7 p-80 -82.65 4.2 25.82 Favored 'General case' 0 N--CA 1.514 2.735 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 175.27 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.446 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 17.5 mt -92.67 -50.45 0.28 Allowed Pre-proline 0 N--CA 1.509 2.49 0 C-N-CA 125.462 1.505 . . . . 0.0 108.665 -176.116 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.446 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 9.5 Cg_exo -62.51 -35.96 68.14 Favored 'Trans proline' 0 C--N 1.391 2.811 0 N-CA-C 105.945 -2.367 . . . . 0.0 105.945 168.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.1 tt -53.7 -44.24 69.63 Favored 'General case' 0 N--CA 1.534 3.725 0 C-N-CA 124.085 0.954 . . . . 0.0 108.998 174.422 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.748 HD11 ' CE2' ' B' ' 519' ' ' TRP . 0.5 OUTLIER -60.73 -40.91 94.14 Favored 'General case' 1 N--CA 1.557 4.898 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 177.834 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -63.59 -12.97 37.44 Favored 'General case' 0 N--CA 1.535 3.807 0 CA-C-O 118.123 -0.942 . . . . 0.0 113.036 -179.473 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -110.92 -41.78 4.16 Favored 'General case' 0 N--CA 1.531 3.579 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 -177.41 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 4.0 ptp -128.72 13.27 6.39 Favored 'General case' 1 N--CA 1.55 4.571 0 CA-C-N 119.848 1.204 . . . . 0.0 113.436 -175.359 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -113.2 -72.65 0.7 Allowed 'General case' 0 N--CA 1.496 1.856 0 CA-C-N 118.99 0.814 . . . . 0.0 108.946 179.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 14.2 p 126.52 156.98 0.0 OUTLIER Pre-proline 1 N--CA 1.549 4.507 0 C-N-CA 128.629 2.772 . . . . 0.0 107.343 -178.02 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -70.03 -35.74 11.32 Favored 'Trans proline' 0 CA--C 1.571 2.366 0 C-N-CA 122.345 2.03 . . . . 0.0 107.572 174.189 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -65.31 -21.11 66.67 Favored 'General case' 0 N--CA 1.529 3.503 0 CA-C-O 118.175 -0.916 . . . . 0.0 110.296 175.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -75.03 -28.76 60.57 Favored 'General case' 0 N--CA 1.52 3.027 0 CA-C-O 117.283 -1.341 . . . . 0.0 110.137 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.8 ptt180 -87.21 -19.84 27.81 Favored 'General case' 0 N--CA 1.539 3.991 0 CA-C-N 120.406 1.457 . . . . 0.0 107.745 172.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -72.96 -24.09 60.74 Favored 'General case' 0 N--CA 1.525 3.302 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 172.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.438 ' O ' ' HB2' ' A' ' 54' ' ' ARG . . . -87.1 -42.95 12.65 Favored 'General case' 0 N--CA 1.501 2.1 0 CA-C-O 117.982 -1.009 . . . . 0.0 108.71 179.527 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.47 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 24.0 tp -68.24 -20.21 64.79 Favored 'General case' 1 N--CA 1.544 4.252 0 CA-C-N 120.753 1.615 . . . . 0.0 107.747 173.855 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.456 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -68.21 -69.27 1.42 Allowed Glycine 0 N--CA 1.5 2.966 0 C-N-CA 125.493 1.52 . . . . 0.0 111.17 177.475 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.7 m -75.44 -27.53 58.96 Favored 'General case' 0 N--CA 1.53 3.563 0 CA-C-O 117.838 -1.077 . . . . 0.0 112.442 -177.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -68.03 -49.4 61.72 Favored 'General case' 0 N--CA 1.531 3.62 0 CA-C-N 120.185 1.357 . . . . 0.0 107.705 177.514 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.3 t -65.67 -18.59 24.19 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.1 0 CA-C-O 117.929 -1.034 . . . . 0.0 109.776 176.258 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -71.84 -51.58 21.7 Favored 'General case' 0 N--CA 1.527 3.38 0 CA-C-N 120.012 1.278 . . . . 0.0 111.558 178.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -23.66 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.428 0 CA-C-N 120.789 1.631 . . . . 0.0 111.863 -178.049 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.423 ' CG1' HD22 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -86.13 -52.72 11.63 Favored 'Isoleucine or valine' 1 N--CA 1.548 4.454 0 CA-C-N 120.772 1.624 . . . . 0.0 107.308 -179.758 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -59.6 -24.06 63.47 Favored 'General case' 0 N--CA 1.532 3.634 0 CA-C-O 118.579 -0.724 . . . . 0.0 110.453 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -94.36 -24.18 17.49 Favored 'General case' 0 N--CA 1.524 3.23 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.5 177.338 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.423 HD22 ' OG ' ' A' ' 86' ' ' SER . 7.0 mt -72.2 -59.85 2.53 Favored 'General case' 0 N--CA 1.536 3.848 0 CA-C-N 119.521 1.055 . . . . 0.0 110.041 -179.622 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 46.3 mt -50.56 -29.29 10.39 Favored 'General case' 1 N--CA 1.545 4.308 0 C-N-CA 123.443 0.697 . . . . 0.0 112.732 -179.15 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -79.91 -47.78 14.51 Favored 'General case' 0 N--CA 1.528 3.446 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 71.67 86.99 0.15 Allowed Glycine 1 N--CA 1.519 4.169 0 CA-C-O 119.368 -0.684 . . . . 0.0 112.096 178.156 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -151.39 -54.71 0.14 Allowed 'General case' 0 N--CA 1.53 3.562 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.529 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 4.3 ttt -147.2 71.75 1.23 Allowed 'General case' 0 N--CA 1.52 3.045 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 178.56 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.523 ' HA ' HD22 ' A' ' 71' ' ' LEU . 97.2 p -142.86 7.41 1.64 Allowed 'General case' 0 N--CA 1.52 3.066 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -175.446 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -122.53 -62.31 1.38 Allowed 'General case' 0 N--CA 1.529 3.488 0 CA-C-N 119.672 1.124 . . . . 0.0 111.992 -178.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -110.28 -48.79 3.13 Favored 'General case' 0 N--CA 1.524 3.236 0 C-N-CA 123.547 0.739 . . . . 0.0 109.908 -177.422 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -78.47 4.6 12.77 Favored 'General case' 0 N--CA 1.513 2.71 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -177.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.681 HD23 HG21 ' A' ' 82' ' ' ILE . 44.0 tp -89.13 -46.54 8.74 Favored 'General case' 0 N--CA 1.53 3.567 0 CA-C-N 120.285 1.402 . . . . 0.0 113.233 -178.603 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -41.7 -42.59 2.6 Favored 'General case' 1 N--CA 1.544 4.228 0 N-CA-C 116.169 1.914 . . . . 0.0 116.169 -173.906 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -64.1 -21.52 66.57 Favored 'General case' 1 N--CA 1.545 4.306 0 CA-C-N 119.071 0.85 . . . . 0.0 113.117 -177.592 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -57.65 -59.77 4.69 Favored 'General case' 0 N--CA 1.529 3.476 0 C-N-CA 124.579 1.152 . . . . 0.0 112.587 -178.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.427 HD23 ' N ' ' A' ' 75' ' ' LEU . 1.3 pt? -130.78 -42.0 1.15 Allowed 'General case' 0 N--CA 1.526 3.369 0 CA-C-O 118.857 -0.592 . . . . 0.0 111.21 -179.538 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 120.34 78.26 0.53 Allowed Glycine 0 N--CA 1.514 3.897 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 179.344 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -104.53 -39.76 6.29 Favored 'General case' 0 N--CA 1.524 3.257 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 177.265 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.34 162.24 23.52 Favored Glycine 1 N--CA 1.524 4.547 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 -179.007 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.541 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 1.5 mt -84.7 -13.82 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.813 0 CA-C-N 119.721 1.761 . . . . 0.0 108.346 178.111 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.941 ' HB3' ' H72' ' E' ' 14' ' ' ' DT' . . . -70.75 -40.31 72.77 Favored 'General case' 0 N--CA 1.517 2.878 0 CA-C-O 117.656 -1.164 . . . . 0.0 110.294 177.09 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.536 HG21 ' OP2' ' E' ' 14' ' ' ' DT' . 4.6 p -79.52 -42.37 25.32 Favored 'General case' 0 N--CA 1.538 3.961 0 CA-C-N 119.838 1.199 . . . . 0.0 112.807 -178.839 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.681 HG21 HD23 ' A' ' 71' ' ' LEU . 20.5 pt -70.88 -16.49 19.62 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.022 0 CA-C-O 117.853 -1.07 . . . . 0.0 113.749 -176.552 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 80.4 p -113.01 -32.75 6.26 Favored 'General case' 0 N--CA 1.514 2.773 0 CA-C-N 119.795 1.18 . . . . 0.0 110.216 178.007 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.5 ptt180 -71.91 -20.22 61.81 Favored 'General case' 0 N--CA 1.533 3.68 0 CA-C-N 119.56 1.073 . . . . 0.0 109.005 175.041 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -64.78 -38.18 95.26 Favored Glycine 1 N--CA 1.52 4.263 0 N-CA-C 108.529 -1.829 . . . . 0.0 108.529 175.43 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.423 ' OG ' HD22 ' A' ' 61' ' ' LEU . 50.3 m -65.09 -28.13 69.24 Favored 'General case' 1 N--CA 1.54 4.042 0 CA-C-N 117.747 0.773 . . . . 0.0 110.708 176.678 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -60.64 -31.62 70.82 Favored 'General case' 1 N--CA 1.54 4.046 0 CA-C-N 118.542 0.61 . . . . 0.0 111.228 179.218 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 2.6 m -65.59 -35.29 80.38 Favored 'General case' 0 N--CA 1.537 3.89 0 C-N-CA 123.471 0.708 . . . . 0.0 111.219 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 23.8 mt -56.33 -40.11 73.9 Favored 'General case' 0 N--CA 1.534 3.759 0 C-N-CA 124.165 0.986 . . . . 0.0 111.882 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -20.73 18.95 Favored 'General case' 1 N--CA 1.54 4.042 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 -178.756 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -106.56 -30.76 8.84 Favored 'General case' 0 N--CA 1.517 2.913 0 CA-C-N 119.301 0.955 . . . . 0.0 112.511 -179.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -49.88 160.37 0.64 Allowed Pre-proline 1 N--CA 1.55 4.531 0 CA-C-N 119.285 0.948 . . . . 0.0 113.508 -178.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -85.29 151.12 10.6 Favored 'Trans proline' 0 C--N 1.379 2.166 0 C-N-CA 122.497 2.131 . . . . 0.0 110.511 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.8 t -84.08 -25.83 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.217 0 CA-C-O 117.694 -1.146 . . . . 0.0 111.858 -179.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -63.27 -40.6 97.85 Favored 'General case' 0 N--CA 1.52 3.029 0 CA-C-N 120.346 1.43 . . . . 0.0 109.85 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.486 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.0 mp -97.87 -13.97 20.97 Favored 'General case' 0 N--CA 1.51 2.542 0 C-N-CA 123.818 0.847 . . . . 0.0 111.344 178.51 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.07 -36.65 84.7 Favored 'General case' 1 N--CA 1.544 4.237 0 N-CA-C 102.809 -3.034 . . . . 0.0 102.809 168.005 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -52.78 -38.27 60.87 Favored 'General case' 0 N--CA 1.517 2.886 0 C-N-CA 124.585 1.154 . . . . 0.0 111.621 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.661 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 50.6 t90 -63.0 -37.1 85.81 Favored 'General case' 0 N--CA 1.532 3.64 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.545 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 10.0 mp -55.31 -35.33 65.0 Favored 'General case' 1 N--CA 1.543 4.197 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 176.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -70.5 -35.95 73.51 Favored 'General case' 0 N--CA 1.536 3.853 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 175.177 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.411 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 3.0 mm-40 -62.2 -23.78 66.84 Favored 'General case' 1 N--CA 1.542 4.164 0 C-N-CA 123.739 0.816 . . . . 0.0 110.087 175.285 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.54 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -120.96 12.82 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.556 0 C-N-CA 123.673 0.789 . . . . 0.0 111.851 -178.052 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 43.4 mt -124.85 -62.32 1.25 Allowed 'General case' 0 N--CA 1.526 3.351 0 N-CA-C 106.573 -1.639 . . . . 0.0 106.573 176.234 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.411 HD23 ' O ' ' A' ' 105' ' ' LEU . 3.8 tt -46.68 -38.4 9.75 Favored 'General case' 1 N--CA 1.548 4.448 0 C-N-CA 125.278 1.431 . . . . 0.0 111.899 179.073 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 32.6 ttmt 89.19 102.03 0.03 OUTLIER 'General case' 1 N--CA 1.54 4.051 0 C-N-CA 125.793 1.637 . . . . 0.0 108.045 -179.506 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 28.3 p . . . . . 0 N--CA 1.525 3.317 0 CA-C-O 118.557 -0.735 . . . . 0.0 109.458 -179.763 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 . . . . . 0 N--CA 1.502 2.171 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 82.3 p 61.84 117.73 0.02 OUTLIER Pre-proline 0 N--CA 1.536 3.827 0 C-N-CA 125.412 1.485 . . . . 0.0 111.242 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -70.91 165.02 33.64 Favored 'Trans proline' 0 C--N 1.389 2.693 0 C-N-CA 122.421 2.081 . . . . 0.0 112.575 -179.33 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -121.61 -54.64 1.95 Allowed 'General case' 0 N--CA 1.518 2.96 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 178.61 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 71.5 m -112.83 146.32 39.08 Favored 'General case' 0 N--CA 1.522 3.174 0 C-N-CA 123.139 0.576 . . . . 0.0 111.609 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -101.9 126.72 48.86 Favored 'General case' 0 N--CA 1.52 3.03 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.221 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -78.15 129.81 35.6 Favored 'General case' 0 N--CA 1.524 3.238 0 C-N-CA 122.395 0.278 . . . . 0.0 110.773 -178.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 48.2 mtt -145.88 126.79 14.49 Favored 'General case' 0 N--CA 1.526 3.333 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 179.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -115.35 135.63 53.94 Favored 'General case' 0 N--CA 1.521 3.078 0 C-N-CA 122.998 0.519 . . . . 0.0 111.275 -178.499 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -136.32 -54.97 0.75 Allowed 'General case' 0 N--CA 1.523 3.202 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 178.724 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -102.0 91.84 4.52 Favored 'General case' 0 N--CA 1.518 2.939 0 N-CA-C 108.323 -0.992 . . . . 0.0 108.323 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -139.57 132.08 28.67 Favored 'General case' 0 N--CA 1.527 3.418 0 C-N-CA 122.935 0.494 . . . . 0.0 110.075 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 12.1 p80 -150.49 113.66 4.85 Favored 'General case' 0 N--CA 1.524 3.27 0 C-N-CA 122.691 0.396 . . . . 0.0 110.145 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -101.49 129.74 47.6 Favored 'General case' 0 N--CA 1.527 3.394 0 C-N-CA 123.004 0.522 . . . . 0.0 110.242 -179.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -119.41 -77.16 0.57 Allowed 'General case' 0 N--CA 1.517 2.894 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 519' ' ' TRP . . . . . 0.748 ' CE2' HD11 ' A' ' 39' ' ' LEU . 68.5 t-105 -43.33 -28.09 0.3 Allowed 'General case' 1 N--CA 1.545 4.324 0 C-N-CA 124.206 1.002 . . . . 0.0 113.679 179.834 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 520' ' ' LEU . . . . . 0.578 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.2 mm? -96.12 -30.38 13.56 Favored 'General case' 0 N--CA 1.528 3.434 0 CA-C-O 117.847 -1.073 . . . . 0.0 113.733 -172.12 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 21.1 tpp180 -64.8 -23.44 67.24 Favored 'General case' 0 N--CA 1.533 3.679 0 N-CA-C 105.882 -1.896 . . . . 0.0 105.882 172.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 522' ' ' PHE . . . . . 0.543 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 2.1 m-85 -76.42 -41.39 47.85 Favored 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 106.059 -1.83 . . . . 0.0 106.059 172.466 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 523' ' ' VAL . . . . . 0.465 ' HA ' ' HB2' ' B' ' 526' ' ' LEU . 72.2 t -64.53 -18.32 22.98 Favored 'Isoleucine or valine' 1 N--CA 1.559 4.986 0 CA-C-N 119.52 1.055 . . . . 0.0 111.685 177.711 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -76.53 -56.22 4.82 Favored 'General case' 0 N--CA 1.532 3.669 0 CA-C-N 120.276 1.398 . . . . 0.0 107.842 -179.321 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 5.6 mp -67.61 -18.98 65.17 Favored 'General case' 0 N--CA 1.533 3.678 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 175.285 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 526' ' ' LEU . . . . . 0.465 ' HB2' ' HA ' ' B' ' 523' ' ' VAL . 0.4 OUTLIER -70.36 -39.78 74.44 Favored 'General case' 0 N--CA 1.513 2.716 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 177.688 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 527' ' ' LYS . . . . . 0.415 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 10.2 tttt -67.07 -18.65 65.43 Favored 'General case' 0 N--CA 1.524 3.24 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.884 177.229 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -72.97 -39.88 65.77 Favored 'General case' 0 N--CA 1.529 3.517 0 CA-C-N 119.46 1.027 . . . . 0.0 108.665 176.068 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 529' ' ' ALA . . . . . 0.661 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -92.83 -7.6 45.9 Favored 'General case' 0 N--CA 1.507 2.399 0 CA-C-O 118.629 -0.7 . . . . 0.0 111.166 178.221 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 530' ' ' TYR . . . . . 0.415 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.2 OUTLIER -83.73 -34.51 24.86 Favored 'General case' 0 N--CA 1.535 3.803 0 CA-C-N 120.35 1.432 . . . . 0.0 108.515 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -62.68 -41.35 99.05 Favored 'General case' 0 N--CA 1.534 3.728 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 177.192 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -91.85 -87.62 0.21 Allowed 'General case' 0 N--CA 1.514 2.732 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 176.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.9 p30 150.33 51.27 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.07 0 C-N-CA 127.755 2.422 . . . . 0.0 108.415 177.227 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 534' ' ' LEU . . . . . 0.486 HD22 ' CD2' ' A' ' 96' ' ' LEU . 4.8 mt -110.75 9.15 22.71 Favored 'General case' 0 N--CA 1.529 3.486 0 C-N-CA 124.624 1.17 . . . . 0.0 111.024 -178.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 535' ' ' HIS . . . . . 0.569 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 57.2 p-80 -82.53 -0.9 48.81 Favored 'General case' 0 N--CA 1.515 2.793 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 174.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 536' ' ' LEU . . . . . 0.43 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 39.2 mt -91.29 -49.82 0.33 Allowed Pre-proline 0 N--CA 1.505 2.277 0 CA-C-O 116.317 -1.802 . . . . 0.0 109.212 -176.088 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 537' ' ' PRO . . . . . 0.43 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 4.1 Cg_exo -66.26 -35.19 33.15 Favored 'Trans proline' 0 C--N 1.395 2.996 0 N-CA-C 107.345 -1.829 . . . . 0.0 107.345 171.252 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 538' ' ' LEU . . . . . 0.415 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 0.3 OUTLIER -62.17 -39.6 93.19 Favored 'General case' 0 N--CA 1.533 3.682 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 175.111 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 9.8 mt -73.32 -23.08 60.21 Favored 'General case' 0 N--CA 1.535 3.817 0 CA-C-O 118.583 -0.722 . . . . 0.0 111.125 177.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.53 -17.14 62.34 Favored 'General case' 0 N--CA 1.531 3.596 0 CA-C-N 118.853 0.751 . . . . 0.0 110.802 178.212 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 541' ' ' LEU . . . . . 0.433 ' O ' HD23 ' B' ' 541' ' ' LEU . 1.9 tt -101.01 -52.86 3.18 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 123.495 0.718 . . . . 0.0 110.916 -178.81 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 12.2 ptm -54.55 -41.52 69.87 Favored 'General case' 0 N--CA 1.531 3.611 0 CA-C-O 117.754 -1.117 . . . . 0.0 113.301 -174.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 1.3 tt -134.37 -104.3 0.23 Allowed 'General case' 0 N--CA 1.533 3.722 0 CA-C-O 117.307 -1.33 . . . . 0.0 113.545 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 31.0 p -156.27 163.47 24.77 Favored Pre-proline 1 N--CA 1.545 4.278 0 CA-C-N 121.322 1.874 . . . . 0.0 112.389 -177.466 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -67.54 -27.48 39.19 Favored 'Trans proline' 0 C--N 1.392 2.85 0 C-N-CA 122.849 2.366 . . . . 0.0 111.287 176.182 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -61.36 -21.57 64.16 Favored 'General case' 1 N--CA 1.54 4.03 0 CA-C-O 118.327 -0.844 . . . . 0.0 111.122 178.627 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -71.27 -38.48 71.85 Favored 'General case' 0 N--CA 1.528 3.446 0 CA-C-N 119.061 0.846 . . . . 0.0 108.923 177.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -79.78 -19.71 47.98 Favored 'General case' 0 N--CA 1.525 3.285 0 CA-C-O 117.792 -1.099 . . . . 0.0 111.126 177.207 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -68.65 -45.89 70.58 Favored 'General case' 0 N--CA 1.539 3.998 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 175.14 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -79.53 -16.41 56.02 Favored 'General case' 0 N--CA 1.509 2.508 0 CA-C-O 117.376 -1.297 . . . . 0.0 110.726 176.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 551' ' ' LEU . . . . . 0.82 HD22 ' CE3' ' A' ' 19' ' ' TRP . 5.7 tp -74.89 -31.54 61.6 Favored 'General case' 0 N--CA 1.528 3.451 0 CA-C-N 120.758 1.617 . . . . 0.0 107.765 174.759 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -70.74 -62.06 3.79 Favored Glycine 0 N--CA 1.5 2.918 0 N-CA-C 109.051 -1.62 . . . . 0.0 109.051 178.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 3.1 m -61.05 -27.37 68.29 Favored 'General case' 1 N--CA 1.54 4.058 0 CA-C-O 118.393 -0.813 . . . . 0.0 112.119 -179.34 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 7.5 mtm180 -69.5 -49.33 55.61 Favored 'General case' 0 N--CA 1.539 3.997 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 176.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 555' ' ' VAL . . . . . 0.556 HG23 ' O ' ' B' ' 551' ' ' LEU . 21.8 t -66.23 -15.51 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.865 0 CA-C-O 118.144 -0.931 . . . . 0.0 109.809 175.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 26.3 mtp180 -77.75 -46.71 20.94 Favored 'General case' 0 N--CA 1.52 3.067 0 CA-C-N 119.568 1.076 . . . . 0.0 110.807 178.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 557' ' ' ILE . . . . . 0.589 ' HB ' HG22 ' B' ' 582' ' ' ILE . 0.0 OUTLIER -71.56 -24.71 23.76 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.502 0 CA-C-N 120.282 1.401 . . . . 0.0 111.084 -179.054 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 558' ' ' VAL . . . . . 0.44 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -87.83 -52.64 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.76 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 -179.07 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -59.88 -22.95 63.02 Favored 'General case' 0 N--CA 1.534 3.741 0 CA-C-O 118.81 -0.614 . . . . 0.0 110.701 178.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -91.51 -28.34 17.65 Favored 'General case' 0 N--CA 1.524 3.249 0 CA-C-O 118.546 -0.74 . . . . 0.0 109.935 177.257 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -68.04 -46.17 71.92 Favored 'General case' 1 N--CA 1.539 4.015 0 CA-C-N 119.224 0.92 . . . . 0.0 109.249 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 33.3 mt -55.88 -25.71 43.78 Favored 'General case' 0 N--CA 1.535 3.781 0 C-N-CA 124.533 1.133 . . . . 0.0 112.234 178.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -82.99 -52.59 6.53 Favored 'General case' 0 N--CA 1.515 2.799 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 179.2 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 80.21 77.34 0.96 Allowed Glycine 0 N--CA 1.512 3.729 0 N-CA-C 110.018 -1.233 . . . . 0.0 110.018 179.556 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -144.61 -60.7 0.37 Allowed 'General case' 0 N--CA 1.523 3.208 0 CA-C-N 117.294 0.547 . . . . 0.0 109.615 -179.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 43.6 mtt -148.86 79.73 1.42 Allowed 'General case' 0 N--CA 1.524 3.251 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 567' ' ' SER . . . . . 0.402 ' HA ' HD22 ' B' ' 571' ' ' LEU . 17.4 m -140.46 -16.13 0.93 Allowed 'General case' 0 N--CA 1.522 3.169 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 -174.191 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -110.75 -53.43 2.7 Favored 'General case' 0 N--CA 1.531 3.6 0 CA-C-N 120.626 1.557 . . . . 0.0 112.159 -177.224 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -106.68 -53.37 2.63 Favored 'General case' 0 N--CA 1.528 3.458 0 C-N-CA 123.116 0.566 . . . . 0.0 110.475 -177.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -74.79 -0.13 17.27 Favored 'General case' 0 N--CA 1.515 2.812 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -177.685 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 571' ' ' LEU . . . . . 0.656 HD23 HG21 ' B' ' 582' ' ' ILE . 42.5 tp -88.64 -49.19 7.02 Favored 'General case' 0 N--CA 1.528 3.469 0 CA-C-N 120.142 1.337 . . . . 0.0 113.682 -177.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -44.39 -46.5 9.49 Favored 'General case' 1 N--CA 1.544 4.252 0 N-CA-C 114.935 1.457 . . . . 0.0 114.935 -175.11 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -62.47 -29.97 70.92 Favored 'General case' 1 N--CA 1.54 4.032 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -177.565 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -54.83 -57.36 11.87 Favored 'General case' 0 N--CA 1.528 3.437 0 C-N-CA 124.056 0.942 . . . . 0.0 112.636 -179.218 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -126.12 -38.99 2.11 Favored 'General case' 0 N--CA 1.533 3.709 0 CA-C-O 118.623 -0.703 . . . . 0.0 111.616 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 123.33 65.66 0.21 Allowed Glycine 1 N--CA 1.519 4.225 0 CA-C-N 118.971 0.805 . . . . 0.0 111.122 179.281 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -120.89 102.76 8.57 Favored 'General case' 0 N--CA 1.518 2.957 0 N-CA-C 105.506 -2.035 . . . . 0.0 105.506 177.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -40.4 162.82 0.01 OUTLIER Glycine 1 N--CA 1.539 5.513 0 C-N-CA 124.758 1.17 . . . . 0.0 114.653 -177.402 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 579' ' ' ILE . . . . . 0.553 HG21 ' N6 ' ' E' ' 4' ' ' ' DA' . 1.1 mt -79.43 -20.59 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.627 0 CA-C-N 119.028 1.414 . . . . 0.0 108.944 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 580' ' ' ALA . . . . . 0.877 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -63.41 -33.53 75.75 Favored 'General case' 0 N--CA 1.53 3.545 0 CA-C-N 120.294 1.406 . . . . 0.0 109.853 175.72 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.8 p -80.24 -52.47 7.7 Favored 'General case' 0 N--CA 1.532 3.638 0 CA-C-N 118.997 0.817 . . . . 0.0 111.578 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 582' ' ' ILE . . . . . 0.656 HG21 HD23 ' B' ' 571' ' ' LEU . 24.2 pt -67.33 -18.7 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.83 0 CA-C-O 117.701 -1.143 . . . . 0.0 113.482 -176.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 61.0 p -107.57 -25.61 11.28 Favored 'General case' 0 N--CA 1.516 2.844 0 CA-C-N 119.814 1.188 . . . . 0.0 110.781 178.395 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 13.8 ptt180 -75.64 -22.27 56.95 Favored 'General case' 0 N--CA 1.532 3.653 0 CA-C-N 120.232 1.378 . . . . 0.0 108.087 174.225 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -69.59 -34.64 73.45 Favored Glycine 0 N--CA 1.513 3.826 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 175.767 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 60.2 p -72.32 -39.59 68.09 Favored 'General case' 0 N--CA 1.536 3.831 0 CA-C-N 118.362 1.081 . . . . 0.0 110.052 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -60.58 -32.59 71.69 Favored 'General case' 1 N--CA 1.541 4.09 0 C-N-CA 123.126 0.571 . . . . 0.0 110.523 179.085 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 1.4 m -58.87 -38.88 79.8 Favored 'General case' 1 N--CA 1.541 4.114 0 C-N-CA 123.436 0.695 . . . . 0.0 110.381 178.488 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 42.1 mt -61.47 -44.91 96.26 Favored 'General case' 0 N--CA 1.525 3.286 0 C-N-CA 123.955 0.902 . . . . 0.0 110.725 179.272 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.92 -26.21 64.14 Favored 'General case' 1 N--CA 1.543 4.202 0 C-N-CA 123.678 0.791 . . . . 0.0 112.158 179.53 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -84.05 -39.99 18.91 Favored 'General case' 0 N--CA 1.517 2.911 0 CA-C-N 118.627 0.649 . . . . 0.0 111.917 -178.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -55.63 161.58 3.07 Favored Pre-proline 1 N--CA 1.546 4.373 0 CA-C-O 118.258 -0.877 . . . . 0.0 113.098 -179.591 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -80.05 -179.89 5.65 Favored 'Trans proline' 0 C--N 1.379 2.171 0 C-N-CA 121.777 1.651 . . . . 0.0 110.355 178.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -97.83 -28.34 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.036 0 CA-C-O 117.865 -1.064 . . . . 0.0 111.489 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -61.1 -44.04 97.97 Favored 'General case' 0 N--CA 1.517 2.903 0 CA-C-N 119.808 1.185 . . . . 0.0 110.373 -178.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 596' ' ' LEU . . . . . 0.474 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.9 mp -99.47 -14.39 19.11 Favored 'General case' 0 N--CA 1.509 2.503 0 CA-C-O 118.653 -0.689 . . . . 0.0 112.023 179.299 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.85 -27.84 66.18 Favored 'General case' 1 N--CA 1.54 4.052 0 N-CA-C 103.35 -2.833 . . . . 0.0 103.35 168.75 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -56.87 -38.76 73.18 Favored 'General case' 0 N--CA 1.519 3.01 0 C-N-CA 123.889 0.876 . . . . 0.0 109.641 173.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 599' ' ' TRP . . . . . 0.611 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 44.0 t90 -63.75 -36.09 82.75 Favored 'General case' 0 N--CA 1.529 3.482 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 177.139 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.28 -37.08 54.51 Favored 'General case' 0 N--CA 1.535 3.803 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 177.073 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -69.9 -38.93 76.44 Favored 'General case' 0 N--CA 1.539 3.983 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 175.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.97 -23.8 48.42 Favored 'General case' 1 N--CA 1.546 4.367 0 C-N-CA 123.199 0.6 . . . . 0.0 110.598 175.295 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 603' ' ' VAL . . . . . 0.553 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.3 OUTLIER -120.57 0.85 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.321 0 CA-C-O 118.351 -0.833 . . . . 0.0 113.159 -176.475 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -112.87 -59.73 1.98 Allowed 'General case' 0 N--CA 1.509 2.522 0 N-CA-C 105.964 -1.865 . . . . 0.0 105.964 176.555 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.29 -40.52 94.47 Favored 'General case' 1 N--CA 1.542 4.138 0 C-N-CA 123.948 0.899 . . . . 0.0 110.552 178.7 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 23.1 tttp 76.75 101.81 0.07 Allowed 'General case' 0 N--CA 1.527 3.395 0 C-N-CA 125.015 1.326 . . . . 0.0 108.884 -179.285 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 75.0 m . . . . . 0 N--CA 1.525 3.296 0 C-N-CA 123.451 0.701 . . . . 0.0 109.854 -179.814 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.112 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.146 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.42 -9.796 3 O4'-C1'-N19 119.549 14.686 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.338 2 O4'-C1'-N19 120.093 15.366 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.419 -9.92 4 O4'-C1'-N19 119.233 14.292 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . 0.974 ' H62' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 5 C3'--C2' 1.416 -10.169 4 O4'-C1'-N19 120.453 15.816 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' E' E ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.574 11.009 4 O4'-C1'-N19 119.855 15.069 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.399 -11.864 6 O4'-C1'-N19 119.427 14.534 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' E' E ' 7' ' ' ' DA' . . . . . 0.521 H2'' " H5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 6 C3'--C2' 1.4 -11.801 4 C4'-C3'-C2' 113.12 9.92 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' E' E ' 8' ' ' ' DG' . . . . . 0.521 " H5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 O3'--C3' 1.563 10.177 2 O4'-C1'-N19 119.82 15.026 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -10.989 5 O4'-C1'-N19 119.996 15.245 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.409 -10.88 5 O4'-C1'-N19 117.784 12.481 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.407 -11.063 6 O4'-C1'-N19 120.385 15.731 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.403 -11.489 2 O4'-C1'-N19 120.768 16.21 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' E' E ' 13' ' ' ' DC' . . . . . 0.476 H2'' " O5'" ' E' ' 14' ' ' ' DT' . . . . . . . . 6 O3'--C3' 1.556 9.643 4 O4'-C1'-N19 119.038 14.047 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' E' E ' 14' ' ' ' DT' . . . . . 0.589 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.404 -11.382 6 O4'-C1'-N19 118.983 13.979 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' E' E ' 15' ' ' ' DA' . . . . . 0.704 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.418 -10.009 5 O4'-C1'-N19 120.014 15.267 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.417 -10.062 5 O4'-C1'-N19 120.279 15.599 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.566 10.396 3 O4'-C1'-N19 119.65 14.812 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.413 -10.478 5 O4'-C1'-N19 120.503 15.879 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.418 5 O4'-C1'-N19 119.805 15.007 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.509 6.836 4 O4'-C1'-N19 119.659 14.824 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.565 10.317 2 C4'-C3'-C2' 116.735 13.535 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.769 5 O4'-C1'-N19 119.926 15.157 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.093 4 O4'-C1'-N19 120.302 15.628 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' F' F ' 4' ' ' ' DA' . . . . . 0.52 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 5 C3'--C2' 1.415 -10.31 4 O4'-C1'-N19 120.944 16.43 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' F' F ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.578 11.3 4 O4'-C1'-N19 118.738 13.672 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.402 -11.601 6 O4'-C1'-N19 119.172 14.215 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C4'--C3' 1.42 -10.81 3 N19-C1'-C2' 131.227 10.642 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.412 -10.627 5 O4'-C1'-N19 119.716 14.896 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.43 5 O4'-C1'-N19 119.282 14.352 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.402 -11.623 4 O4'-C1'-N19 118.084 12.855 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.521 5 O4'-C1'-N19 119.879 15.098 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.402 -11.565 2 O4'-C1'-N19 120.355 15.694 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.553 9.409 4 O4'-C1'-N19 124.167 20.458 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' F' F ' 14' ' ' ' DT' . . . . . 0.715 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 5 C3'--C2' 1.405 -11.332 6 O4'-C1'-N19 120.103 15.379 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' F' F ' 15' ' ' ' DA' . . . . . 0.617 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 5 C3'--C2' 1.426 -9.182 3 O4'-C1'-N19 120.083 15.353 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' F' F ' 16' ' ' ' DG' . . . . . 0.512 ' O6 ' ' HB ' ' B' ' 579' ' ' ILE . . . . . . . . 5 C3'--C2' 1.417 -10.111 4 O4'-C1'-N19 119.973 15.216 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.607 3 O4'-C1'-N19 118.734 13.668 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.383 4 O4'-C1'-N19 119.644 14.804 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.565 10.273 3 O4'-C1'-N19 119.789 14.986 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.511 7.034 4 O4'-C1'-N19 119.817 15.021 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 . . . . . 0 N--CA 1.501 2.106 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.2 t -89.38 133.39 34.88 Favored Pre-proline 0 N--CA 1.524 3.255 0 CA-C-O 117.423 -1.275 . . . . 0.0 109.762 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_endo -68.58 -34.13 20.38 Favored 'Trans proline' 0 C--N 1.391 2.787 0 C-N-CA 122.561 2.174 . . . . 0.0 111.685 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -88.28 130.58 35.07 Favored 'General case' 0 N--CA 1.521 3.09 0 CA-C-N 118.24 0.473 . . . . 0.0 110.048 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 10.6 t -127.17 119.47 26.52 Favored 'General case' 0 N--CA 1.521 3.121 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 178.178 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 68.53 131.01 0.03 OUTLIER 'General case' 1 N--CA 1.542 4.135 0 C-N-CA 123.621 0.768 . . . . 0.0 109.117 -177.179 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.64 -54.64 38.94 Favored 'General case' 1 N--CA 1.543 4.189 0 C-N-CA 122.956 0.502 . . . . 0.0 111.937 -178.482 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 29.7 mtt -115.89 115.21 25.82 Favored 'General case' 0 N--CA 1.517 2.92 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -159.15 132.07 6.99 Favored 'General case' 0 N--CA 1.524 3.23 0 C-N-CA 122.632 0.373 . . . . 0.0 110.896 -179.075 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 64.46 124.17 0.02 OUTLIER 'General case' 0 N--CA 1.538 3.97 0 C-N-CA 124.673 1.189 . . . . 0.0 110.948 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -148.9 129.6 14.12 Favored 'General case' 0 N--CA 1.534 3.736 0 C-N-CA 122.878 0.471 . . . . 0.0 110.008 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 44.0 mtp180 -75.4 139.25 42.23 Favored 'General case' 0 N--CA 1.533 3.681 0 C-N-CA 122.534 0.334 . . . . 0.0 111.3 -178.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -71.69 149.46 45.46 Favored 'General case' 0 N--CA 1.534 3.765 0 C-N-CA 123.128 0.571 . . . . 0.0 111.961 -178.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 43.5 mt-30 -83.12 135.61 34.75 Favored 'General case' 0 N--CA 1.533 3.711 0 C-N-CA 122.792 0.437 . . . . 0.0 110.919 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -122.02 -68.53 0.89 Allowed 'General case' 0 N--CA 1.521 3.112 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 179.796 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.761 ' CE3' HD22 ' B' ' 551' ' ' LEU . 76.4 t-105 -51.37 -44.42 62.1 Favored 'General case' 1 N--CA 1.541 4.093 0 C-N-CA 123.471 0.708 . . . . 0.0 109.736 177.29 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.401 HD22 ' N ' ' A' ' 20' ' ' LEU . 2.3 mm? -77.41 -25.61 50.93 Favored 'General case' 0 N--CA 1.524 3.271 0 CA-C-O 117.557 -1.211 . . . . 0.0 111.745 -177.343 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.0 tpm_? -55.64 -30.54 61.17 Favored 'General case' 1 N--CA 1.544 4.266 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 173.813 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.55 ' HB2' HG21 ' B' ' 555' ' ' VAL . 0.0 OUTLIER -84.89 -37.57 20.46 Favored 'General case' 0 N--CA 1.507 2.411 0 CA-C-O 116.125 -1.893 . . . . 0.0 109.482 173.496 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 22.0 t -70.67 -29.9 40.03 Favored 'Isoleucine or valine' 1 N--CA 1.574 5.769 0 CA-C-N 121.382 1.901 . . . . 0.0 113.475 -174.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -73.05 -50.64 21.83 Favored 'General case' 0 N--CA 1.533 3.719 0 CA-C-N 120.298 1.408 . . . . 0.0 108.3 -179.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.7 mp -72.8 -15.69 61.63 Favored 'General case' 0 N--CA 1.525 3.314 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 175.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.537 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -69.79 -37.0 76.16 Favored 'General case' 0 N--CA 1.517 2.896 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 175.294 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.487 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 35.4 tttt -63.42 -21.68 66.44 Favored 'General case' 0 N--CA 1.522 3.169 0 CA-C-O 118.437 -0.792 . . . . 0.0 111.247 176.633 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -70.6 -41.47 72.27 Favored 'General case' 0 N--CA 1.534 3.768 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 175.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.633 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -88.72 -6.19 57.6 Favored 'General case' 0 N--CA 1.507 2.398 0 CA-C-O 118.676 -0.678 . . . . 0.0 110.908 178.073 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.487 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -83.94 -36.06 23.54 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-N 120.218 1.372 . . . . 0.0 108.52 179.486 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -61.08 -39.06 88.46 Favored 'General case' 0 N--CA 1.532 3.658 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 177.072 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -97.32 -85.45 0.36 Allowed 'General case' 0 N--CA 1.516 2.872 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 177.318 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p30 149.78 51.97 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.044 0 C-N-CA 127.515 2.326 . . . . 0.0 107.982 178.312 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.488 HD22 ' CD2' ' B' ' 596' ' ' LEU . 7.3 mt -112.32 11.56 20.1 Favored 'General case' 0 N--CA 1.532 3.652 0 C-N-CA 123.74 0.816 . . . . 0.0 111.354 -178.161 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.56 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 52.8 p-80 -81.4 0.29 38.12 Favored 'General case' 0 N--CA 1.518 2.966 0 C-N-CA 123.381 0.672 . . . . 0.0 109.473 174.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.463 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 22.8 mt -91.3 -50.98 0.31 Allowed Pre-proline 0 N--CA 1.51 2.555 0 C-N-CA 125.266 1.426 . . . . 0.0 109.148 -176.333 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.463 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 9.1 Cg_exo -62.11 -39.9 45.97 Favored 'Trans proline' 0 C--N 1.386 2.523 0 N-CA-C 106.428 -2.182 . . . . 0.0 106.428 170.305 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.458 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.3 OUTLIER -56.59 -38.64 72.29 Favored 'General case' 0 N--CA 1.531 3.606 0 C-N-CA 123.928 0.891 . . . . 0.0 109.736 176.11 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.648 HD11 ' CE2' ' B' ' 519' ' ' TRP . 3.0 mt -60.08 -42.25 94.2 Favored 'General case' 1 N--CA 1.561 5.093 0 CA-C-N 119.478 1.035 . . . . 0.0 109.237 175.979 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -63.27 -25.62 68.4 Favored 'General case' 1 N--CA 1.544 4.244 0 CA-C-O 118.614 -0.707 . . . . 0.0 112.732 -179.646 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.803 HD11 ' HB2' ' B' ' 592' ' ' ALA . 7.8 mp -81.19 -41.14 22.79 Favored 'General case' 0 N--CA 1.534 3.771 0 CA-C-N 118.827 0.74 . . . . 0.0 109.112 -179.357 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 11.9 ptt? -97.82 44.29 1.05 Allowed 'General case' 0 N--CA 1.53 3.537 0 N-CA-C 104.05 -2.574 . . . . 0.0 104.05 173.039 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.9 tp -30.73 -103.64 0.0 OUTLIER 'General case' 0 N--CA 1.531 3.611 0 C-N-CA 127.338 2.255 . . . . 0.0 115.41 -173.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 54.0 p 52.5 126.94 0.0 OUTLIER Pre-proline 0 N--CA 1.535 3.795 0 CA-C-N 120.624 1.557 . . . . 0.0 111.69 -178.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -62.09 -32.06 83.46 Favored 'Trans proline' 0 C--N 1.382 2.316 0 C-N-CA 121.27 1.313 . . . . 0.0 110.335 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -48.85 -21.78 0.7 Allowed 'General case' 1 N--CA 1.551 4.585 0 C-N-CA 124.394 1.078 . . . . 0.0 113.71 178.513 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -62.45 -73.81 0.1 Allowed 'General case' 0 N--CA 1.538 3.936 0 CA-C-N 119.671 1.123 . . . . 0.0 110.522 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -89.64 6.18 42.45 Favored 'General case' 0 N--CA 1.535 3.806 0 CA-C-N 119.806 1.184 . . . . 0.0 111.837 177.3 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -86.67 -30.77 21.48 Favored 'General case' 0 N--CA 1.518 2.975 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 172.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.88 -48.71 6.85 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.472 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 13.1 tp -65.06 -28.77 69.7 Favored 'General case' 1 N--CA 1.54 4.071 0 CA-C-N 119.98 1.263 . . . . 0.0 107.853 175.304 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.441 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -68.46 -73.72 0.67 Allowed Glycine 0 N--CA 1.505 3.262 0 C-N-CA 124.474 1.035 . . . . 0.0 112.64 177.343 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.5 m -69.78 -29.0 66.21 Favored 'General case' 0 N--CA 1.537 3.915 0 CA-C-O 117.989 -1.005 . . . . 0.0 113.418 -175.643 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.413 ' O ' HD13 ' A' ' 57' ' ' ILE . 6.6 mtt180 -73.39 -46.89 46.19 Favored 'General case' 0 N--CA 1.53 3.532 0 CA-C-N 120.179 1.354 . . . . 0.0 107.644 178.079 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.5 t -66.18 -16.96 21.57 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.9 0 O-C-N 120.648 -1.282 . . . . 0.0 109.41 174.345 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.32 -51.48 20.5 Favored 'General case' 0 N--CA 1.529 3.51 0 CA-C-N 120.022 1.283 . . . . 0.0 111.499 177.752 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.462 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -71.84 -23.57 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.51 0 CA-C-N 120.336 1.426 . . . . 0.0 112.123 -177.916 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.7 HG11 HD11 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -86.11 -51.51 13.15 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.088 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 -179.697 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -58.57 -25.0 62.07 Favored 'General case' 0 N--CA 1.538 3.931 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.505 178.002 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -94.45 -24.3 17.37 Favored 'General case' 0 N--CA 1.526 3.341 0 CA-C-O 118.303 -0.856 . . . . 0.0 110.859 177.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 20.7 tp -79.14 -70.2 0.52 Allowed 'General case' 0 N--CA 1.529 3.506 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.8 mt -42.84 -31.93 0.55 Allowed 'General case' 1 N--CA 1.544 4.232 0 C-N-CA 125.163 1.385 . . . . 0.0 113.683 -178.536 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.7 mmm180 -87.99 -43.33 11.82 Favored 'General case' 0 N--CA 1.526 3.345 0 CA-C-O 119.149 -0.453 . . . . 0.0 110.115 -179.166 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.37 87.12 0.59 Allowed Glycine 1 N--CA 1.517 4.097 0 N-CA-C 110.678 -0.969 . . . . 0.0 110.678 178.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -148.68 -54.53 0.19 Allowed 'General case' 0 N--CA 1.522 3.146 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.334 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 76.3 mtm -148.42 83.12 1.48 Allowed 'General case' 0 N--CA 1.516 2.83 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.8 t -146.95 14.9 1.18 Allowed 'General case' 0 N--CA 1.528 3.436 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -178.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -116.29 -72.18 0.7 Allowed 'General case' 0 N--CA 1.526 3.341 0 CA-C-N 119.154 0.888 . . . . 0.0 111.097 179.054 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -110.86 -46.29 3.37 Favored 'General case' 0 N--CA 1.522 3.149 0 C-N-CA 123.278 0.631 . . . . 0.0 110.135 -178.054 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -68.17 -14.62 63.12 Favored 'General case' 0 N--CA 1.517 2.892 0 CA-C-O 117.866 -1.064 . . . . 0.0 113.441 -178.305 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.73 HD23 HG21 ' A' ' 82' ' ' ILE . 13.6 tp -76.89 -60.34 2.4 Favored 'General case' 0 N--CA 1.529 3.485 0 CA-C-N 120.117 1.326 . . . . 0.0 112.701 -177.784 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -39.03 -32.63 0.09 Allowed 'General case' 1 N--CA 1.552 4.67 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -177.783 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -72.78 -44.64 61.31 Favored 'General case' 0 N--CA 1.532 3.642 0 CA-C-N 118.361 0.528 . . . . 0.0 110.46 -178.561 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -41.34 -51.65 3.63 Favored 'General case' 1 N--CA 1.541 4.094 0 C-N-CA 125.548 1.539 . . . . 0.0 113.39 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.99 -77.2 0.59 Allowed 'General case' 0 N--CA 1.532 3.674 0 CA-C-O 118.739 -0.648 . . . . 0.0 109.374 -179.703 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 157.63 45.89 0.01 OUTLIER Glycine 1 N--CA 1.522 4.38 0 CA-C-O 119.177 -0.79 . . . . 0.0 111.522 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -113.3 113.48 25.34 Favored 'General case' 0 N--CA 1.514 2.755 0 N-CA-C 107.4 -1.334 . . . . 0.0 107.4 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -44.67 176.24 0.01 OUTLIER Glycine 1 N--CA 1.541 5.652 0 C-N-CA 124.966 1.27 . . . . 0.0 115.184 -177.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.52 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 3.4 mt -81.55 -18.81 11.36 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.913 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 177.183 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.704 ' HB2' ' H62' ' E' ' 15' ' ' ' DA' . . . -75.43 -0.19 19.2 Favored 'General case' 0 N--CA 1.513 2.694 0 CA-C-O 117.86 -1.067 . . . . 0.0 111.084 174.243 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.74 -47.94 3.91 Favored 'General case' 0 N--CA 1.536 3.864 0 CA-C-N 120.758 1.617 . . . . 0.0 109.283 176.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.73 HG21 HD23 ' A' ' 71' ' ' LEU . 0.1 OUTLIER -66.16 -41.01 88.56 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.912 0 CA-C-O 118.938 -0.553 . . . . 0.0 111.373 -178.192 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 50.3 p -82.64 -26.28 32.33 Favored 'General case' 0 N--CA 1.519 2.991 0 CA-C-O 118.743 -0.646 . . . . 0.0 109.991 178.46 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.6 ttp180 -65.15 -35.16 80.22 Favored 'General case' 1 N--CA 1.544 4.264 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 175.5 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -56.56 -36.61 71.66 Favored Glycine 1 N--CA 1.529 4.849 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 176.694 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 14.7 m -62.25 -41.43 98.43 Favored 'General case' 1 N--CA 1.542 4.158 0 CA-C-N 117.552 0.676 . . . . 0.0 110.181 177.526 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -61.67 -32.72 72.92 Favored 'General case' 1 N--CA 1.541 4.084 0 C-N-CA 123.893 0.877 . . . . 0.0 112.219 -179.677 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 2.5 m -68.32 -39.43 81.96 Favored 'General case' 1 N--CA 1.54 4.026 0 CA-C-N 118.311 0.505 . . . . 0.0 111.07 -178.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.4 mt -59.35 -40.46 86.47 Favored 'General case' 0 N--CA 1.528 3.471 0 C-N-CA 123.764 0.826 . . . . 0.0 111.588 -179.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -56.82 -28.69 61.87 Favored 'General case' 1 N--CA 1.543 4.219 0 CA-C-O 118.771 -0.633 . . . . 0.0 112.064 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.96 -38.0 21.55 Favored 'General case' 0 N--CA 1.516 2.874 0 CA-C-N 118.323 0.51 . . . . 0.0 111.216 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.11 161.86 0.68 Allowed Pre-proline 1 N--CA 1.548 4.434 0 CA-C-O 118.206 -0.902 . . . . 0.0 112.897 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -81.64 170.73 14.03 Favored 'Trans proline' 0 C--N 1.379 2.155 0 C-N-CA 121.687 1.591 . . . . 0.0 110.72 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.44 ' HA ' ' HB3' ' A' ' 97' ' ' ARG . 2.8 t -95.34 -29.08 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.029 0 CA-C-O 117.92 -1.038 . . . . 0.0 111.076 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -62.3 -42.61 99.5 Favored 'General case' 0 N--CA 1.513 2.685 0 CA-C-N 119.764 1.166 . . . . 0.0 109.962 -179.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.528 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.2 mp -98.84 -14.04 19.82 Favored 'General case' 0 N--CA 1.508 2.47 0 CA-C-O 118.302 -0.856 . . . . 0.0 112.221 179.072 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.44 ' HB3' ' HA ' ' A' ' 94' ' ' VAL . 0.1 OUTLIER -67.42 -30.57 70.35 Favored 'General case' 1 N--CA 1.549 4.522 0 N-CA-C 102.728 -3.064 . . . . 0.0 102.728 168.254 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -57.04 -39.59 75.14 Favored 'General case' 0 N--CA 1.517 2.914 0 C-N-CA 123.871 0.868 . . . . 0.0 110.201 174.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.658 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 47.8 t90 -65.1 -33.96 77.27 Favored 'General case' 0 N--CA 1.527 3.407 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 177.355 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.23 -36.68 61.3 Favored 'General case' 0 N--CA 1.538 3.928 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 176.429 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -69.51 -38.7 77.69 Favored 'General case' 1 N--CA 1.54 4.052 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 175.213 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.42 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 1.2 mm-40 -59.17 -23.99 62.69 Favored 'General case' 1 N--CA 1.546 4.341 0 C-N-CA 123.4 0.68 . . . . 0.0 110.63 175.865 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.508 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -113.37 -2.9 10.66 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.348 0 CA-C-O 118.11 -0.947 . . . . 0.0 112.399 -176.947 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 54.5 mt -102.99 -62.24 1.3 Allowed 'General case' 0 N--CA 1.527 3.378 0 N-CA-C 105.088 -2.19 . . . . 0.0 105.088 174.186 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.6 tp -54.83 -33.3 61.53 Favored 'General case' 0 N--CA 1.53 3.538 0 C-N-CA 125.077 1.351 . . . . 0.0 111.384 177.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.8 mttp 70.01 5.04 5.09 Favored 'General case' 1 N--CA 1.539 4.008 0 C-N-CA 124.987 1.315 . . . . 0.0 113.364 -179.765 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.525 3.295 0 CA-C-N 119.791 1.178 . . . . 0.0 110.07 178.837 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 . . . . . 0 N--CA 1.508 2.445 0 CA-C-O 119.653 -0.213 . . . . 0.0 110.851 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 37.4 p -84.39 123.66 74.6 Favored Pre-proline 0 N--CA 1.527 3.392 0 CA-C-O 117.248 -1.358 . . . . 0.0 109.499 179.584 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -73.95 -1.93 11.55 Favored 'Trans proline' 0 CA--C 1.579 2.734 0 C-N-CA 122.452 2.101 . . . . 0.0 113.445 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 67.67 117.67 0.03 OUTLIER 'General case' 0 N--CA 1.537 3.897 0 CA-C-N 120.016 1.28 . . . . 0.0 108.933 -177.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 7.1 t -117.28 -43.38 2.84 Favored 'General case' 0 N--CA 1.53 3.546 0 CA-C-O 118.969 -0.539 . . . . 0.0 111.238 -178.555 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -93.62 126.63 38.89 Favored 'General case' 0 N--CA 1.523 3.219 0 CA-C-N 118.294 0.497 . . . . 0.0 110.158 -179.025 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . 64.56 139.73 0.02 OUTLIER 'General case' 0 N--CA 1.537 3.91 0 C-N-CA 124.519 1.128 . . . . 0.0 111.77 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 17.5 ptt? -103.38 -40.44 6.38 Favored 'General case' 0 N--CA 1.527 3.422 0 CA-C-O 119.074 -0.488 . . . . 0.0 110.17 179.299 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -156.45 139.3 15.25 Favored 'General case' 0 N--CA 1.523 3.213 0 CA-C-N 118.063 0.392 . . . . 0.0 111.618 -179.524 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -106.5 126.69 52.57 Favored 'General case' 0 N--CA 1.523 3.206 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.346 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -99.69 -54.23 2.98 Favored 'General case' 0 N--CA 1.528 3.444 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -178.743 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? 63.06 123.57 0.01 OUTLIER 'General case' 0 N--CA 1.536 3.864 0 C-N-CA 124.308 1.043 . . . . 0.0 112.3 178.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 3.4 t-80 62.16 136.56 0.01 OUTLIER 'General case' 0 N--CA 1.535 3.816 0 C-N-CA 124.85 1.26 . . . . 0.0 112.848 177.554 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -112.26 124.92 53.51 Favored 'General case' 0 N--CA 1.522 3.165 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 177.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -95.87 -71.03 0.69 Allowed 'General case' 0 N--CA 1.522 3.137 0 CA-C-O 118.66 -0.686 . . . . 0.0 110.924 -178.282 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 519' ' ' TRP . . . . . 0.648 ' CE2' HD11 ' A' ' 39' ' ' LEU . 70.8 t-105 -43.7 -28.68 0.43 Allowed 'General case' 1 N--CA 1.55 4.559 0 N-CA-C 113.658 0.985 . . . . 0.0 113.658 -178.542 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 520' ' ' LEU . . . . . 0.605 ' N ' HD22 ' B' ' 520' ' ' LEU . 2.1 mm? -97.76 -28.34 13.92 Favored 'General case' 0 N--CA 1.529 3.485 0 CA-C-O 117.637 -1.173 . . . . 0.0 113.715 -172.856 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -63.05 -24.84 68.1 Favored 'General case' 1 N--CA 1.54 4.039 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 171.355 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 522' ' ' PHE . . . . . 0.558 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.5 m-85 -76.73 -41.54 44.7 Favored 'General case' 0 N--CA 1.513 2.724 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 173.872 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 43.4 t -67.12 -22.51 29.38 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.25 0 CA-C-O 117.645 -1.169 . . . . 0.0 112.631 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -78.03 -51.45 10.31 Favored 'General case' 0 N--CA 1.528 3.44 0 CA-C-N 120.202 1.364 . . . . 0.0 109.153 -177.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 525' ' ' LEU . . . . . 0.454 HD23 ' HB ' ' A' ' 103' ' ' VAL . 5.0 mp -75.71 -18.84 59.46 Favored 'General case' 0 N--CA 1.524 3.249 0 O-C-N 123.395 0.434 . . . . 0.0 109.979 176.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 526' ' ' LEU . . . . . 0.444 HD23 ' O ' ' B' ' 522' ' ' PHE . 0.4 OUTLIER -71.89 -32.84 67.83 Favored 'General case' 0 N--CA 1.524 3.228 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 173.873 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -65.02 -26.35 68.23 Favored 'General case' 0 N--CA 1.518 2.966 0 CA-C-O 118.398 -0.81 . . . . 0.0 110.386 176.173 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -66.6 -41.93 87.67 Favored 'General case' 1 N--CA 1.54 4.071 0 CA-C-N 119.088 0.858 . . . . 0.0 108.861 176.715 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 529' ' ' ALA . . . . . 0.658 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -88.11 -10.47 49.96 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 118.035 -0.983 . . . . 0.0 111.548 178.855 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -81.31 -34.3 31.99 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-N 120.925 1.693 . . . . 0.0 108.864 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -60.31 -43.02 96.71 Favored 'General case' 0 N--CA 1.538 3.972 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 177.391 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 61.5 m-80 -92.96 -85.81 0.26 Allowed 'General case' 0 N--CA 1.516 2.864 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 177.142 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.9 p30 150.14 48.98 0.0 OUTLIER 'General case' 1 N--CA 1.559 5.017 0 C-N-CA 127.89 2.476 . . . . 0.0 108.245 177.658 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 534' ' ' LEU . . . . . 0.528 HD22 ' CD2' ' A' ' 96' ' ' LEU . 6.0 mt -105.45 7.7 33.21 Favored 'General case' 0 N--CA 1.53 3.564 0 C-N-CA 124.3 1.04 . . . . 0.0 111.012 -179.339 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 535' ' ' HIS . . . . . 0.615 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 46.6 p-80 -82.52 0.47 42.39 Favored 'General case' 0 N--CA 1.508 2.469 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 175.103 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 536' ' ' LEU . . . . . . . . . . . . . 42.5 mt -92.93 -49.16 0.29 Allowed Pre-proline 0 N--CA 1.508 2.458 0 CA-C-O 116.391 -1.766 . . . . 0.0 109.282 -176.023 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 537' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -67.11 -37.01 19.9 Favored 'Trans proline' 0 C--N 1.394 2.921 0 N-CA-C 107.179 -1.893 . . . . 0.0 107.179 171.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.85 -43.69 98.0 Favored 'General case' 0 N--CA 1.529 3.507 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 176.455 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 11.6 mt -66.36 -31.04 71.57 Favored 'General case' 0 N--CA 1.537 3.893 0 CA-C-O 118.865 -0.588 . . . . 0.0 110.781 179.323 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -54.63 -23.48 17.28 Favored 'General case' 1 N--CA 1.542 4.158 0 CA-C-N 118.952 0.796 . . . . 0.0 111.996 178.701 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 541' ' ' LEU . . . . . 0.7 HD11 HG11 ' A' ' 58' ' ' VAL . 0.0 OUTLIER -102.18 -41.34 6.43 Favored 'General case' 0 N--CA 1.519 2.98 0 C-N-CA 123.734 0.814 . . . . 0.0 109.297 -179.553 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 542' ' ' MET . . . . . 0.665 ' N ' HD13 ' B' ' 541' ' ' LEU . 4.3 ptt? -101.46 25.11 8.74 Favored 'General case' 1 N--CA 1.541 4.108 0 CA-C-N 119.061 0.846 . . . . 0.0 112.789 -178.427 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 543' ' ' LEU . . . . . 0.409 ' O ' HG23 ' B' ' 544' ' ' THR . 18.7 tp -131.64 -96.43 0.34 Allowed 'General case' 0 N--CA 1.536 3.84 0 CA-C-O 117.559 -1.21 . . . . 0.0 112.67 178.465 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 544' ' ' THR . . . . . 0.409 HG23 ' O ' ' B' ' 543' ' ' LEU . 18.1 p 129.14 140.23 0.0 OUTLIER Pre-proline 1 N--CA 1.558 4.952 0 C-N-CA 128.727 2.811 . . . . 0.0 106.94 -177.145 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -57.49 -32.56 94.5 Favored 'Trans proline' 0 N--CA 1.521 3.098 0 C-N-CA 122.84 2.36 . . . . 0.0 113.368 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -63.17 -34.76 78.32 Favored 'General case' 1 N--CA 1.539 4.024 0 CA-C-O 118.886 -0.578 . . . . 0.0 111.02 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -68.67 -40.97 79.91 Favored 'General case' 0 N--CA 1.53 3.534 0 CA-C-O 118.469 -0.777 . . . . 0.0 110.759 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 19.8 ptt180 -76.21 -20.5 57.41 Favored 'General case' 0 N--CA 1.529 3.519 0 CA-C-O 118.045 -0.979 . . . . 0.0 111.592 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -69.17 -44.26 72.57 Favored 'General case' 0 N--CA 1.536 3.842 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 174.248 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -80.18 -11.12 59.77 Favored 'General case' 0 N--CA 1.512 2.66 0 CA-C-O 117.736 -1.126 . . . . 0.0 111.538 177.419 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 551' ' ' LEU . . . . . 0.761 HD22 ' CE3' ' A' ' 19' ' ' TRP . 10.2 tp -77.23 -44.04 31.41 Favored 'General case' 0 N--CA 1.528 3.43 0 CA-C-N 120.779 1.627 . . . . 0.0 107.827 176.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -69.78 -49.23 37.22 Favored Glycine 0 N--CA 1.506 3.309 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 553' ' ' THR . . . . . 0.458 HG21 ' HB2' ' B' ' 577' ' ' ALA . 2.6 m -65.21 -33.81 76.88 Favored 'General case' 0 N--CA 1.532 3.667 0 CA-C-O 118.535 -0.745 . . . . 0.0 112.037 -178.752 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 22.6 mtt180 -65.31 -52.34 54.71 Favored 'General case' 1 N--CA 1.541 4.082 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 176.294 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 555' ' ' VAL . . . . . 0.55 HG21 ' HB2' ' A' ' 22' ' ' PHE . 17.5 t -64.86 -16.81 20.51 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.806 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.559 177.558 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 11.4 mmt180 -79.11 -43.49 23.98 Favored 'General case' 0 N--CA 1.52 3.03 0 CA-C-N 119.884 1.22 . . . . 0.0 110.5 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 557' ' ' ILE . . . . . 0.537 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -75.94 -25.68 17.23 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.93 0 CA-C-N 120.124 1.329 . . . . 0.0 111.421 -178.89 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 558' ' ' VAL . . . . . 0.537 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -86.43 -51.42 13.16 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.902 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 -178.708 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -61.08 -28.28 68.97 Favored 'General case' 0 N--CA 1.527 3.381 0 CA-C-O 118.6 -0.714 . . . . 0.0 110.326 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -89.49 -22.64 22.36 Favored 'General case' 0 N--CA 1.522 3.156 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.326 177.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.14 -46.62 70.31 Favored 'General case' 1 N--CA 1.543 4.185 0 CA-C-N 119.749 1.159 . . . . 0.0 108.379 177.503 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 15.2 mt -50.25 -28.61 7.97 Favored 'General case' 0 N--CA 1.537 3.911 0 C-N-CA 124.048 0.939 . . . . 0.0 111.978 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 24.8 mmm180 -82.61 -52.73 6.54 Favored 'General case' 0 N--CA 1.526 3.369 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.342 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 66.02 83.71 0.1 OUTLIER Glycine 1 N--CA 1.524 4.559 0 CA-C-O 119.308 -0.718 . . . . 0.0 112.949 177.729 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -161.8 -52.26 0.04 OUTLIER 'General case' 0 N--CA 1.528 3.46 0 CA-C-N 117.581 0.69 . . . . 0.0 109.729 178.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 86.9 mtp -145.02 54.53 1.22 Allowed 'General case' 0 N--CA 1.525 3.299 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 75.7 p -130.75 -4.88 4.09 Favored 'General case' 0 N--CA 1.522 3.16 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -176.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -107.29 -57.81 2.03 Favored 'General case' 0 N--CA 1.527 3.387 0 CA-C-N 119.938 1.244 . . . . 0.0 111.238 -178.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 3.5 ttm180 -99.53 -51.4 3.78 Favored 'General case' 0 N--CA 1.529 3.512 0 C-N-CA 123.234 0.613 . . . . 0.0 110.617 -177.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -73.73 3.77 6.03 Favored 'General case' 0 N--CA 1.515 2.797 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -176.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 571' ' ' LEU . . . . . 0.556 HD23 HD11 ' B' ' 582' ' ' ILE . 45.8 tp -91.12 -56.01 3.32 Favored 'General case' 0 N--CA 1.526 3.349 0 CA-C-N 120.219 1.372 . . . . 0.0 113.299 -178.585 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -30.12 -34.19 0.01 OUTLIER 'General case' 1 N--CA 1.551 4.615 0 N-CA-C 117.662 2.468 . . . . 0.0 117.662 -174.67 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -55.23 -20.36 10.63 Favored 'General case' 1 N--CA 1.545 4.276 0 CA-C-N 119.155 0.889 . . . . 0.0 112.779 -179.331 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -101.95 -83.1 0.47 Allowed 'General case' 0 N--CA 1.509 2.485 0 C-N-CA 124.287 1.035 . . . . 0.0 109.143 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 55.4 mt -139.17 17.85 2.6 Favored 'General case' 0 N--CA 1.53 3.529 0 CA-C-N 119.14 0.882 . . . . 0.0 111.51 -179.086 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . -47.68 -28.75 5.39 Favored Glycine 1 N--CA 1.548 6.138 0 O-C-N 120.866 -1.146 . . . . 0.0 113.851 -179.164 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 577' ' ' ALA . . . . . 0.458 ' HB2' HG21 ' B' ' 553' ' ' THR . . . 67.5 39.99 2.72 Favored 'General case' 1 N--CA 1.545 4.288 0 CA-C-N 118.539 1.17 . . . . 0.0 112.071 178.523 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 86.21 167.4 43.51 Favored Glycine 1 N--CA 1.519 4.195 0 CA-C-O 119.449 -0.639 . . . . 0.0 112.317 178.182 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 579' ' ' ILE . . . . . 0.974 HG21 ' H62' ' E' ' 4' ' ' ' DA' . 36.2 mm -84.63 -17.79 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.709 0 CA-C-N 118.621 1.21 . . . . 0.0 108.466 176.194 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 580' ' ' ALA . . . . . 0.715 ' HB3' ' H72' ' F' ' 14' ' ' ' DT' . . . -63.82 -39.39 94.12 Favored 'General case' 0 N--CA 1.523 3.218 0 CA-C-N 120.17 1.35 . . . . 0.0 110.097 177.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 15.2 p -77.44 -40.69 42.48 Favored 'General case' 1 N--CA 1.542 4.134 0 CA-C-N 119.208 0.913 . . . . 0.0 111.64 178.661 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 582' ' ' ILE . . . . . 0.556 HD11 HD23 ' B' ' 571' ' ' LEU . 1.1 tt -63.31 -36.8 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.258 0 C-N-CA 123.563 0.745 . . . . 0.0 112.682 -175.082 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 41.3 p -99.24 -30.15 12.42 Favored 'General case' 0 N--CA 1.513 2.722 0 CA-C-O 118.053 -0.975 . . . . 0.0 111.428 -178.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 21.3 ptt180 -71.91 -22.66 61.45 Favored 'General case' 0 N--CA 1.533 3.676 0 CA-C-N 119.891 1.223 . . . . 0.0 109.411 175.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -77.99 -28.06 57.17 Favored Glycine 0 N--CA 1.511 3.662 0 N-CA-C 109.428 -1.469 . . . . 0.0 109.428 176.065 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 10.9 m -63.16 -40.35 97.31 Favored 'General case' 0 N--CA 1.537 3.9 0 CA-C-N 118.239 1.019 . . . . 0.0 111.074 179.584 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -61.24 -24.93 66.72 Favored 'General case' 1 N--CA 1.54 4.03 0 CA-C-O 118.783 -0.627 . . . . 0.0 112.318 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 7.8 m -64.12 -41.88 97.07 Favored 'General case' 1 N--CA 1.541 4.093 0 CA-C-N 118.726 0.694 . . . . 0.0 110.663 179.46 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 42.1 mt -54.7 -43.3 72.41 Favored 'General case' 0 N--CA 1.531 3.588 0 C-N-CA 124.406 1.082 . . . . 0.0 111.944 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.86 -31.98 73.12 Favored 'General case' 1 N--CA 1.541 4.117 0 C-N-CA 123.339 0.656 . . . . 0.0 112.382 -178.83 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -74.35 -35.1 63.55 Favored 'General case' 0 N--CA 1.525 3.281 0 CA-C-N 118.352 0.524 . . . . 0.0 111.983 -179.306 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 592' ' ' ALA . . . . . 0.803 ' HB2' HD11 ' A' ' 41' ' ' LEU . . . -45.07 163.61 0.2 Allowed Pre-proline 1 N--CA 1.548 4.452 0 N-CA-C 115.207 1.558 . . . . 0.0 115.207 -178.837 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 593' ' ' PRO . . . . . 0.44 ' O ' ' HB2' ' B' ' 597' ' ' ARG . 60.1 Cg_endo -86.81 173.82 5.89 Favored 'Trans proline' 0 C--N 1.38 2.229 0 C-N-CA 122.125 1.884 . . . . 0.0 107.407 174.508 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.9 t -98.92 -27.62 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.311 0 CA-C-N 120.188 1.358 . . . . 0.0 111.662 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -62.55 -43.4 98.91 Favored 'General case' 0 N--CA 1.517 2.905 0 CA-C-N 120.079 1.309 . . . . 0.0 110.792 -178.232 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 596' ' ' LEU . . . . . 0.488 ' CD2' HD22 ' A' ' 34' ' ' LEU . 7.2 mp -99.97 -14.35 18.72 Favored 'General case' 0 N--CA 1.511 2.61 0 CA-C-O 118.723 -0.656 . . . . 0.0 112.26 179.382 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 597' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' B' ' 593' ' ' PRO . 0.0 OUTLIER -68.07 -30.17 69.3 Favored 'General case' 0 N--CA 1.538 3.927 0 N-CA-C 103.245 -2.872 . . . . 0.0 103.245 168.412 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -54.73 -37.97 66.55 Favored 'General case' 0 N--CA 1.521 3.115 0 C-N-CA 123.868 0.867 . . . . 0.0 110.094 173.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 599' ' ' TRP . . . . . 0.633 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 43.3 t90 -63.06 -38.41 91.07 Favored 'General case' 0 N--CA 1.536 3.828 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 177.262 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.85 -36.86 59.49 Favored 'General case' 0 N--CA 1.535 3.796 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 177.24 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -70.12 -36.24 74.67 Favored 'General case' 1 N--CA 1.541 4.117 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 175.699 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -62.27 -23.82 66.92 Favored 'General case' 1 N--CA 1.543 4.199 0 C-N-CA 123.619 0.768 . . . . 0.0 110.402 176.229 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 603' ' ' VAL . . . . . 0.51 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.1 OUTLIER -115.73 9.79 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.497 0 C-N-CA 123.163 0.585 . . . . 0.0 111.832 -177.501 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 26.7 mt -110.03 -63.1 1.42 Allowed 'General case' 0 N--CA 1.519 2.977 0 N-CA-C 105.281 -2.118 . . . . 0.0 105.281 175.554 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.57 -45.22 60.25 Favored 'General case' 0 N--CA 1.525 3.285 0 C-N-CA 124.484 1.114 . . . . 0.0 109.932 179.395 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 57.9 mttp 69.04 97.02 0.06 Allowed 'General case' 0 N--CA 1.527 3.394 0 C-N-CA 124.786 1.234 . . . . 0.0 108.766 -178.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 52.9 p . . . . . 0 N--CA 1.524 3.261 0 CA-C-O 118.184 -0.912 . . . . 0.0 110.347 -178.671 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.209 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.049 0 CA-C-O 118.099 -0.953 . . . . 0.0 108.441 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.47 ' O ' HD21 ' B' ' 551' ' ' LEU . 44.2 mt-10 . . . . . 0 N--CA 1.531 3.594 0 N-CA-C 106.908 -1.516 . . . . 0.0 106.908 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.711 ' N ' HD11 ' B' ' 551' ' ' LEU . 68.5 t-105 -57.23 -21.09 31.44 Favored 'General case' 0 N--CA 1.534 3.771 0 CA-C-O 118.073 -0.965 . . . . 0.0 111.76 175.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.563 HD22 ' N ' ' A' ' 20' ' ' LEU . 2.3 mm? -91.29 -30.6 16.5 Favored 'General case' 0 N--CA 1.529 3.476 0 CA-C-O 118.182 -0.913 . . . . 0.0 111.861 -177.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.9 mtt180 -64.12 -26.82 68.71 Favored 'General case' 0 N--CA 1.535 3.796 0 N-CA-C 106.122 -1.807 . . . . 0.0 106.122 172.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.465 ' O ' HD23 ' A' ' 26' ' ' LEU . 9.4 t80 -83.21 -32.74 26.36 Favored 'General case' 0 N--CA 1.506 2.361 0 CA-C-O 116.739 -1.6 . . . . 0.0 108.564 174.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.687 HG23 ' O ' ' A' ' 19' ' ' TRP . 61.3 t -76.25 -25.25 16.55 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.227 0 CA-C-N 121.682 2.037 . . . . 0.0 112.885 -177.933 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -77.97 -43.79 28.64 Favored 'General case' 0 N--CA 1.532 3.648 0 CA-C-N 120.454 1.479 . . . . 0.0 108.83 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.4 mp -71.43 -27.2 63.12 Favored 'General case' 0 N--CA 1.53 3.557 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 176.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.465 HD23 ' O ' ' A' ' 22' ' ' PHE . 1.2 mm? -67.57 -35.82 79.76 Favored 'General case' 0 N--CA 1.53 3.55 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 176.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.9 ttmt -68.66 -25.68 64.94 Favored 'General case' 0 N--CA 1.515 2.781 0 CA-C-O 118.074 -0.965 . . . . 0.0 110.931 177.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -70.39 -38.51 74.71 Favored 'General case' 0 N--CA 1.533 3.676 0 CA-C-N 119.435 1.016 . . . . 0.0 109.434 178.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.555 ' HB1' ' N ' ' A' ' 35' ' ' HIS . . . -89.59 -8.85 51.71 Favored 'General case' 0 N--CA 1.499 2.02 0 CA-C-O 118.371 -0.823 . . . . 0.0 110.762 178.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -79.01 -33.82 44.55 Favored 'General case' 0 N--CA 1.53 3.526 0 CA-C-N 120.136 1.335 . . . . 0.0 108.994 179.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -65.61 -43.74 88.69 Favored 'General case' 0 N--CA 1.535 3.818 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 66.9 m-80 -88.28 -88.7 0.14 Allowed 'General case' 0 N--CA 1.513 2.704 0 N-CA-C 106.341 -1.726 . . . . 0.0 106.341 176.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.8 p30 152.9 48.46 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.039 0 C-N-CA 127.318 2.247 . . . . 0.0 108.418 177.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.439 HD22 ' CD2' ' B' ' 596' ' ' LEU . 6.6 mt -109.99 14.06 23.15 Favored 'General case' 0 N--CA 1.528 3.435 0 C-N-CA 124.493 1.117 . . . . 0.0 110.456 -178.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.555 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 30.2 p-80 -81.43 3.65 23.81 Favored 'General case' 0 N--CA 1.518 2.939 0 C-N-CA 123.381 0.672 . . . . 0.0 109.352 175.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.766 ' HA ' HD23 ' A' ' 39' ' ' LEU . 22.9 mt -94.03 -51.46 0.26 Allowed Pre-proline 0 N--CA 1.507 2.382 0 CA-C-O 116.857 -1.544 . . . . 0.0 108.565 -175.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.457 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 8.2 Cg_exo -61.63 -32.61 87.36 Favored 'Trans proline' 0 C--N 1.397 3.101 0 N-CA-C 106.257 -2.247 . . . . 0.0 106.257 169.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.7 tt -60.25 -46.34 90.14 Favored 'General case' 0 N--CA 1.529 3.518 0 C-N-CA 124.598 1.159 . . . . 0.0 109.05 174.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.766 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.0 OUTLIER -74.35 -12.26 60.48 Favored 'General case' 0 N--CA 1.533 3.7 0 CA-C-O 118.526 -0.749 . . . . 0.0 111.199 179.664 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -87.84 -19.18 27.79 Favored 'General case' 0 N--CA 1.514 2.75 0 CA-C-O 117.282 -1.342 . . . . 0.0 111.273 178.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -113.93 -23.7 9.46 Favored 'General case' 0 N--CA 1.534 3.729 0 CA-C-N 120.591 1.541 . . . . 0.0 114.038 -178.301 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 23.6 ptp -129.23 27.76 5.32 Favored 'General case' 1 N--CA 1.546 4.33 0 CA-C-N 120.6 1.545 . . . . 0.0 111.46 178.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.461 HD22 ' HB2' ' A' ' 39' ' ' LEU . 0.7 OUTLIER -135.16 -68.25 0.53 Allowed 'General case' 0 N--CA 1.515 2.795 0 CA-C-O 117.922 -1.037 . . . . 0.0 109.233 177.923 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 25.5 p 121.47 160.59 0.0 OUTLIER Pre-proline 1 N--CA 1.571 5.624 0 C-N-CA 128.003 2.521 . . . . 0.0 109.8 -179.232 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -68.14 -28.62 34.21 Favored 'Trans proline' 0 C--N 1.394 2.942 0 C-N-CA 122.3 2.0 . . . . 0.0 109.297 175.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -66.95 -19.05 65.65 Favored 'General case' 0 N--CA 1.532 3.636 0 CA-C-O 118.407 -0.806 . . . . 0.0 110.462 176.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.448 ' HB3' HD23 ' A' ' 43' ' ' LEU . 7.7 mm-40 -75.7 -29.67 59.05 Favored 'General case' 0 N--CA 1.525 3.281 0 CA-C-O 117.853 -1.07 . . . . 0.0 109.656 178.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 12.7 ptt180 -91.35 -14.32 30.93 Favored 'General case' 0 N--CA 1.535 3.806 0 CA-C-N 119.39 0.996 . . . . 0.0 108.535 173.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -79.8 -22.81 42.64 Favored 'General case' 0 N--CA 1.518 2.953 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 173.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -93.96 -36.04 12.36 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 123.854 0.862 . . . . 0.0 109.156 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.495 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 18.1 tp -75.05 -25.5 58.71 Favored 'General case' 0 N--CA 1.533 3.699 0 N-CA-C 106.684 -1.598 . . . . 0.0 106.684 174.181 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.452 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -69.8 -70.91 1.08 Allowed Glycine 0 N--CA 1.503 3.164 0 C-N-CA 125.39 1.471 . . . . 0.0 111.492 177.615 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.5 m -71.83 -27.13 62.7 Favored 'General case' 0 N--CA 1.532 3.635 0 CA-C-O 118.008 -0.996 . . . . 0.0 113.009 -176.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 39.6 mtt180 -74.31 -45.46 47.27 Favored 'General case' 0 N--CA 1.524 3.251 0 CA-C-N 120.12 1.327 . . . . 0.0 108.195 178.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 30.9 t -64.89 -18.12 23.03 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.002 0 O-C-N 120.636 -1.29 . . . . 0.0 109.164 174.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.31 -50.73 20.55 Favored 'General case' 0 N--CA 1.531 3.602 0 CA-C-N 119.734 1.152 . . . . 0.0 111.571 177.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.462 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -70.75 -22.57 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.823 0 CA-C-N 120.779 1.627 . . . . 0.0 111.826 -178.55 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -87.54 -51.49 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.986 0 CA-C-N 120.257 1.389 . . . . 0.0 107.688 -179.014 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -61.13 -22.03 64.3 Favored 'General case' 0 N--CA 1.531 3.594 0 CA-C-O 118.782 -0.627 . . . . 0.0 110.576 177.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -95.27 -24.05 16.95 Favored 'General case' 0 N--CA 1.52 3.046 0 CA-C-O 118.089 -0.958 . . . . 0.0 110.8 178.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.3 tp -77.01 -57.29 3.93 Favored 'General case' 0 N--CA 1.535 3.787 0 CA-C-N 119.662 1.119 . . . . 0.0 108.484 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 42.5 mt -45.97 -29.82 1.58 Allowed 'General case' 1 N--CA 1.544 4.262 0 C-N-CA 124.775 1.23 . . . . 0.0 112.858 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.89 -53.23 5.23 Favored 'General case' 0 N--CA 1.519 3.02 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.11 80.29 0.82 Allowed Glycine 0 N--CA 1.512 3.704 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 179.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -138.41 -59.4 0.63 Allowed 'General case' 0 N--CA 1.526 3.327 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 87.7 mtp -149.51 76.13 1.3 Allowed 'General case' 0 N--CA 1.525 3.304 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.491 ' HA ' HD22 ' A' ' 71' ' ' LEU . 5.6 t -142.02 3.64 1.61 Allowed 'General case' 0 N--CA 1.524 3.271 0 N-CA-C 114.245 1.202 . . . . 0.0 114.245 -176.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -116.21 -55.29 2.41 Favored 'General case' 0 N--CA 1.526 3.333 0 CA-C-N 120.018 1.281 . . . . 0.0 112.124 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -110.63 -57.23 2.25 Favored 'General case' 0 N--CA 1.527 3.424 0 C-N-CA 123.198 0.599 . . . . 0.0 111.233 -176.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -74.11 -4.85 38.16 Favored 'General case' 0 N--CA 1.518 2.968 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.638 HD23 HG21 ' A' ' 82' ' ' ILE . 60.8 tp -76.71 -48.32 19.19 Favored 'General case' 0 N--CA 1.525 3.293 0 CA-C-N 119.91 1.232 . . . . 0.0 111.446 -178.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -35.65 -40.48 0.17 Allowed 'General case' 1 N--CA 1.541 4.102 0 N-CA-C 115.514 1.672 . . . . 0.0 115.514 -175.903 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -78.03 -40.31 39.24 Favored 'General case' 0 N--CA 1.529 3.524 0 CA-C-N 118.126 0.421 . . . . 0.0 110.811 -178.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -51.97 -35.19 45.44 Favored 'General case' 0 N--CA 1.531 3.576 0 C-N-CA 124.174 0.99 . . . . 0.0 113.149 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.3 pp -132.98 -44.94 0.86 Allowed 'General case' 0 N--CA 1.533 3.712 0 CA-C-N 118.76 0.709 . . . . 0.0 111.588 -179.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 104.93 73.96 0.93 Allowed Glycine 1 N--CA 1.528 4.803 0 CA-C-N 118.975 0.807 . . . . 0.0 112.099 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.08 -12.01 6.41 Favored 'General case' 0 N--CA 1.531 3.621 0 CA-C-N 117.886 0.843 . . . . 0.0 112.831 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 86.59 167.12 43.29 Favored Glycine 1 N--CA 1.532 5.09 0 CA-C-N 119.634 1.106 . . . . 0.0 111.128 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -87.05 -20.81 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.337 0 CA-C-N 119.483 1.641 . . . . 0.0 109.107 179.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.05 -30.87 71.06 Favored 'General case' 0 N--CA 1.525 3.317 0 CA-C-N 120.145 1.338 . . . . 0.0 111.995 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.5 p -83.53 -43.17 16.03 Favored 'General case' 1 N--CA 1.55 4.534 0 CA-C-N 120.249 1.386 . . . . 0.0 111.16 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.638 HG21 HD23 ' A' ' 71' ' ' LEU . 14.9 pt -70.8 -18.56 20.99 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.031 0 CA-C-O 117.958 -1.02 . . . . 0.0 112.98 -177.655 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 59.1 p -109.68 -31.91 7.29 Favored 'General case' 0 N--CA 1.516 2.871 0 CA-C-N 119.656 1.116 . . . . 0.0 110.688 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.2 ptt180 -73.22 -25.55 60.79 Favored 'General case' 0 N--CA 1.535 3.821 0 CA-C-N 119.475 1.034 . . . . 0.0 108.435 175.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -62.79 -31.35 79.97 Favored Glycine 1 N--CA 1.522 4.413 0 N-CA-C 108.991 -1.644 . . . . 0.0 108.991 175.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 18.3 m -63.1 -41.54 99.4 Favored 'General case' 0 N--CA 1.538 3.943 0 CA-C-N 118.004 0.902 . . . . 0.0 109.335 176.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -55.25 -28.01 50.41 Favored 'General case' 1 N--CA 1.547 4.423 0 C-N-CA 123.941 0.896 . . . . 0.0 111.942 178.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.434 ' HB3' ' HA ' ' B' ' 541' ' ' LEU . 39.4 m -65.81 -40.42 91.86 Favored 'General case' 0 N--CA 1.534 3.739 0 C-N-CA 123.193 0.597 . . . . 0.0 111.049 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.7 mt -58.92 -41.48 87.39 Favored 'General case' 0 N--CA 1.534 3.74 0 C-N-CA 124.291 1.036 . . . . 0.0 111.021 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.49 -21.02 65.18 Favored 'General case' 1 N--CA 1.54 4.025 0 CA-C-O 118.458 -0.782 . . . . 0.0 112.61 -179.636 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.59 -42.41 11.42 Favored 'General case' 0 N--CA 1.517 2.896 0 CA-C-N 118.915 0.78 . . . . 0.0 111.367 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.54 158.19 8.58 Favored Pre-proline 1 N--CA 1.542 4.165 0 CA-C-O 118.308 -0.853 . . . . 0.0 112.857 -179.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -84.66 170.2 10.33 Favored 'Trans proline' 0 C--N 1.377 2.048 0 C-N-CA 122.215 1.944 . . . . 0.0 110.401 178.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.462 ' HA ' ' HB3' ' A' ' 97' ' ' ARG . 2.9 t -90.83 -25.36 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.074 0 CA-C-O 117.912 -1.042 . . . . 0.0 111.543 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -61.91 -43.85 98.0 Favored 'General case' 0 N--CA 1.516 2.851 0 CA-C-N 119.966 1.257 . . . . 0.0 110.135 -179.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.5 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.3 mp -99.07 -16.09 18.78 Favored 'General case' 0 N--CA 1.511 2.588 0 C-N-CA 123.344 0.658 . . . . 0.0 111.704 178.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.462 ' HB3' ' HA ' ' A' ' 94' ' ' VAL . 0.2 OUTLIER -68.12 -26.25 65.71 Favored 'General case' 1 N--CA 1.541 4.084 0 N-CA-C 103.809 -2.663 . . . . 0.0 103.809 169.174 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -57.5 -40.1 77.92 Favored 'General case' 0 N--CA 1.516 2.874 0 C-N-CA 123.688 0.795 . . . . 0.0 109.519 174.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.635 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 57.2 t90 -63.93 -34.98 79.2 Favored 'General case' 0 N--CA 1.527 3.419 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 177.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.57 -38.73 60.52 Favored 'General case' 0 N--CA 1.536 3.835 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 176.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -67.61 -38.61 84.19 Favored 'General case' 1 N--CA 1.545 4.286 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 175.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 1.0 OUTLIER -59.31 -22.7 61.63 Favored 'General case' 1 N--CA 1.549 4.475 0 C-N-CA 123.633 0.773 . . . . 0.0 110.391 175.732 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.538 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.3 OUTLIER -122.58 5.25 5.64 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.259 0 C-N-CA 123.468 0.707 . . . . 0.0 112.682 -177.336 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.85 -55.89 2.34 Favored 'General case' 0 N--CA 1.516 2.863 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 175.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 5.4 tt . . . . . 0 N--CA 1.534 3.762 0 C-N-CA 125.181 1.392 . . . . 0.0 110.802 178.629 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 . . . . . 0 N--CA 1.532 3.633 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 519' ' ' TRP . . . . . 0.678 ' CE2' HD22 ' A' ' 39' ' ' LEU . 76.2 t-105 -36.74 -29.32 0.02 OUTLIER 'General case' 1 N--CA 1.548 4.468 0 N-CA-C 116.131 1.9 . . . . 0.0 116.131 -174.72 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 520' ' ' LEU . . . . . 0.596 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.1 mm? -98.6 -31.0 12.17 Favored 'General case' 0 N--CA 1.537 3.915 0 CA-C-O 117.98 -1.009 . . . . 0.0 113.497 -172.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 -62.72 -25.59 68.26 Favored 'General case' 1 N--CA 1.544 4.231 0 N-CA-C 105.639 -1.986 . . . . 0.0 105.639 171.429 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . 0.537 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.9 m-85 -75.29 -43.19 52.49 Favored 'General case' 0 N--CA 1.511 2.618 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 173.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 523' ' ' VAL . . . . . 0.436 HG23 ' O ' ' B' ' 519' ' ' TRP . 74.4 t -63.6 -18.56 22.37 Favored 'Isoleucine or valine' 1 N--CA 1.563 5.224 0 CA-C-O 117.999 -1.0 . . . . 0.0 111.334 177.518 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -74.66 -52.7 10.96 Favored 'General case' 0 N--CA 1.531 3.621 0 CA-C-N 119.996 1.271 . . . . 0.0 107.82 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 4.8 mp -63.33 -26.18 68.64 Favored 'General case' 0 N--CA 1.537 3.893 0 CA-C-O 119.134 -0.46 . . . . 0.0 110.165 175.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 526' ' ' LEU . . . . . 0.51 HD23 ' O ' ' B' ' 522' ' ' PHE . 3.1 mm? -67.52 -39.34 85.11 Favored 'General case' 0 N--CA 1.519 2.991 0 CA-C-O 118.206 -0.902 . . . . 0.0 108.602 178.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 527' ' ' LYS . . . . . 0.436 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 13.7 mttt -69.17 -19.8 64.0 Favored 'General case' 0 N--CA 1.525 3.31 0 CA-C-O 118.078 -0.963 . . . . 0.0 111.262 177.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -75.25 -37.35 61.06 Favored 'General case' 0 N--CA 1.529 3.524 0 CA-C-N 119.629 1.104 . . . . 0.0 109.056 176.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 529' ' ' ALA . . . . . 0.635 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -92.81 -8.63 43.06 Favored 'General case' 0 N--CA 1.504 2.238 0 CA-C-O 118.537 -0.744 . . . . 0.0 110.475 178.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 530' ' ' TYR . . . . . 0.436 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.5 OUTLIER -81.53 -29.1 33.64 Favored 'General case' 0 N--CA 1.532 3.673 0 CA-C-N 119.953 1.252 . . . . 0.0 109.272 179.841 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -68.69 -43.35 76.26 Favored 'General case' 0 N--CA 1.531 3.613 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 176.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 41.5 m-80 -90.54 -91.85 0.14 Allowed 'General case' 0 N--CA 1.516 2.853 0 N-CA-C 106.625 -1.62 . . . . 0.0 106.625 176.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 3.0 p30 155.1 54.47 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.868 0 C-N-CA 127.474 2.31 . . . . 0.0 107.397 177.25 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 534' ' ' LEU . . . . . 0.5 HD22 ' CD2' ' A' ' 96' ' ' LEU . 7.4 mt -114.64 11.6 16.99 Favored 'General case' 0 N--CA 1.53 3.531 0 C-N-CA 124.029 0.932 . . . . 0.0 111.197 -177.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 535' ' ' HIS . . . . . 0.585 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 42.2 p-80 -81.15 0.27 37.07 Favored 'General case' 0 N--CA 1.515 2.805 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 175.142 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 536' ' ' LEU . . . . . 0.443 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 35.4 mt -93.92 -51.52 0.26 Allowed Pre-proline 0 N--CA 1.506 2.37 0 CA-C-O 116.381 -1.771 . . . . 0.0 109.175 -176.166 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 537' ' ' PRO . . . . . 0.443 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 2.7 Cg_exo -64.28 -33.93 57.59 Favored 'Trans proline' 0 C--N 1.395 3.009 0 N-CA-C 107.104 -1.922 . . . . 0.0 107.104 171.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 538' ' ' LEU . . . . . 0.411 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 1.2 tm? -61.94 -41.99 98.59 Favored 'General case' 0 N--CA 1.529 3.487 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 175.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 13.7 mt -70.86 -22.43 62.3 Favored 'General case' 0 N--CA 1.537 3.909 0 CA-C-O 118.419 -0.8 . . . . 0.0 111.084 177.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -76.29 -8.52 57.26 Favored 'General case' 0 N--CA 1.526 3.375 0 CA-C-N 118.934 0.788 . . . . 0.0 110.228 176.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 541' ' ' LEU . . . . . 0.612 HD13 ' N ' ' B' ' 542' ' ' MET . 0.0 OUTLIER -106.12 -46.85 3.97 Favored 'General case' 0 N--CA 1.511 2.595 0 C-N-CA 124.247 1.019 . . . . 0.0 110.238 -178.512 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 542' ' ' MET . . . . . 0.612 ' N ' HD13 ' B' ' 541' ' ' LEU . 8.2 ptt? -94.41 -21.7 18.77 Favored 'General case' 0 N--CA 1.536 3.854 0 CA-C-O 116.85 -1.548 . . . . 0.0 114.966 -175.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 543' ' ' LEU . . . . . 0.644 ' O ' HG23 ' B' ' 544' ' ' THR . 3.1 mp -119.09 -106.97 0.38 Allowed 'General case' 0 N--CA 1.534 3.752 0 CA-C-N 121.464 1.938 . . . . 0.0 113.539 -176.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 544' ' ' THR . . . . . 0.644 HG23 ' O ' ' B' ' 543' ' ' LEU . 7.6 p 179.13 165.78 0.69 Allowed Pre-proline 1 N--CA 1.56 5.05 0 CA-C-N 121.381 1.901 . . . . 0.0 110.788 -176.838 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -69.37 -33.98 16.88 Favored 'Trans proline' 0 CA--C 1.574 2.512 0 C-N-CA 122.427 2.085 . . . . 0.0 109.031 172.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -59.94 -18.86 48.36 Favored 'General case' 0 N--CA 1.533 3.718 0 CA-C-O 118.078 -0.963 . . . . 0.0 111.633 177.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -76.74 -44.86 31.47 Favored 'General case' 0 N--CA 1.525 3.315 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 177.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 548' ' ' ARG . . . . . 0.523 ' HA ' HD12 ' B' ' 551' ' ' LEU . 31.0 ptt180 -81.4 -1.85 47.19 Favored 'General case' 0 N--CA 1.533 3.707 0 CA-C-N 118.627 0.649 . . . . 0.0 110.95 176.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -84.53 -47.53 10.5 Favored 'General case' 0 N--CA 1.524 3.275 0 N-CA-C 105.07 -2.196 . . . . 0.0 105.07 174.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -75.63 -17.14 60.1 Favored 'General case' 0 N--CA 1.509 2.499 0 CA-C-O 117.414 -1.279 . . . . 0.0 111.448 177.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 551' ' ' LEU . . . . . 0.711 HD11 ' N ' ' A' ' 19' ' ' TRP . 0.0 OUTLIER -74.91 -39.71 61.28 Favored 'General case' 0 N--CA 1.53 3.557 0 N-CA-C 106.35 -1.722 . . . . 0.0 106.35 175.139 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 552' ' ' GLY . . . . . 0.683 ' N ' HD13 ' B' ' 551' ' ' LEU . . . -62.79 -58.71 10.99 Favored Glycine 0 N--CA 1.495 2.577 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 -177.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 553' ' ' THR . . . . . 0.537 ' O ' HG23 ' B' ' 557' ' ' ILE . 2.8 m -71.73 -34.59 69.69 Favored 'General case' 0 N--CA 1.537 3.904 0 CA-C-O 118.168 -0.92 . . . . 0.0 112.604 -178.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -68.25 -58.15 4.87 Favored 'General case' 1 N--CA 1.541 4.082 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 178.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 47.8 t -58.09 -18.9 11.77 Favored 'Isoleucine or valine' 1 N--CA 1.549 4.48 0 CA-C-O 117.621 -1.18 . . . . 0.0 110.264 175.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 13.6 mtt-85 -84.88 -32.74 23.02 Favored 'General case' 0 N--CA 1.52 3.062 0 CA-C-O 117.077 -1.439 . . . . 0.0 111.729 178.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 557' ' ' ILE . . . . . 0.537 HG23 ' O ' ' B' ' 553' ' ' THR . 0.0 OUTLIER -77.2 -20.92 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.182 0 CA-C-N 122.049 2.204 . . . . 0.0 109.728 177.722 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 558' ' ' VAL . . . . . 0.476 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.0 OUTLIER -89.44 -50.33 13.26 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.911 0 N-CA-C 106.954 -1.499 . . . . 0.0 106.954 -179.205 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -60.69 -24.78 65.89 Favored 'General case' 0 N--CA 1.531 3.607 0 CA-C-O 119.004 -0.522 . . . . 0.0 109.822 177.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -96.97 -23.74 16.15 Favored 'General case' 0 N--CA 1.522 3.13 0 CA-C-O 117.831 -1.08 . . . . 0.0 111.306 178.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 27.6 tp -75.75 -51.92 11.6 Favored 'General case' 1 N--CA 1.542 4.129 0 CA-C-N 120.108 1.322 . . . . 0.0 108.306 179.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 40.5 mt -48.24 -27.55 2.53 Favored 'General case' 1 N--CA 1.543 4.195 0 C-N-CA 124.375 1.07 . . . . 0.0 112.3 179.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.69 -51.03 13.65 Favored 'General case' 0 N--CA 1.53 3.54 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 178.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 62.78 54.91 30.15 Favored Glycine 1 N--CA 1.521 4.324 0 C-N-CA 123.975 0.797 . . . . 0.0 114.228 175.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -115.73 -56.15 2.36 Favored 'General case' 0 N--CA 1.517 2.877 0 N-CA-C 106.657 -1.608 . . . . 0.0 106.657 177.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 52.1 ttp -139.64 76.06 1.54 Allowed 'General case' 0 N--CA 1.524 3.225 0 N-CA-C 104.271 -2.492 . . . . 0.0 104.271 177.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 567' ' ' SER . . . . . 0.446 ' HA ' ' HB2' ' B' ' 571' ' ' LEU . 29.6 m -135.53 -3.28 2.38 Favored 'General case' 0 N--CA 1.522 3.173 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -173.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -98.03 -84.66 0.38 Allowed 'General case' 0 N--CA 1.52 3.029 0 CA-C-N 119.809 1.186 . . . . 0.0 110.654 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 3.9 mtt-85 -75.67 -55.91 5.2 Favored 'General case' 0 N--CA 1.527 3.386 0 CA-C-N 119.857 1.208 . . . . 0.0 111.851 -178.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -70.98 -2.4 15.17 Favored 'General case' 0 N--CA 1.523 3.21 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -174.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 571' ' ' LEU . . . . . 0.814 HD23 HD11 ' B' ' 582' ' ' ILE . 34.0 tp -85.41 -47.23 10.17 Favored 'General case' 0 N--CA 1.533 3.699 0 CA-C-N 120.664 1.575 . . . . 0.0 111.773 -178.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.79 -35.88 0.55 Allowed 'General case' 1 N--CA 1.557 4.888 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -179.444 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -71.49 -39.16 71.03 Favored 'General case' 0 N--CA 1.536 3.874 0 CA-C-N 118.806 0.73 . . . . 0.0 111.02 -178.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -53.91 -59.99 3.91 Favored 'General case' 0 N--CA 1.53 3.531 0 C-N-CA 123.976 0.911 . . . . 0.0 111.743 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 5.5 mp -93.81 -64.64 1.06 Allowed 'General case' 0 N--CA 1.519 3.018 0 C-N-CA 123.224 0.61 . . . . 0.0 110.012 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 124.78 46.54 0.24 Allowed Glycine 1 N--CA 1.518 4.158 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -178.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -119.32 115.73 24.76 Favored 'General case' 0 N--CA 1.517 2.876 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -39.45 171.48 0.01 OUTLIER Glycine 1 N--CA 1.541 5.674 0 C-N-CA 125.493 1.52 . . . . 0.0 116.168 -177.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 579' ' ' ILE . . . . . 0.665 HD13 ' CG2' ' B' ' 582' ' ' ILE . 0.6 OUTLIER -80.24 -16.37 12.8 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.386 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.504 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -68.85 -39.45 79.9 Favored 'General case' 0 N--CA 1.527 3.379 0 CA-C-N 119.502 1.046 . . . . 0.0 109.967 176.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.5 p -77.76 -38.79 46.11 Favored 'General case' 0 N--CA 1.535 3.776 0 CA-C-N 118.888 0.767 . . . . 0.0 111.502 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 582' ' ' ILE . . . . . 0.814 HD11 HD23 ' B' ' 571' ' ' LEU . 2.1 tt -67.27 -35.34 73.63 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.185 0 CA-C-O 118.849 -0.596 . . . . 0.0 112.411 -175.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 82.0 p -102.27 -25.1 13.8 Favored 'General case' 0 N--CA 1.515 2.78 0 CA-C-O 117.904 -1.046 . . . . 0.0 111.573 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -73.12 -24.86 60.66 Favored 'General case' 0 N--CA 1.538 3.953 0 CA-C-N 119.981 1.264 . . . . 0.0 108.544 174.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -62.71 -36.1 92.82 Favored Glycine 1 N--CA 1.521 4.35 0 N-CA-C 107.325 -2.31 . . . . 0.0 107.325 173.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 1.7 m -60.65 -39.74 89.41 Favored 'General case' 1 N--CA 1.541 4.106 0 C-N-CA 123.94 0.896 . . . . 0.0 110.32 176.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -59.7 -32.65 70.71 Favored 'General case' 1 N--CA 1.548 4.445 0 C-N-CA 123.539 0.736 . . . . 0.0 111.683 -179.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 4.8 m -65.29 -37.62 87.73 Favored 'General case' 0 N--CA 1.535 3.817 0 C-N-CA 123.039 0.536 . . . . 0.0 110.867 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 29.8 mt -58.31 -45.23 88.4 Favored 'General case' 0 N--CA 1.529 3.52 0 C-N-CA 124.094 0.958 . . . . 0.0 111.519 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -14.82 63.27 Favored 'General case' 0 N--CA 1.538 3.934 0 CA-C-O 118.04 -0.981 . . . . 0.0 112.926 -178.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -88.52 -43.55 11.33 Favored 'General case' 0 N--CA 1.521 3.11 0 CA-C-N 119.534 1.061 . . . . 0.0 110.849 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -57.12 163.83 2.85 Favored Pre-proline 1 N--CA 1.542 4.161 0 C-N-CA 123.647 0.779 . . . . 0.0 112.934 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 593' ' ' PRO . . . . . 0.43 ' O ' ' HB2' ' B' ' 597' ' ' ARG . 45.5 Cg_endo -80.51 173.32 12.45 Favored 'Trans proline' 0 C--N 1.381 2.26 0 C-N-CA 121.777 1.651 . . . . 0.0 110.54 178.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -94.73 -25.89 4.53 Favored 'Isoleucine or valine' 0 N--CA 1.522 3.173 0 CA-C-O 117.875 -1.059 . . . . 0.0 111.579 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -62.83 -41.16 99.22 Favored 'General case' 0 N--CA 1.517 2.893 0 CA-C-N 120.02 1.282 . . . . 0.0 110.246 -179.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 596' ' ' LEU . . . . . 0.439 ' CD2' HD22 ' A' ' 34' ' ' LEU . 7.0 mp -98.45 -15.37 19.65 Favored 'General case' 0 N--CA 1.512 2.639 0 CA-C-O 118.687 -0.673 . . . . 0.0 111.878 178.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' B' ' 593' ' ' PRO . 0.0 OUTLIER -65.18 -34.37 78.22 Favored 'General case' 1 N--CA 1.544 4.231 0 N-CA-C 103.338 -2.838 . . . . 0.0 103.338 168.632 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -52.76 -40.47 63.16 Favored 'General case' 0 N--CA 1.516 2.872 0 C-N-CA 124.328 1.051 . . . . 0.0 111.001 174.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 599' ' ' TRP . . . . . 0.504 ' O ' HG22 ' B' ' 603' ' ' VAL . 52.3 t90 -64.68 -37.38 87.38 Favored 'General case' 0 N--CA 1.532 3.64 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 177.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -51.71 -36.86 48.45 Favored 'General case' 1 N--CA 1.541 4.106 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 176.554 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -70.51 -39.55 74.03 Favored 'General case' 0 N--CA 1.537 3.88 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 175.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 602' ' ' GLU . . . . . 0.426 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.9 OUTLIER -57.43 -24.35 55.08 Favored 'General case' 1 N--CA 1.546 4.372 0 C-N-CA 124.045 0.938 . . . . 0.0 111.505 176.41 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' B' B ' 603' ' ' VAL . . . . . 0.504 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.0 OUTLIER -107.22 -6.3 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.358 0 CA-C-O 117.862 -1.066 . . . . 0.0 113.526 -175.322 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 6.7 mp -104.88 -61.12 1.51 Allowed 'General case' 0 N--CA 1.525 3.307 0 N-CA-C 106.314 -1.736 . . . . 0.0 106.314 174.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 5.4 tp . . . . . 0 N--CA 1.535 3.81 0 C-N-CA 125.507 1.523 . . . . 0.0 113.55 -179.388 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.542 ' O ' HD21 ' B' ' 551' ' ' LEU . 47.1 mt-10 . . . . . 0 N--CA 1.523 3.181 0 N-CA-C 105.441 -2.059 . . . . 0.0 105.441 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.768 ' O ' HG23 ' A' ' 23' ' ' VAL . 75.1 t-105 -59.99 -20.09 55.82 Favored 'General case' 0 N--CA 1.537 3.909 0 CA-C-O 117.824 -1.084 . . . . 0.0 110.973 174.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.546 HD22 ' N ' ' A' ' 20' ' ' LEU . 1.8 mm? -92.25 -31.42 15.42 Favored 'General case' 0 N--CA 1.52 3.039 0 C-N-CA 124.114 0.966 . . . . 0.0 110.765 -177.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.7 mtt180 -60.83 -27.48 68.11 Favored 'General case' 0 N--CA 1.534 3.743 0 N-CA-C 106.395 -1.706 . . . . 0.0 106.395 172.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.513 ' HB2' HD23 ' B' ' 551' ' ' LEU . 20.9 t80 -88.53 -31.55 18.63 Favored 'General case' 0 CA--C 1.595 2.695 0 CA-C-O 116.645 -1.645 . . . . 0.0 109.332 175.088 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.768 HG23 ' O ' ' A' ' 19' ' ' TRP . 93.3 t -74.54 -62.38 1.34 Allowed 'Isoleucine or valine' 1 N--CA 1.565 5.285 0 CA-C-N 122.215 2.28 . . . . 0.0 110.425 -178.597 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -52.91 -36.18 59.16 Favored 'General case' 1 N--CA 1.548 4.452 0 CA-C-N 119.106 0.866 . . . . 0.0 111.62 -178.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.94 -35.32 66.96 Favored 'General case' 0 N--CA 1.533 3.699 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 177.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.03 -40.84 95.12 Favored 'General case' 0 N--CA 1.529 3.477 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 176.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.439 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 22.3 tttt -56.47 -30.46 62.96 Favored 'General case' 0 N--CA 1.531 3.609 0 C-N-CA 123.216 0.606 . . . . 0.0 111.743 179.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -71.67 -42.33 67.63 Favored 'General case' 0 N--CA 1.529 3.511 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.603 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -87.81 3.35 48.57 Favored 'General case' 0 N--CA 1.517 2.889 0 O-C-N 123.176 0.297 . . . . 0.0 110.295 177.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.439 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -87.54 -45.65 10.27 Favored 'General case' 0 N--CA 1.524 3.236 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 -179.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -58.21 -39.72 79.74 Favored 'General case' 1 N--CA 1.541 4.088 0 C-N-CA 123.292 0.637 . . . . 0.0 109.3 178.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 65.5 m-80 -92.63 -83.21 0.31 Allowed 'General case' 0 N--CA 1.512 2.669 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 177.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 p30 145.51 44.16 0.0 OUTLIER 'General case' 1 N--CA 1.562 5.157 0 C-N-CA 128.444 2.698 . . . . 0.0 107.879 178.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.43 HD22 ' CD2' ' B' ' 596' ' ' LEU . 13.3 mt -98.22 12.02 35.96 Favored 'General case' 0 N--CA 1.53 3.541 0 O-C-N 121.368 -0.832 . . . . 0.0 110.693 -179.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.555 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -89.86 16.39 8.21 Favored 'General case' 0 N--CA 1.515 2.799 0 C-N-CA 123.984 0.913 . . . . 0.0 109.071 174.894 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.503 HD21 HD11 ' B' ' 520' ' ' LEU . 23.6 mt -98.96 -51.93 0.2 Allowed Pre-proline 0 N--CA 1.503 2.198 0 C-N-CA 125.335 1.454 . . . . 0.0 107.581 -178.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.484 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 6.1 Cg_exo -70.03 -33.43 15.57 Favored 'Trans proline' 0 C--N 1.393 2.869 0 N-CA-C 107.098 -1.924 . . . . 0.0 107.098 170.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.5 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.1 OUTLIER -65.79 -42.08 91.2 Favored 'General case' 0 N--CA 1.517 2.903 0 CA-C-O 117.93 -1.033 . . . . 0.0 108.495 177.357 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.518 HD22 ' CE2' ' B' ' 519' ' ' TRP 0.268 0.1 OUTLIER -77.42 -11.08 59.8 Favored 'General case' 1 N--CA 1.552 4.649 0 CA-C-N 120.316 1.416 . . . . 0.0 110.934 176.628 . . . . . . . . 5 4 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -91.59 9.77 30.79 Favored 'General case' 0 N--CA 1.524 3.228 0 CA-C-N 119.057 0.844 . . . . 0.0 110.038 176.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.647 HD13 ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -125.57 -50.08 1.63 Allowed 'General case' 0 N--CA 1.522 3.166 0 CA-C-N 119.407 1.003 . . . . 0.0 109.686 -178.872 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.647 ' N ' HD13 ' A' ' 41' ' ' LEU . 7.9 ptp -93.95 -14.0 26.44 Favored 'General case' 1 N--CA 1.543 4.222 0 CA-C-O 118.273 -0.87 . . . . 0.0 113.298 -177.661 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.464 ' O ' HG23 ' A' ' 44' ' ' THR . 3.6 mp -110.88 -83.38 0.57 Allowed 'General case' 0 N--CA 1.502 2.167 0 CA-C-O 117.934 -1.031 . . . . 0.0 110.911 -177.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.464 HG23 ' O ' ' A' ' 43' ' ' LEU . 0.9 OUTLIER 150.52 166.09 0.0 OUTLIER Pre-proline 1 N--CA 1.564 5.233 0 C-N-CA 126.144 1.778 . . . . 0.0 109.1 -178.445 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -68.86 -33.86 19.35 Favored 'Trans proline' 0 CA--C 1.574 2.515 0 C-N-CA 122.304 2.003 . . . . 0.0 108.399 173.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -62.66 -19.69 64.08 Favored 'General case' 0 N--CA 1.529 3.476 0 CA-C-O 118.058 -0.972 . . . . 0.0 111.15 177.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -73.2 -32.6 64.9 Favored 'General case' 0 N--CA 1.523 3.203 0 CA-C-O 117.684 -1.15 . . . . 0.0 109.969 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.8 ptt180 -89.5 -14.27 35.62 Favored 'General case' 0 N--CA 1.538 3.956 0 CA-C-N 119.689 1.131 . . . . 0.0 108.779 173.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -79.52 -19.35 49.81 Favored 'General case' 0 N--CA 1.516 2.847 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 172.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -95.46 -38.06 10.63 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 123.932 0.893 . . . . 0.0 109.467 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.483 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 23.3 tp -75.26 -21.77 58.31 Favored 'General case' 0 N--CA 1.534 3.753 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 173.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.452 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -69.08 -71.34 0.99 Allowed Glycine 0 N--CA 1.497 2.704 0 C-N-CA 125.104 1.335 . . . . 0.0 110.553 176.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.6 m -70.33 -28.44 65.16 Favored 'General case' 0 N--CA 1.537 3.893 0 CA-C-O 117.842 -1.075 . . . . 0.0 112.991 -177.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -69.47 -51.7 33.57 Favored 'General case' 0 N--CA 1.534 3.751 0 CA-C-N 120.007 1.276 . . . . 0.0 107.848 178.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 33.2 t -61.78 -19.31 21.0 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.241 0 CA-C-O 117.683 -1.151 . . . . 0.0 109.793 175.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.5 mtp180 -77.39 -43.94 30.97 Favored 'General case' 0 N--CA 1.526 3.355 0 CA-C-N 120.371 1.441 . . . . 0.0 112.299 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.422 HD13 ' N ' ' A' ' 58' ' ' VAL . 0.0 OUTLIER -73.03 -21.69 19.33 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.75 0 CA-C-N 121.719 2.054 . . . . 0.0 111.011 179.508 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.473 HG11 HD11 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -89.15 -52.18 11.25 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.024 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 -178.855 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -59.61 -23.06 62.66 Favored 'General case' 0 N--CA 1.529 3.509 0 CA-C-O 119.087 -0.482 . . . . 0.0 109.984 177.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -96.34 -22.52 17.14 Favored 'General case' 0 N--CA 1.526 3.357 0 CA-C-O 117.861 -1.066 . . . . 0.0 110.97 177.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.3 mt -75.3 -54.66 6.7 Favored 'General case' 1 N--CA 1.544 4.235 0 CA-C-N 119.999 1.272 . . . . 0.0 107.903 178.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.3 -36.34 4.02 Favored 'General case' 1 N--CA 1.545 4.278 0 C-N-CA 125.346 1.458 . . . . 0.0 112.003 179.727 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.9 mmm180 -81.85 -52.6 6.93 Favored 'General case' 0 N--CA 1.527 3.397 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.06 59.73 3.31 Favored Glycine 1 N--CA 1.517 4.081 0 CA-C-O 119.349 -0.695 . . . . 0.0 111.795 178.098 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -116.05 -54.52 2.48 Favored 'General case' 0 N--CA 1.524 3.234 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 178.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 10.7 ptp -149.39 77.64 1.35 Allowed 'General case' 0 N--CA 1.526 3.351 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 178.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.41 ' HA ' HD22 ' A' ' 71' ' ' LEU . 5.6 t -128.97 -8.54 4.9 Favored 'General case' 0 N--CA 1.528 3.429 0 N-CA-C 114.066 1.136 . . . . 0.0 114.066 -176.161 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -114.97 -59.24 2.04 Favored 'General case' 0 N--CA 1.528 3.468 0 CA-C-N 120.056 1.298 . . . . 0.0 111.955 -178.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 3.2 mmt-85 -94.68 -55.12 3.24 Favored 'General case' 0 N--CA 1.528 3.432 0 CA-C-N 118.093 0.406 . . . . 0.0 111.46 -177.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -76.87 -9.3 58.59 Favored 'General case' 0 N--CA 1.524 3.273 0 N-CA-C 114.05 1.129 . . . . 0.0 114.05 -177.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.55 HD23 HG21 ' A' ' 82' ' ' ILE . 36.4 tp -77.66 -49.65 14.08 Favored 'General case' 0 N--CA 1.526 3.37 0 CA-C-N 119.973 1.26 . . . . 0.0 112.299 -177.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.45 -34.07 15.75 Favored 'General case' 0 N--CA 1.534 3.747 0 N-CA-C 114.306 1.225 . . . . 0.0 114.306 -176.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -68.34 -33.54 74.47 Favored 'General case' 0 N--CA 1.535 3.805 0 CA-C-O 119.051 -0.5 . . . . 0.0 111.709 -178.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -52.54 -46.42 66.76 Favored 'General case' 0 N--CA 1.531 3.611 0 C-N-CA 124.275 1.03 . . . . 0.0 112.584 -178.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.407 HD23 ' N ' ' A' ' 75' ' ' LEU . 1.2 pt? -138.16 -40.56 0.53 Allowed 'General case' 0 N--CA 1.527 3.388 0 CA-C-O 118.63 -0.7 . . . . 0.0 111.852 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 107.87 79.21 1.16 Allowed Glycine 1 N--CA 1.524 4.517 0 CA-C-N 119.185 0.902 . . . . 0.0 111.712 178.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -112.47 -9.78 13.78 Favored 'General case' 0 N--CA 1.526 3.367 0 C-N-CA 123.626 0.77 . . . . 0.0 111.269 177.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 87.81 162.88 38.47 Favored Glycine 0 N--CA 1.513 3.78 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 -178.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -85.33 -23.31 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.522 3.17 0 CA-C-N 118.825 1.313 . . . . 0.0 108.387 178.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.32 -29.21 70.29 Favored 'General case' 0 N--CA 1.515 2.776 0 CA-C-O 116.921 -1.514 . . . . 0.0 111.509 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.8 p -83.08 -46.91 12.25 Favored 'General case' 1 N--CA 1.545 4.296 0 CA-C-N 120.809 1.64 . . . . 0.0 110.545 178.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.55 HG21 HD23 ' A' ' 71' ' ' LEU . 15.9 pt -68.36 -16.3 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.99 0 CA-C-O 117.879 -1.058 . . . . 0.0 113.114 -177.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 62.7 p -111.19 -29.88 7.67 Favored 'General case' 0 N--CA 1.516 2.861 0 CA-C-N 120.022 1.283 . . . . 0.0 110.721 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -74.96 -21.76 58.97 Favored 'General case' 0 N--CA 1.53 3.564 0 CA-C-N 119.528 1.058 . . . . 0.0 108.309 174.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.07 -29.65 74.81 Favored Glycine 0 N--CA 1.516 3.983 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 176.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.2 t -64.37 -39.55 94.1 Favored 'General case' 0 N--CA 1.539 3.978 0 CA-C-N 118.402 1.101 . . . . 0.0 109.326 176.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -62.04 -19.1 62.52 Favored 'General case' 1 N--CA 1.543 4.187 0 CA-C-O 118.41 -0.805 . . . . 0.0 112.367 179.075 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 14.3 m -72.04 -39.93 68.74 Favored 'General case' 0 N--CA 1.535 3.79 0 CA-C-N 119.297 0.953 . . . . 0.0 110.288 179.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 54.9 mt -56.47 -49.28 75.12 Favored 'General case' 0 N--CA 1.525 3.285 0 C-N-CA 124.324 1.05 . . . . 0.0 112.525 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.66 -11.94 59.36 Favored 'General case' 1 N--CA 1.54 4.071 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -179.421 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.03 -44.72 12.79 Favored 'General case' 0 N--CA 1.519 2.997 0 CA-C-N 119.537 1.062 . . . . 0.0 110.974 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.39 161.98 5.01 Favored Pre-proline 1 N--CA 1.546 4.344 0 CA-C-O 118.249 -0.882 . . . . 0.0 112.663 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.429 ' O ' ' HB2' ' A' ' 97' ' ' ARG . 39.1 Cg_endo -78.22 174.61 12.19 Favored 'Trans proline' 0 C--N 1.38 2.21 0 C-N-CA 121.758 1.639 . . . . 0.0 110.43 178.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -94.56 -28.08 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.077 0 CA-C-O 117.302 -1.332 . . . . 0.0 111.721 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -64.24 -39.6 94.29 Favored 'General case' 0 N--CA 1.517 2.903 0 CA-C-N 120.37 1.441 . . . . 0.0 110.904 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.474 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.2 mp -98.9 -17.55 18.32 Favored 'General case' 0 N--CA 1.513 2.721 0 C-N-CA 123.291 0.636 . . . . 0.0 111.751 178.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.429 ' HB2' ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -65.35 -32.85 74.71 Favored 'General case' 1 N--CA 1.545 4.3 0 N-CA-C 103.047 -2.946 . . . . 0.0 103.047 168.459 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -55.18 -40.28 70.53 Favored 'General case' 0 N--CA 1.515 2.808 0 C-N-CA 124.371 1.068 . . . . 0.0 110.686 174.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.615 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 54.4 t90 -62.65 -35.49 79.79 Favored 'General case' 0 N--CA 1.536 3.855 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 177.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -52.25 -39.1 59.91 Favored 'General case' 1 N--CA 1.542 4.147 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 175.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -68.83 -37.25 79.04 Favored 'General case' 1 N--CA 1.542 4.129 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 175.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.425 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 1.2 mm-40 -60.79 -23.39 64.99 Favored 'General case' 1 N--CA 1.546 4.362 0 C-N-CA 123.542 0.737 . . . . 0.0 110.609 175.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.511 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -115.49 -3.19 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.179 0 CA-C-O 118.375 -0.821 . . . . 0.0 111.921 -177.268 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.25 -56.24 2.53 Favored 'General case' 0 N--CA 1.516 2.842 0 N-CA-C 106.121 -1.807 . . . . 0.0 106.121 175.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.2 tt . . . . . 0 N--CA 1.535 3.777 0 C-N-CA 124.95 1.3 . . . . 0.0 110.014 178.423 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 . . . . . 0 N--CA 1.524 3.228 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.019 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 519' ' ' TRP . . . . . 0.539 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 73.6 t-105 -44.65 -27.27 0.46 Allowed 'General case' 1 N--CA 1.55 4.57 0 CA-C-N 119.961 1.255 . . . . 0.0 113.291 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 520' ' ' LEU . . . . . 0.608 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.2 mm? -99.3 -28.08 13.48 Favored 'General case' 0 N--CA 1.529 3.491 0 CA-C-O 117.645 -1.169 . . . . 0.0 113.273 -173.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 18.8 ttm180 -61.33 -26.11 67.59 Favored 'General case' 1 N--CA 1.544 4.228 0 N-CA-C 105.38 -2.081 . . . . 0.0 105.38 171.278 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . 0.539 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.8 m-85 -77.05 -43.8 33.16 Favored 'General case' 0 N--CA 1.507 2.423 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 174.311 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 523' ' ' VAL . . . . . 0.522 HG23 ' O ' ' B' ' 519' ' ' TRP . 99.2 t -71.57 -17.45 19.56 Favored 'Isoleucine or valine' 1 N--CA 1.571 5.604 0 CA-C-O 117.755 -1.116 . . . . 0.0 113.203 -178.899 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -79.34 -48.64 13.72 Favored 'General case' 0 N--CA 1.534 3.772 0 CA-C-N 120.631 1.56 . . . . 0.0 108.45 -178.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 5.1 mp -76.95 -18.77 58.04 Favored 'General case' 0 N--CA 1.525 3.301 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 175.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 526' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' B' ' 522' ' ' PHE . 0.2 OUTLIER -69.43 -34.4 74.39 Favored 'General case' 0 N--CA 1.519 2.989 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 173.779 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 52.5 tttt -64.37 -27.7 69.19 Favored 'General case' 0 N--CA 1.519 3.003 0 CA-C-O 118.569 -0.729 . . . . 0.0 110.543 176.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -64.67 -41.62 95.96 Favored 'General case' 0 N--CA 1.536 3.873 0 CA-C-N 118.981 0.809 . . . . 0.0 109.492 177.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 529' ' ' ALA . . . . . 0.615 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -83.33 -13.34 55.28 Favored 'General case' 0 N--CA 1.505 2.308 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.894 178.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -76.54 -31.79 57.82 Favored 'General case' 0 N--CA 1.539 3.991 0 CA-C-N 120.401 1.455 . . . . 0.0 109.62 179.393 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -64.79 -44.66 89.24 Favored 'General case' 0 N--CA 1.536 3.872 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 178.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -89.63 -90.01 0.15 Allowed 'General case' 0 N--CA 1.515 2.782 0 N-CA-C 105.779 -1.934 . . . . 0.0 105.779 176.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.3 p30 155.56 48.9 0.0 OUTLIER 'General case' 1 N--CA 1.559 4.979 0 C-N-CA 127.447 2.299 . . . . 0.0 108.021 176.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 534' ' ' LEU . . . . . 0.474 HD22 ' CD2' ' A' ' 96' ' ' LEU . 9.4 mt -105.38 12.6 31.41 Favored 'General case' 0 N--CA 1.52 3.041 0 C-N-CA 124.531 1.132 . . . . 0.0 110.257 -178.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 535' ' ' HIS . . . . . 0.555 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 30.9 p-80 -85.17 5.57 29.45 Favored 'General case' 0 N--CA 1.51 2.565 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 175.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 536' ' ' LEU . . . . . 0.473 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 31.3 mt -97.03 -51.33 0.22 Allowed Pre-proline 0 N--CA 1.501 2.11 0 CA-C-O 116.362 -1.78 . . . . 0.0 108.45 -175.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 537' ' ' PRO . . . . . 0.473 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 6.3 Cg_exo -68.44 -36.47 15.38 Favored 'Trans proline' 0 C--N 1.394 2.925 0 N-CA-C 106.999 -1.962 . . . . 0.0 106.999 171.397 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 538' ' ' LEU . . . . . 0.51 HD11 ' HE1' ' B' ' 542' ' ' MET . 0.8 OUTLIER -59.87 -45.11 93.52 Favored 'General case' 0 N--CA 1.526 3.326 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 176.382 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 39.9 mt -73.43 -20.89 60.61 Favored 'General case' 0 N--CA 1.535 3.802 0 CA-C-O 118.224 -0.893 . . . . 0.0 111.456 179.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -74.2 -23.33 59.18 Favored 'General case' 0 N--CA 1.532 3.638 0 CA-C-N 119.772 1.169 . . . . 0.0 110.049 176.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 541' ' ' LEU . . . . . 0.563 HD13 ' N ' ' B' ' 542' ' ' MET . 0.1 OUTLIER -86.1 -51.83 6.07 Favored 'General case' 0 N--CA 1.514 2.757 0 C-N-CA 123.82 0.848 . . . . 0.0 109.649 -179.098 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 542' ' ' MET . . . . . 0.563 ' N ' HD13 ' B' ' 541' ' ' LEU . 8.8 ptt? -99.49 17.17 21.01 Favored 'General case' 0 N--CA 1.53 3.531 0 CA-C-O 118.024 -0.989 . . . . 0.0 113.588 -177.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -134.34 -98.85 0.25 Allowed 'General case' 0 N--CA 1.535 3.798 0 CA-C-N 120.467 1.485 . . . . 0.0 113.31 178.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 158.17 175.11 0.02 OUTLIER Pre-proline 1 N--CA 1.586 6.331 0 CA-C-N 120.985 1.72 . . . . 0.0 109.511 -177.187 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -63.18 -23.81 72.85 Favored 'Trans proline' 0 N--CA 1.525 3.364 0 C-N-CA 122.135 1.89 . . . . 0.0 110.544 174.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -54.03 -22.45 10.69 Favored 'General case' 1 N--CA 1.55 4.53 0 C-N-CA 123.894 0.877 . . . . 0.0 110.751 176.067 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -45.71 -76.23 0.03 OUTLIER 'General case' 0 N--CA 1.519 3.001 0 C-N-CA 126.333 1.853 . . . . 0.0 112.19 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 548' ' ' ARG . . . . . 0.515 ' HA ' HD12 ' B' ' 551' ' ' LEU . 28.7 ptt180 -93.77 -0.6 55.82 Favored 'General case' 0 N--CA 1.526 3.356 0 N-CA-C 113.634 0.975 . . . . 0.0 113.634 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -75.69 -52.46 10.44 Favored 'General case' 1 N--CA 1.544 4.243 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 173.259 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -73.88 -22.05 59.86 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 117.016 -1.469 . . . . 0.0 111.656 177.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 551' ' ' LEU . . . . . 0.673 HD13 ' N ' ' B' ' 552' ' ' GLY . 0.0 OUTLIER -74.22 -40.24 62.56 Favored 'General case' 0 N--CA 1.533 3.701 0 CA-C-N 121.039 1.745 . . . . 0.0 107.67 176.242 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 552' ' ' GLY . . . . . 0.673 ' N ' HD13 ' B' ' 551' ' ' LEU . . . -63.46 -47.77 84.34 Favored Glycine 0 N--CA 1.507 3.378 0 N-CA-C 110.803 -0.919 . . . . 0.0 110.803 -177.221 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.2 m -79.52 -39.56 31.69 Favored 'General case' 0 N--CA 1.534 3.754 0 CA-C-N 118.244 1.022 . . . . 0.0 112.086 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.2 -49.05 71.22 Favored 'General case' 0 N--CA 1.539 3.994 0 CA-C-N 119.511 1.05 . . . . 0.0 108.982 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 46.2 t -67.74 -19.82 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.761 0 CA-C-O 117.484 -1.246 . . . . 0.0 109.697 177.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 34.1 mtt180 -82.97 -33.49 26.65 Favored 'General case' 0 N--CA 1.521 3.101 0 CA-C-O 116.413 -1.756 . . . . 0.0 112.574 178.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 557' ' ' ILE . . . . . 0.464 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -78.19 -22.12 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.484 0 CA-C-N 122.984 2.629 . . . . 0.0 109.573 178.221 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 558' ' ' VAL . . . . . 0.464 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.0 OUTLIER -85.75 -52.97 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.738 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 179.826 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -60.87 -28.29 68.75 Favored 'General case' 0 N--CA 1.53 3.53 0 CA-C-O 118.653 -0.689 . . . . 0.0 110.659 178.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -86.52 -26.73 24.4 Favored 'General case' 0 N--CA 1.529 3.514 0 CA-C-N 118.667 0.667 . . . . 0.0 109.592 176.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 15.9 tp -65.69 -44.07 87.33 Favored 'General case' 1 N--CA 1.54 4.046 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 21.4 mt -59.65 -21.66 60.8 Favored 'General case' 0 N--CA 1.533 3.685 0 C-N-CA 123.752 0.821 . . . . 0.0 111.719 178.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 14.2 mmm180 -77.83 -53.44 7.49 Favored 'General case' 0 N--CA 1.524 3.235 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 69.04 77.1 0.42 Allowed Glycine 1 N--CA 1.523 4.458 0 CA-C-O 119.195 -0.781 . . . . 0.0 111.197 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -162.51 -52.69 0.04 OUTLIER 'General case' 0 N--CA 1.529 3.512 0 CA-C-N 117.834 0.817 . . . . 0.0 110.36 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 75.3 mtm -136.03 62.82 1.61 Allowed 'General case' 0 N--CA 1.521 3.108 0 N-CA-C 106.106 -1.813 . . . . 0.0 106.106 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 57.9 m -136.42 9.62 3.18 Favored 'General case' 0 N--CA 1.518 2.949 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.718 -176.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -112.15 -64.31 1.31 Allowed 'General case' 0 N--CA 1.517 2.907 0 CA-C-N 119.259 0.936 . . . . 0.0 110.404 -179.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -110.03 -43.53 3.96 Favored 'General case' 0 N--CA 1.519 3.01 0 C-N-CA 123.166 0.586 . . . . 0.0 110.271 -178.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -70.07 -13.12 62.06 Favored 'General case' 0 N--CA 1.514 2.767 0 CA-C-O 117.89 -1.052 . . . . 0.0 113.551 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 571' ' ' LEU . . . . . 0.853 HD23 HD11 ' B' ' 582' ' ' ILE . 18.2 tp -82.4 -51.46 7.83 Favored 'General case' 0 N--CA 1.527 3.411 0 CA-C-N 120.245 1.384 . . . . 0.0 110.615 -179.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -44.56 -30.51 0.91 Allowed 'General case' 1 N--CA 1.55 4.563 0 CA-C-N 119.125 0.875 . . . . 0.0 113.308 179.956 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -67.21 -43.59 81.71 Favored 'General case' 0 N--CA 1.535 3.806 0 C-N-CA 122.882 0.473 . . . . 0.0 110.795 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -47.68 -50.55 24.57 Favored 'General case' 0 N--CA 1.534 3.741 0 C-N-CA 124.734 1.214 . . . . 0.0 113.449 -178.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 2.0 pp -135.97 -43.86 0.65 Allowed 'General case' 0 N--CA 1.537 3.885 0 CA-C-O 118.938 -0.554 . . . . 0.0 111.604 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 113.85 82.37 1.1 Allowed Glycine 1 N--CA 1.523 4.479 0 N-CA-C 110.305 -1.118 . . . . 0.0 110.305 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -103.2 -43.04 5.57 Favored 'General case' 0 N--CA 1.526 3.352 0 C-N-CA 123.426 0.691 . . . . 0.0 109.594 178.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 108.61 157.94 18.99 Favored Glycine 0 N--CA 1.515 3.913 0 N-CA-C 109.734 -1.346 . . . . 0.0 109.734 -179.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 579' ' ' ILE . . . . . 0.464 ' HA ' HG22 ' B' ' 582' ' ' ILE . 0.8 OUTLIER -82.74 -15.82 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.898 0 CA-C-N 119.235 1.518 . . . . 0.0 108.265 177.701 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -69.4 -42.62 74.87 Favored 'General case' 0 N--CA 1.525 3.318 0 CA-C-N 120.047 1.294 . . . . 0.0 109.149 176.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.2 p -75.94 -38.68 57.35 Favored 'General case' 1 N--CA 1.542 4.142 0 CA-C-N 119.127 0.876 . . . . 0.0 112.365 179.31 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 582' ' ' ILE . . . . . 0.853 HD11 HD23 ' B' ' 571' ' ' LEU . 0.8 OUTLIER -67.66 -37.19 78.23 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.356 0 C-N-CA 123.347 0.659 . . . . 0.0 112.35 -175.112 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 75.6 p -101.07 -24.79 14.23 Favored 'General case' 0 N--CA 1.511 2.608 0 CA-C-O 117.897 -1.049 . . . . 0.0 111.685 -179.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 13.7 ptt180 -74.59 -23.69 58.78 Favored 'General case' 0 N--CA 1.526 3.365 0 CA-C-N 119.936 1.244 . . . . 0.0 109.004 175.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -63.02 -35.03 91.54 Favored Glycine 1 N--CA 1.528 4.781 0 N-CA-C 107.871 -2.092 . . . . 0.0 107.871 173.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 19.4 m -65.35 -34.52 78.52 Favored 'General case' 1 N--CA 1.541 4.104 0 C-N-CA 123.136 0.575 . . . . 0.0 110.403 176.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -62.85 -35.09 78.83 Favored 'General case' 1 N--CA 1.547 4.408 0 C-N-CA 123.354 0.662 . . . . 0.0 110.274 178.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.84 -35.26 76.1 Favored 'General case' 0 N--CA 1.534 3.758 0 C-N-CA 123.773 0.829 . . . . 0.0 111.133 179.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 24.1 mt -58.25 -42.47 86.46 Favored 'General case' 0 N--CA 1.531 3.575 0 C-N-CA 123.724 0.81 . . . . 0.0 110.731 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 3.1 mptt -60.29 -29.41 68.81 Favored 'General case' 1 N--CA 1.543 4.21 0 C-N-CA 123.205 0.602 . . . . 0.0 111.89 179.148 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -71.8 -40.88 68.87 Favored 'General case' 0 N--CA 1.517 2.884 0 CA-C-O 119.226 -0.416 . . . . 0.0 110.241 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -70.82 159.0 86.77 Favored Pre-proline 0 N--CA 1.527 3.41 0 CA-C-O 118.5 -0.762 . . . . 0.0 111.439 178.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -82.07 178.88 5.99 Favored 'Trans proline' 0 C--N 1.376 2.015 0 C-N-CA 122.013 1.809 . . . . 0.0 111.731 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.8 t -92.36 -26.97 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.906 0 CA-C-O 117.558 -1.211 . . . . 0.0 110.272 179.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -65.35 -38.14 89.18 Favored 'General case' 0 N--CA 1.515 2.819 0 CA-C-N 119.938 1.244 . . . . 0.0 110.195 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 596' ' ' LEU . . . . . 0.43 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.8 mp -97.95 -20.92 17.14 Favored 'General case' 0 N--CA 1.513 2.676 0 C-N-CA 123.443 0.697 . . . . 0.0 110.973 178.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -27.42 66.83 Favored 'General case' 0 N--CA 1.536 3.854 0 N-CA-C 103.389 -2.819 . . . . 0.0 103.389 168.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.16 -39.88 79.98 Favored 'General case' 0 N--CA 1.523 3.224 0 C-N-CA 124.345 1.058 . . . . 0.0 109.742 173.401 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 599' ' ' TRP . . . . . 0.603 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 45.7 t90 -61.86 -35.72 79.14 Favored 'General case' 0 N--CA 1.526 3.374 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 178.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.81 -36.26 47.27 Favored 'General case' 1 N--CA 1.541 4.092 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 176.781 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -73.38 -37.28 66.07 Favored 'General case' 0 N--CA 1.533 3.716 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 175.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 602' ' ' GLU . . . . . 0.445 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.2 OUTLIER -59.65 -22.16 61.5 Favored 'General case' 1 N--CA 1.544 4.261 0 CA-C-O 118.675 -0.679 . . . . 0.0 110.912 175.513 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' B' B ' 603' ' ' VAL . . . . . 0.519 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.0 OUTLIER -112.93 3.15 8.32 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.763 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -176.548 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 75.6 mt -114.43 -60.26 1.91 Allowed 'General case' 0 N--CA 1.519 3.017 0 N-CA-C 106.395 -1.705 . . . . 0.0 106.395 175.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 4.1 mp . . . . . 0 N--CA 1.536 3.841 0 C-N-CA 124.467 1.107 . . . . 0.0 111.768 -179.504 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 . . . . . 0 N--CA 1.514 2.74 0 CA-C-O 118.205 -0.902 . . . . 0.0 109.265 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.681 ' CZ3' HD22 ' B' ' 551' ' ' LEU . 72.6 t-105 -48.45 -38.49 19.96 Favored 'General case' 0 N--CA 1.534 3.728 0 CA-C-N 119.862 1.21 . . . . 0.0 112.148 179.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.505 HD22 ' N ' ' A' ' 20' ' ' LEU . 2.6 mm? -87.37 -27.11 22.99 Favored 'General case' 0 N--CA 1.524 3.239 0 CA-C-O 117.369 -1.3 . . . . 0.0 112.891 -174.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.71 -28.4 68.63 Favored 'General case' 1 N--CA 1.54 4.059 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 173.272 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.488 ' HB2' HG21 ' B' ' 555' ' ' VAL . 0.1 OUTLIER -79.6 -39.44 31.65 Favored 'General case' 0 N--CA 1.5 2.046 0 CA-C-O 116.366 -1.778 . . . . 0.0 108.075 173.585 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 19' ' ' TRP . 86.7 t -68.22 -21.28 26.45 Favored 'Isoleucine or valine' 1 N--CA 1.568 5.456 0 CA-C-N 121.138 1.79 . . . . 0.0 112.569 -177.631 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -78.19 -53.02 7.81 Favored 'General case' 0 N--CA 1.534 3.741 0 CA-C-N 120.112 1.324 . . . . 0.0 107.51 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.6 mp -70.03 -15.94 63.08 Favored 'General case' 0 N--CA 1.529 3.492 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 175.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.473 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -72.34 -37.8 68.77 Favored 'General case' 0 N--CA 1.513 2.694 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 176.305 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.677 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 11.0 tptp -69.16 -15.02 63.31 Favored 'General case' 0 N--CA 1.515 2.804 0 CA-C-O 117.924 -1.036 . . . . 0.0 111.483 176.171 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -74.16 -41.28 61.75 Favored 'General case' 0 N--CA 1.533 3.681 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 175.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.601 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -87.62 -7.1 57.91 Favored 'General case' 0 N--CA 1.505 2.301 0 CA-C-O 118.671 -0.681 . . . . 0.0 110.364 177.216 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.677 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -82.99 -33.34 26.62 Favored 'General case' 0 N--CA 1.537 3.92 0 CA-C-N 120.071 1.305 . . . . 0.0 109.073 179.532 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -65.56 -40.12 92.47 Favored 'General case' 0 N--CA 1.532 3.649 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 176.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -90.94 -90.61 0.15 Allowed 'General case' 0 N--CA 1.514 2.736 0 N-CA-C 106.143 -1.799 . . . . 0.0 106.143 176.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 152.93 50.73 0.0 OUTLIER 'General case' 1 N--CA 1.558 4.93 0 C-N-CA 127.629 2.372 . . . . 0.0 108.474 176.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.483 HD22 ' CD2' ' B' ' 596' ' ' LEU . 5.7 mt -112.16 13.29 20.54 Favored 'General case' 0 N--CA 1.527 3.389 0 C-N-CA 124.312 1.045 . . . . 0.0 109.855 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.497 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 43.6 p-80 -83.07 3.61 29.74 Favored 'General case' 0 N--CA 1.506 2.341 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 175.566 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.803 ' HA ' HD23 ' A' ' 39' ' ' LEU . 21.2 mt -94.92 -50.95 0.25 Allowed Pre-proline 0 N--CA 1.509 2.503 0 CA-C-O 116.957 -1.497 . . . . 0.0 108.971 -175.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.472 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 3.9 Cg_exo -65.41 -30.87 52.8 Favored 'Trans proline' 0 C--N 1.396 3.036 0 N-CA-C 106.563 -2.13 . . . . 0.0 106.563 170.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.497 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.2 OUTLIER -67.32 -37.83 83.96 Favored 'General case' 0 N--CA 1.52 3.068 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 175.88 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.803 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -73.99 -15.98 61.08 Favored 'General case' 1 N--CA 1.543 4.186 0 CA-C-N 119.549 1.068 . . . . 0.0 110.407 175.956 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -82.58 -17.91 43.18 Favored 'General case' 0 N--CA 1.523 3.218 0 CA-C-N 119.651 1.114 . . . . 0.0 110.151 177.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 pp -99.83 -44.91 5.9 Favored 'General case' 0 N--CA 1.531 3.578 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -177.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 12.8 ptp -109.94 2.04 19.49 Favored 'General case' 1 N--CA 1.551 4.579 0 CA-C-N 118.962 0.801 . . . . 0.0 112.637 -175.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.0 mt -115.89 -65.39 1.19 Allowed 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 117.729 -1.129 . . . . 0.0 110.416 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 35.4 p 119.45 159.66 0.0 OUTLIER Pre-proline 1 N--CA 1.573 5.705 0 C-N-CA 128.32 2.648 . . . . 0.0 109.542 -178.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -67.24 -30.97 36.74 Favored 'Trans proline' 0 C--N 1.39 2.761 0 C-N-CA 122.026 1.817 . . . . 0.0 109.276 175.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -65.63 -26.42 67.81 Favored 'General case' 0 N--CA 1.531 3.604 0 CA-C-O 118.476 -0.773 . . . . 0.0 109.77 176.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -69.64 -33.35 72.5 Favored 'General case' 0 N--CA 1.524 3.275 0 CA-C-O 117.584 -1.198 . . . . 0.0 109.579 178.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 25.3 ptt180 -83.97 -18.12 38.27 Favored 'General case' 0 N--CA 1.53 3.533 0 CA-C-N 119.653 1.115 . . . . 0.0 108.906 174.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -75.23 -21.77 58.38 Favored 'General case' 0 N--CA 1.521 3.116 0 N-CA-C 107.2 -1.408 . . . . 0.0 107.2 173.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.474 ' HB1' ' CZ ' ' A' ' 54' ' ' ARG . . . -92.91 -35.22 13.45 Favored 'General case' 0 N--CA 1.506 2.368 0 CA-C-O 118.124 -0.941 . . . . 0.0 109.05 179.028 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.465 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 25.7 tp -71.99 -21.81 61.52 Favored 'General case' 0 N--CA 1.536 3.873 0 N-CA-C 106.232 -1.766 . . . . 0.0 106.232 172.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.47 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -68.91 -75.55 0.52 Allowed Glycine 0 C--N 1.374 2.648 0 C-N-CA 125.585 1.564 . . . . 0.0 110.684 177.068 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.4 m -66.97 -26.08 66.64 Favored 'General case' 0 N--CA 1.534 3.757 0 CA-C-O 117.774 -1.108 . . . . 0.0 113.389 -177.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.474 ' CZ ' ' HB1' ' A' ' 50' ' ' ALA . 29.2 mtm180 -72.53 -47.06 51.37 Favored 'General case' 0 N--CA 1.532 3.637 0 CA-C-N 120.105 1.321 . . . . 0.0 108.329 178.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.6 t -66.77 -18.41 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.978 0 CA-C-N 119.638 1.108 . . . . 0.0 108.839 174.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.3 mtp180 -73.49 -46.81 45.81 Favored 'General case' 0 N--CA 1.528 3.454 0 CA-C-O 117.16 -1.4 . . . . 0.0 111.792 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.531 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -75.24 -23.54 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.733 0 CA-C-N 121.626 2.012 . . . . 0.0 111.304 -179.049 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.67 HG11 HD11 ' B' ' 541' ' ' LEU . 0.0 OUTLIER -83.46 -47.32 18.16 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.261 0 CA-C-N 120.374 1.443 . . . . 0.0 107.59 -179.529 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -63.88 -29.39 70.58 Favored 'General case' 0 N--CA 1.528 3.446 0 N-CA-C 109.435 -0.579 . . . . 0.0 109.435 177.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -88.28 -17.99 29.52 Favored 'General case' 0 N--CA 1.524 3.237 0 CA-C-O 118.084 -0.96 . . . . 0.0 110.549 177.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.7 mt -79.93 -40.97 26.99 Favored 'General case' 0 N--CA 1.531 3.58 0 CA-C-N 119.439 1.018 . . . . 0.0 108.342 178.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.2 tt -50.05 -36.94 31.06 Favored 'General case' 1 N--CA 1.543 4.184 0 C-N-CA 124.402 1.081 . . . . 0.0 110.537 178.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -80.07 -59.79 2.58 Favored 'General case' 0 N--CA 1.524 3.271 0 N-CA-C 106.824 -1.546 . . . . 0.0 106.824 177.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 57.11 67.59 2.14 Favored Glycine 1 N--CA 1.524 4.506 0 C-N-CA 124.222 0.915 . . . . 0.0 113.264 176.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -130.06 -52.17 1.12 Allowed 'General case' 0 N--CA 1.517 2.921 0 CA-C-N 117.765 0.782 . . . . 0.0 109.027 179.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 73.4 mtp -141.86 15.82 2.12 Favored 'General case' 0 N--CA 1.527 3.387 0 C-N-CA 122.895 0.478 . . . . 0.0 111.761 -179.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 5.1 t -115.67 37.37 3.62 Favored 'General case' 0 N--CA 1.531 3.603 0 CA-C-N 119.517 1.053 . . . . 0.0 111.581 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -114.92 -47.07 2.89 Favored 'General case' 0 N--CA 1.518 2.928 0 C-N-CA 124.381 1.072 . . . . 0.0 109.26 178.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -105.21 -55.6 2.3 Favored 'General case' 0 N--CA 1.526 3.342 0 C-N-CA 123.745 0.818 . . . . 0.0 109.555 -179.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -69.29 -9.2 52.15 Favored 'General case' 0 N--CA 1.52 3.055 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -178.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.705 HD23 HG21 ' A' ' 82' ' ' ILE . 22.1 tp -69.0 -46.99 66.59 Favored 'General case' 0 N--CA 1.528 3.43 0 CA-C-N 119.526 1.057 . . . . 0.0 111.229 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -41.42 -41.42 2.02 Favored 'General case' 1 N--CA 1.549 4.519 0 N-CA-C 114.555 1.316 . . . . 0.0 114.555 -178.093 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -68.32 -36.14 78.85 Favored 'General case' 0 N--CA 1.538 3.943 0 C-N-CA 122.859 0.464 . . . . 0.0 111.94 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -47.61 -55.99 8.15 Favored 'General case' 0 N--CA 1.535 3.814 0 C-N-CA 124.838 1.255 . . . . 0.0 113.383 -178.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -128.81 -38.87 1.64 Allowed 'General case' 0 N--CA 1.532 3.663 0 CA-C-O 118.621 -0.705 . . . . 0.0 111.68 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 125.3 78.98 0.34 Allowed Glycine 1 N--CA 1.522 4.38 0 CA-C-N 119.181 0.9 . . . . 0.0 111.539 178.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.56 104.99 4.11 Favored 'General case' 0 N--CA 1.523 3.204 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 177.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -38.69 168.37 0.01 OUTLIER Glycine 1 N--CA 1.536 5.309 0 C-N-CA 125.576 1.56 . . . . 0.0 116.021 -176.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -80.68 -20.37 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.981 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 177.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.2 -32.49 73.9 Favored 'General case' 0 N--CA 1.522 3.171 0 CA-C-O 117.797 -1.097 . . . . 0.0 110.158 177.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 5.3 p -80.97 -50.17 10.04 Favored 'General case' 0 N--CA 1.536 3.873 0 CA-C-N 119.614 1.097 . . . . 0.0 111.962 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.705 HG21 HD23 ' A' ' 71' ' ' LEU . 0.3 OUTLIER -65.83 -20.73 27.83 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.239 0 CA-C-O 117.831 -1.081 . . . . 0.0 112.888 -178.004 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 46.1 p -107.96 -25.68 11.06 Favored 'General case' 0 N--CA 1.514 2.763 0 CA-C-N 119.794 1.179 . . . . 0.0 111.904 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 14.4 ptt180 -79.28 -21.92 45.4 Favored 'General case' 0 N--CA 1.532 3.633 0 CA-C-N 119.722 1.147 . . . . 0.0 108.3 174.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.14 -32.67 69.13 Favored Glycine 0 N--CA 1.513 3.808 0 N-CA-C 110.259 -1.137 . . . . 0.0 110.259 177.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 51.5 p -67.88 -35.34 78.33 Favored 'General case' 1 N--CA 1.541 4.082 0 CA-C-N 118.579 1.189 . . . . 0.0 111.084 179.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -61.28 -30.53 70.53 Favored 'General case' 1 N--CA 1.541 4.114 0 C-N-CA 123.31 0.644 . . . . 0.0 110.962 179.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.3 m -69.0 -38.91 79.56 Favored 'General case' 0 N--CA 1.534 3.746 0 C-N-CA 123.422 0.689 . . . . 0.0 110.46 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 15.5 mt -59.54 -40.43 87.22 Favored 'General case' 0 N--CA 1.528 3.465 0 C-N-CA 124.02 0.928 . . . . 0.0 111.506 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.08 -19.72 54.6 Favored 'General case' 1 N--CA 1.541 4.112 0 CA-C-O 118.309 -0.853 . . . . 0.0 112.682 -179.322 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -96.27 -35.82 11.12 Favored 'General case' 0 N--CA 1.517 2.92 0 CA-C-N 119.179 0.9 . . . . 0.0 111.907 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -48.1 160.77 0.4 Allowed Pre-proline 1 N--CA 1.55 4.568 0 CA-C-O 118.253 -0.88 . . . . 0.0 113.259 -179.126 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -81.77 150.11 16.34 Favored 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 121.996 1.798 . . . . 0.0 109.946 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -84.11 -25.12 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.865 0 CA-C-O 117.817 -1.087 . . . . 0.0 111.24 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -62.83 -39.48 94.48 Favored 'General case' 0 N--CA 1.518 2.967 0 CA-C-N 120.16 1.346 . . . . 0.0 109.881 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.528 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.4 mp -98.08 -16.35 19.62 Favored 'General case' 0 N--CA 1.513 2.723 0 C-N-CA 123.836 0.854 . . . . 0.0 111.438 178.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -34.93 79.09 Favored 'General case' 1 N--CA 1.544 4.252 0 N-CA-C 103.458 -2.793 . . . . 0.0 103.458 169.348 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -56.17 -39.9 73.08 Favored 'General case' 0 N--CA 1.508 2.432 0 C-N-CA 124.401 1.08 . . . . 0.0 111.144 175.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.593 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 63.8 t90 -63.39 -34.67 78.23 Favored 'General case' 0 N--CA 1.53 3.548 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 177.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.16 -40.85 64.64 Favored 'General case' 0 N--CA 1.539 3.992 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 175.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -67.5 -36.79 81.76 Favored 'General case' 1 N--CA 1.54 4.045 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 175.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.476 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 3.0 mt-10 -60.75 -22.8 64.41 Favored 'General case' 1 N--CA 1.542 4.149 0 C-N-CA 123.635 0.774 . . . . 0.0 110.737 176.645 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -121.81 6.67 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.366 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -177.104 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.36 -55.4 2.52 Favored 'General case' 0 N--CA 1.513 2.715 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 176.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.9 tp . . . . . 0 N--CA 1.529 3.489 0 C-N-CA 124.861 1.264 . . . . 0.0 111.68 -179.768 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 . . . . . 0 N--CA 1.524 3.242 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 519' ' ' TRP . . . . . 0.704 ' CE2' HD22 ' A' ' 39' ' ' LEU . 72.1 t-105 -42.69 -29.27 0.29 Allowed 'General case' 1 N--CA 1.546 4.354 0 C-N-CA 124.373 1.069 . . . . 0.0 113.509 179.676 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 520' ' ' LEU . . . . . 0.571 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.4 mm? -94.34 -29.15 15.17 Favored 'General case' 0 N--CA 1.529 3.476 0 CA-C-O 117.769 -1.11 . . . . 0.0 113.863 -172.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 37.0 mtm180 -64.26 -23.77 67.42 Favored 'General case' 0 N--CA 1.533 3.686 0 N-CA-C 106.266 -1.753 . . . . 0.0 106.266 171.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . 0.545 ' O ' HD23 ' B' ' 526' ' ' LEU . 1.9 m-85 -77.61 -38.74 47.46 Favored 'General case' 0 N--CA 1.514 2.739 0 N-CA-C 106.7 -1.593 . . . . 0.0 106.7 173.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.75 -24.31 34.08 Favored 'Isoleucine or valine' 1 N--CA 1.551 4.622 0 CA-C-O 116.924 -1.512 . . . . 0.0 112.627 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -77.48 -42.14 36.88 Favored 'General case' 1 N--CA 1.542 4.136 0 CA-C-N 121.463 1.938 . . . . 0.0 108.443 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . 0.411 HD12 ' HB ' ' A' ' 103' ' ' VAL . 0.8 OUTLIER -68.79 -28.99 67.26 Favored 'General case' 1 N--CA 1.539 4.003 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 175.473 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' B' B ' 526' ' ' LEU . . . . . 0.545 HD23 ' O ' ' B' ' 522' ' ' PHE . 2.7 mm? -72.25 -32.78 66.99 Favored 'General case' 0 N--CA 1.524 3.243 0 CA-C-O 118.511 -0.757 . . . . 0.0 109.459 177.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 31.1 ttmt -71.6 -28.88 64.11 Favored 'General case' 0 N--CA 1.517 2.901 0 CA-C-O 118.388 -0.815 . . . . 0.0 110.641 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -71.71 -35.94 70.37 Favored 'General case' 0 N--CA 1.533 3.702 0 CA-C-N 119.052 0.842 . . . . 0.0 108.98 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 529' ' ' ALA . . . . . 0.593 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -89.44 -9.38 50.4 Favored 'General case' 0 CA--C 1.578 2.028 0 CA-C-O 118.358 -0.829 . . . . 0.0 110.209 178.132 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -82.07 -34.41 29.42 Favored 'General case' 0 N--CA 1.533 3.678 0 CA-C-N 120.411 1.459 . . . . 0.0 108.574 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -61.69 -41.0 96.99 Favored 'General case' 0 N--CA 1.538 3.926 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 177.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 66.2 m-80 -95.42 -88.9 0.25 Allowed 'General case' 0 N--CA 1.514 2.736 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 176.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.8 p30 153.54 49.74 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.062 0 C-N-CA 127.764 2.426 . . . . 0.0 108.228 177.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 534' ' ' LEU . . . . . 0.528 HD22 ' CD2' ' A' ' 96' ' ' LEU . 10.0 mt -101.73 2.05 38.09 Favored 'General case' 0 N--CA 1.529 3.523 0 C-N-CA 124.561 1.144 . . . . 0.0 111.197 -179.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 535' ' ' HIS . . . . . 0.582 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 56.7 p-80 -80.64 0.48 34.06 Favored 'General case' 0 N--CA 1.511 2.617 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 174.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 536' ' ' LEU . . . . . . . . . . . . . 46.7 mt -93.38 -49.62 0.28 Allowed Pre-proline 0 N--CA 1.509 2.48 0 CA-C-O 116.673 -1.632 . . . . 0.0 109.492 -176.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 537' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -63.16 -36.42 58.13 Favored 'Trans proline' 0 C--N 1.397 3.11 0 N-CA-C 106.539 -2.139 . . . . 0.0 106.539 171.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.28 -49.8 74.93 Favored 'General case' 0 N--CA 1.531 3.594 0 C-N-CA 124.21 1.004 . . . . 0.0 109.19 174.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 13.2 mt -66.17 -21.54 66.33 Favored 'General case' 1 N--CA 1.54 4.04 0 CA-C-O 118.086 -0.959 . . . . 0.0 112.599 -178.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 21.9 t30 -70.77 -12.31 61.47 Favored 'General case' 0 N--CA 1.534 3.752 0 CA-C-N 119.297 0.953 . . . . 0.0 111.514 178.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 541' ' ' LEU . . . . . 0.67 HD11 HG11 ' A' ' 58' ' ' VAL . 0.0 OUTLIER -117.29 -37.4 3.53 Favored 'General case' 0 N--CA 1.52 3.059 0 CA-C-N 119.212 0.914 . . . . 0.0 110.344 -178.662 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 542' ' ' MET . . . . . 0.659 ' N ' HD13 ' B' ' 541' ' ' LEU . 6.7 ptt? -96.95 9.77 41.02 Favored 'General case' 1 N--CA 1.544 4.234 0 CA-C-N 119.618 1.099 . . . . 0.0 112.796 -179.001 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 543' ' ' LEU . . . . . 0.473 ' O ' HG23 ' B' ' 544' ' ' THR . 1.5 tp -132.05 -93.42 0.37 Allowed 'General case' 0 N--CA 1.53 3.547 0 CA-C-N 119.898 1.226 . . . . 0.0 111.995 178.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 544' ' ' THR . . . . . 0.473 HG23 ' O ' ' B' ' 543' ' ' LEU . 1.2 p 147.3 135.7 0.0 OUTLIER Pre-proline 1 N--CA 1.566 5.352 0 C-N-CA 127.101 2.161 . . . . 0.0 107.511 -178.875 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -60.15 -33.98 94.61 Favored 'Trans proline' 0 N--CA 1.519 3.01 0 C-N-CA 122.734 2.289 . . . . 0.0 112.137 178.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -64.47 -34.73 78.89 Favored 'General case' 0 N--CA 1.536 3.864 0 CA-C-O 118.856 -0.592 . . . . 0.0 111.651 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -75.5 -29.78 59.62 Favored 'General case' 0 N--CA 1.524 3.259 0 CA-C-O 117.46 -1.257 . . . . 0.0 111.133 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 548' ' ' ARG . . . . . 0.476 ' HB2' ' HB2' ' A' ' 19' ' ' TRP . 32.9 ptt180 -76.3 -24.44 54.37 Favored 'General case' 0 N--CA 1.532 3.627 0 CA-C-N 120.238 1.381 . . . . 0.0 109.152 175.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -64.29 -43.25 95.35 Favored 'General case' 0 N--CA 1.536 3.855 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 173.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -73.02 -21.66 60.78 Favored 'General case' 0 N--CA 1.517 2.904 0 CA-C-O 117.104 -1.427 . . . . 0.0 110.649 176.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 551' ' ' LEU . . . . . 0.681 HD22 ' CZ3' ' A' ' 19' ' ' TRP . 10.9 tp -75.29 -23.39 57.38 Favored 'General case' 0 N--CA 1.521 3.095 0 CA-C-N 120.287 1.403 . . . . 0.0 107.909 174.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -73.71 -59.57 4.02 Favored Glycine 0 N--CA 1.499 2.889 0 N-CA-C 108.67 -1.772 . . . . 0.0 108.67 178.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 1.7 t -65.17 -26.13 68.03 Favored 'General case' 0 N--CA 1.535 3.813 0 CA-C-N 117.95 0.875 . . . . 0.0 111.363 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 45.7 mtt180 -62.2 -52.99 61.56 Favored 'General case' 1 N--CA 1.543 4.195 0 N-CA-C 107.063 -1.458 . . . . 0.0 107.063 176.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 555' ' ' VAL . . . . . 0.488 HG21 ' HB2' ' A' ' 22' ' ' PHE . 18.0 t -71.96 -14.91 17.78 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.547 0 CA-C-O 118.15 -0.929 . . . . 0.0 110.553 178.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 76.1 mtt-85 -77.56 -46.76 21.29 Favored 'General case' 0 N--CA 1.527 3.382 0 CA-C-N 119.88 1.218 . . . . 0.0 110.725 178.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 557' ' ' ILE . . . . . 0.561 ' O ' HD13 ' B' ' 561' ' ' LEU . 0.0 OUTLIER -72.15 -23.98 22.1 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.669 0 CA-C-N 119.622 1.101 . . . . 0.0 110.524 -177.712 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 558' ' ' VAL . . . . . 0.469 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -87.1 -53.21 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.871 0 CA-C-N 119.943 1.247 . . . . 0.0 107.698 179.941 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -58.56 -24.64 61.21 Favored 'General case' 0 N--CA 1.533 3.675 0 CA-C-O 118.516 -0.754 . . . . 0.0 110.969 178.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -91.25 -27.34 18.51 Favored 'General case' 0 N--CA 1.525 3.282 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.385 178.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 561' ' ' LEU . . . . . 0.561 HD13 ' O ' ' B' ' 557' ' ' ILE . 1.9 mp -69.57 -43.93 71.87 Favored 'General case' 1 N--CA 1.541 4.108 0 CA-C-N 119.409 1.004 . . . . 0.0 109.156 178.775 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 42.7 mt -58.29 -21.62 49.6 Favored 'General case' 0 N--CA 1.537 3.897 0 C-N-CA 123.762 0.825 . . . . 0.0 112.226 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 12.3 mmm180 -80.23 -47.94 13.85 Favored 'General case' 0 N--CA 1.53 3.567 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 67.08 38.57 92.53 Favored Glycine 1 N--CA 1.525 4.613 0 CA-C-O 118.783 -1.009 . . . . 0.0 113.647 177.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -97.76 -57.36 2.25 Favored 'General case' 0 N--CA 1.517 2.908 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 178.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 16.3 ptt? -170.52 79.52 0.09 Allowed 'General case' 0 N--CA 1.536 3.839 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 178.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 75.7 m -137.4 3.67 2.59 Favored 'General case' 0 N--CA 1.516 2.826 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -176.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -88.88 -76.51 0.4 Allowed 'General case' 0 N--CA 1.524 3.247 0 CA-C-N 119.981 1.264 . . . . 0.0 111.583 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.97 -33.85 17.08 Favored 'General case' 0 N--CA 1.532 3.675 0 CA-C-N 118.995 0.816 . . . . 0.0 112.879 -177.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -83.49 -3.5 57.67 Favored 'General case' 0 N--CA 1.522 3.138 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -178.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 571' ' ' LEU . . . . . 0.684 HD23 HD11 ' B' ' 582' ' ' ILE . 24.2 tp -82.5 -45.47 14.66 Favored 'General case' 0 N--CA 1.53 3.532 0 CA-C-N 119.744 1.156 . . . . 0.0 111.507 -178.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -41.43 -32.4 0.32 Allowed 'General case' 1 N--CA 1.55 4.536 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -177.796 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -73.51 -40.34 64.14 Favored 'General case' 0 N--CA 1.532 3.647 0 CA-C-N 118.454 0.57 . . . . 0.0 111.393 -177.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -51.69 -61.56 2.18 Favored 'General case' 0 N--CA 1.53 3.53 0 C-N-CA 123.989 0.916 . . . . 0.0 113.191 -178.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -114.77 -50.98 2.76 Favored 'General case' 0 N--CA 1.536 3.827 0 CA-C-N 118.718 0.69 . . . . 0.0 110.934 -179.098 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 130.91 80.3 0.21 Allowed Glycine 1 N--CA 1.518 4.154 0 N-CA-C 109.988 -1.245 . . . . 0.0 109.988 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -136.6 99.77 4.16 Favored 'General case' 0 N--CA 1.52 3.041 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 178.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -41.32 168.24 0.01 OUTLIER Glycine 1 N--CA 1.541 5.653 0 C-N-CA 124.952 1.263 . . . . 0.0 115.319 -176.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 579' ' ' ILE . . . . . 0.636 HD13 ' CG2' ' B' ' 582' ' ' ILE . 0.6 OUTLIER -80.51 -22.37 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.108 0 CA-C-N 118.273 1.036 . . . . 0.0 108.453 178.625 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -67.08 -39.86 86.87 Favored 'General case' 0 N--CA 1.53 3.561 0 CA-C-N 119.619 1.099 . . . . 0.0 110.139 177.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.33 -39.14 33.51 Favored 'General case' 1 N--CA 1.544 4.248 0 CA-C-N 118.759 0.709 . . . . 0.0 112.027 -179.832 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 582' ' ' ILE . . . . . 0.684 HD11 HD23 ' B' ' 571' ' ' LEU . 2.0 tt -65.53 -36.99 78.95 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.502 0 C-N-CA 123.502 0.721 . . . . 0.0 111.597 -176.2 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 69.9 p -96.92 -31.75 12.4 Favored 'General case' 0 N--CA 1.512 2.672 0 CA-C-O 118.175 -0.917 . . . . 0.0 111.132 -178.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 20.9 ptt180 -70.17 -21.39 63.06 Favored 'General case' 0 N--CA 1.535 3.789 0 CA-C-N 119.613 1.097 . . . . 0.0 109.424 175.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -68.1 -35.36 83.41 Favored Glycine 1 N--CA 1.519 4.21 0 N-CA-C 108.046 -2.022 . . . . 0.0 108.046 174.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 5.5 t -61.77 -41.27 97.48 Favored 'General case' 1 N--CA 1.54 4.028 0 CA-C-N 117.701 0.75 . . . . 0.0 110.226 177.094 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -59.65 -23.2 62.84 Favored 'General case' 1 N--CA 1.541 4.099 0 C-N-CA 123.528 0.731 . . . . 0.0 112.157 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 75.3 m -62.12 -46.68 87.96 Favored 'General case' 0 N--CA 1.535 3.797 0 C-N-CA 123.535 0.734 . . . . 0.0 110.828 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 52.3 mt -59.96 -49.41 77.77 Favored 'General case' 0 N--CA 1.524 3.256 0 C-N-CA 124.206 1.002 . . . . 0.0 111.505 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -54.63 -26.31 32.18 Favored 'General case' 1 N--CA 1.547 4.397 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -178.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -86.76 -43.44 12.54 Favored 'General case' 0 N--CA 1.515 2.823 0 CA-C-N 118.395 0.543 . . . . 0.0 110.328 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -57.72 161.8 5.86 Favored Pre-proline 1 N--CA 1.54 4.066 0 CA-C-O 118.247 -0.882 . . . . 0.0 112.545 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -80.08 162.38 23.23 Favored 'Trans proline' 0 C--N 1.378 2.13 0 C-N-CA 121.918 1.745 . . . . 0.0 110.779 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -83.72 -25.87 7.6 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.894 0 CA-C-O 117.471 -1.252 . . . . 0.0 112.077 -178.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -63.6 -41.2 98.35 Favored 'General case' 0 N--CA 1.519 2.993 0 CA-C-N 120.428 1.467 . . . . 0.0 110.398 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 596' ' ' LEU . . . . . 0.483 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.8 mp -98.83 -14.82 19.49 Favored 'General case' 0 N--CA 1.514 2.745 0 C-N-CA 123.557 0.743 . . . . 0.0 111.636 178.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -32.42 74.06 Favored 'General case' 1 N--CA 1.542 4.171 0 N-CA-C 102.807 -3.034 . . . . 0.0 102.807 166.8 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -57.12 -36.34 70.54 Favored 'General case' 0 N--CA 1.517 2.875 0 C-N-CA 124.885 1.274 . . . . 0.0 110.796 175.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 599' ' ' TRP . . . . . 0.601 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 44.2 t90 -61.13 -36.12 78.9 Favored 'General case' 0 N--CA 1.536 3.872 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 177.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 10.3 mp -56.58 -38.94 72.67 Favored 'General case' 1 N--CA 1.544 4.255 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 176.537 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -68.39 -29.88 68.68 Favored 'General case' 0 N--CA 1.537 3.885 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 175.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 602' ' ' GLU . . . . . 0.419 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.6 OUTLIER -69.14 -26.63 64.98 Favored 'General case' 1 N--CA 1.542 4.142 0 C-N-CA 124.411 1.084 . . . . 0.0 110.595 176.622 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' B' B ' 603' ' ' VAL . . . . . 0.546 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.0 OUTLIER -103.87 -14.33 8.56 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.639 0 CA-C-O 117.85 -1.071 . . . . 0.0 112.262 -175.962 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 7.0 mp -92.13 -57.53 2.68 Favored 'General case' 0 N--CA 1.522 3.156 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 173.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 6.1 mp . . . . . 0 N--CA 1.521 3.105 0 CA-C-O 117.693 -1.146 . . . . 0.0 108.159 177.632 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 . . . . . 0 N--CA 1.527 3.408 0 CA-C-O 118.909 -0.567 . . . . 0.0 112.289 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.535 ' CZ3' HD22 ' B' ' 551' ' ' LEU . 73.0 t-105 -51.18 -43.97 61.43 Favored 'General case' 1 N--CA 1.54 4.074 0 CA-C-N 119.193 0.906 . . . . 0.0 111.215 -178.548 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.473 HD22 ' N ' ' A' ' 20' ' ' LEU . 3.0 mm? -83.77 -23.29 31.58 Favored 'General case' 0 N--CA 1.517 2.893 0 CA-C-O 117.542 -1.218 . . . . 0.0 111.695 -176.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -58.4 -28.74 65.49 Favored 'General case' 0 N--CA 1.536 3.868 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 173.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.583 ' CG ' HD21 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -85.5 -36.14 20.73 Favored 'General case' 0 N--CA 1.504 2.232 0 CA-C-O 115.766 -2.064 . . . . 0.0 109.347 174.068 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 48.6 t -71.24 -27.47 29.42 Favored 'Isoleucine or valine' 1 N--CA 1.576 5.833 0 CA-C-N 121.762 2.074 . . . . 0.0 112.754 -175.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -77.39 -50.1 13.48 Favored 'General case' 0 N--CA 1.533 3.718 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 179.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.416 HD11 ' HB ' ' B' ' 603' ' ' VAL . 0.6 OUTLIER -62.65 -25.45 68.13 Favored 'General case' 0 N--CA 1.539 3.996 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 174.996 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.428 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -70.06 -38.66 75.84 Favored 'General case' 0 N--CA 1.517 2.885 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 178.093 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.1 tttt -64.36 -22.57 67.0 Favored 'General case' 0 N--CA 1.527 3.388 0 CA-C-O 118.452 -0.785 . . . . 0.0 111.049 177.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -72.27 -39.66 68.19 Favored 'General case' 0 N--CA 1.53 3.564 0 CA-C-N 119.003 0.82 . . . . 0.0 108.868 176.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.633 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -91.05 -6.33 54.02 Favored 'General case' 0 N--CA 1.506 2.332 0 CA-C-O 118.573 -0.727 . . . . 0.0 110.793 177.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.04 -33.86 26.38 Favored 'General case' 0 N--CA 1.533 3.69 0 CA-C-N 120.41 1.459 . . . . 0.0 109.005 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -65.11 -42.66 93.77 Favored 'General case' 0 N--CA 1.531 3.604 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 176.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 63.3 m-80 -86.87 -89.35 0.12 Allowed 'General case' 0 N--CA 1.516 2.864 0 N-CA-C 106.563 -1.643 . . . . 0.0 106.563 176.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 150.54 52.47 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.909 0 C-N-CA 128.013 2.525 . . . . 0.0 107.959 177.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.467 HD22 ' CD2' ' B' ' 596' ' ' LEU . 6.9 mt -114.62 11.88 17.07 Favored 'General case' 0 N--CA 1.527 3.384 0 C-N-CA 124.698 1.199 . . . . 0.0 110.245 -178.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.52 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 46.8 p-80 -80.61 0.85 32.28 Favored 'General case' 0 N--CA 1.51 2.556 0 C-N-CA 123.505 0.722 . . . . 0.0 109.225 175.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.765 ' HA ' HD23 ' A' ' 39' ' ' LEU . 22.4 mt -93.06 -50.82 0.27 Allowed Pre-proline 0 N--CA 1.511 2.592 0 CA-C-O 116.971 -1.49 . . . . 0.0 109.207 -175.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.456 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 7.6 Cg_exo -61.34 -35.16 85.46 Favored 'Trans proline' 0 C--N 1.396 3.068 0 N-CA-C 106.425 -2.183 . . . . 0.0 106.425 170.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.432 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 2.1 tm? -64.76 -39.21 93.24 Favored 'General case' 0 N--CA 1.512 2.645 0 C-N-CA 124.057 0.943 . . . . 0.0 109.974 176.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.765 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -72.08 -22.53 61.35 Favored 'General case' 1 N--CA 1.546 4.372 0 CA-C-N 119.533 1.06 . . . . 0.0 111.791 -179.862 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -96.31 21.82 8.56 Favored 'General case' 1 N--CA 1.539 4.003 0 CA-C-N 119.926 1.239 . . . . 0.0 110.049 176.454 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.614 HD13 ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -127.08 -45.63 1.55 Allowed 'General case' 0 N--CA 1.519 2.993 0 CA-C-O 118.056 -0.973 . . . . 0.0 109.361 179.763 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.614 ' N ' HD13 ' A' ' 41' ' ' LEU . 9.9 ptt? -116.86 11.01 14.32 Favored 'General case' 1 N--CA 1.551 4.618 0 CA-C-N 119.711 1.142 . . . . 0.0 112.32 179.521 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.7 mp -122.86 -94.05 0.5 Allowed 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 177.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 157.31 169.28 0.02 OUTLIER Pre-proline 1 N--CA 1.566 5.358 0 C-N-CA 125.476 1.511 . . . . 0.0 110.041 178.894 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -69.0 -37.73 10.56 Favored 'Trans proline' 0 C--N 1.39 2.735 0 C-N-CA 122.066 1.844 . . . . 0.0 107.586 172.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -66.19 -18.57 65.43 Favored 'General case' 0 N--CA 1.527 3.395 0 CA-C-O 117.942 -1.027 . . . . 0.0 110.895 176.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -71.09 -37.57 72.41 Favored 'General case' 0 N--CA 1.529 3.478 0 CA-C-N 119.613 1.097 . . . . 0.0 108.613 178.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -84.91 -15.89 42.96 Favored 'General case' 0 N--CA 1.531 3.582 0 CA-C-O 118.117 -0.944 . . . . 0.0 109.826 175.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -73.07 -29.43 62.95 Favored 'General case' 0 N--CA 1.525 3.291 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 173.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.561 ' HB1' ' NH1' ' A' ' 54' ' ' ARG . . . -88.01 -36.28 17.1 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-O 117.918 -1.039 . . . . 0.0 109.725 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.46 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 23.1 tp -69.75 -22.8 63.33 Favored 'General case' 0 N--CA 1.537 3.879 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 173.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.439 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -67.47 -73.36 0.67 Allowed Glycine 0 N--CA 1.496 2.7 0 C-N-CA 125.294 1.426 . . . . 0.0 111.277 177.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.9 m -72.06 -24.56 61.54 Favored 'General case' 0 N--CA 1.536 3.86 0 CA-C-O 118.144 -0.932 . . . . 0.0 112.785 -177.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.561 ' NH1' ' HB1' ' A' ' 50' ' ' ALA . 76.9 mtm-85 -68.15 -50.27 55.63 Favored 'General case' 0 N--CA 1.531 3.593 0 CA-C-N 120.074 1.306 . . . . 0.0 107.628 177.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 51' ' ' LEU . 11.5 t -65.98 -17.9 23.06 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.823 0 CA-C-O 118.217 -0.897 . . . . 0.0 109.88 177.022 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.7 mtt-85 -69.08 -56.92 6.24 Favored 'General case' 0 N--CA 1.529 3.515 0 CA-C-N 119.741 1.155 . . . . 0.0 111.444 177.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.421 HG22 HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -68.9 -25.63 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.757 0 CA-C-N 119.825 1.193 . . . . 0.0 112.087 -177.076 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -83.71 -53.54 11.02 Favored 'Isoleucine or valine' 1 N--CA 1.549 4.517 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 -179.653 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -61.6 -18.73 60.58 Favored 'General case' 0 N--CA 1.527 3.392 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.063 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -96.56 -23.26 16.61 Favored 'General case' 0 N--CA 1.526 3.344 0 CA-C-O 118.174 -0.917 . . . . 0.0 110.305 176.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.6 mt -75.76 -51.74 11.99 Favored 'General case' 0 N--CA 1.534 3.758 0 CA-C-N 119.535 1.062 . . . . 0.0 108.979 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 36.1 mt -54.32 -26.4 29.4 Favored 'General case' 0 N--CA 1.538 3.953 0 C-N-CA 124.163 0.985 . . . . 0.0 113.293 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 30.1 mmm180 -77.86 -45.68 23.58 Favored 'General case' 0 N--CA 1.531 3.584 0 CA-C-N 118.755 0.707 . . . . 0.0 111.278 -178.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.15 56.51 2.41 Favored Glycine 0 N--CA 1.515 3.96 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -98.71 -40.27 8.24 Favored 'General case' 0 N--CA 1.526 3.364 0 CA-C-O 118.713 -0.66 . . . . 0.0 110.074 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 76.8 mtp 121.18 69.0 0.0 OUTLIER 'General case' 1 N--CA 1.544 4.264 0 C-N-CA 128.075 2.55 . . . . 0.0 104.997 -178.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.419 ' HB3' HD22 ' A' ' 71' ' ' LEU . 23.4 m -117.8 38.48 3.62 Favored 'General case' 0 N--CA 1.52 3.03 0 CA-C-N 115.109 -0.951 . . . . 0.0 110.771 -177.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -113.16 -46.38 3.09 Favored 'General case' 0 N--CA 1.521 3.107 0 C-N-CA 123.751 0.82 . . . . 0.0 110.194 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -104.49 -56.59 2.16 Favored 'General case' 0 N--CA 1.528 3.429 0 C-N-CA 123.547 0.739 . . . . 0.0 110.968 -178.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -75.28 -0.18 18.73 Favored 'General case' 0 N--CA 1.519 2.983 0 N-CA-C 114.063 1.135 . . . . 0.0 114.063 -176.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.582 HD23 HG21 ' A' ' 82' ' ' ILE . 24.6 tp -85.35 -47.06 10.38 Favored 'General case' 0 N--CA 1.527 3.392 0 CA-C-N 119.906 1.23 . . . . 0.0 112.458 -178.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -42.65 -30.58 0.38 Allowed 'General case' 1 N--CA 1.552 4.635 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 -176.739 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -71.86 -41.13 68.44 Favored 'General case' 0 N--CA 1.535 3.793 0 CA-C-N 118.829 0.74 . . . . 0.0 111.234 -178.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -47.57 -53.35 14.83 Favored 'General case' 0 N--CA 1.533 3.702 0 C-N-CA 125.078 1.351 . . . . 0.0 113.438 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.1 pp -125.06 -39.67 2.22 Favored 'General case' 0 N--CA 1.536 3.85 0 CA-C-O 118.717 -0.659 . . . . 0.0 111.938 -178.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 112.72 64.78 0.47 Allowed Glycine 1 N--CA 1.523 4.487 0 CA-C-N 118.976 0.807 . . . . 0.0 111.621 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -127.48 108.95 11.26 Favored 'General case' 0 N--CA 1.523 3.211 0 N-CA-C 106.047 -1.835 . . . . 0.0 106.047 176.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -34.65 165.37 0.01 OUTLIER Glycine 1 N--CA 1.536 5.356 0 C-N-CA 125.863 1.696 . . . . 0.0 116.658 -176.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -78.64 -23.67 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.903 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 177.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.85 -34.37 75.85 Favored 'General case' 0 N--CA 1.521 3.076 0 CA-C-O 117.689 -1.148 . . . . 0.0 109.835 177.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 17.8 p -74.89 -56.62 4.57 Favored 'General case' 0 N--CA 1.53 3.568 0 CA-C-N 119.342 0.974 . . . . 0.0 111.965 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.582 HG21 HD23 ' A' ' 71' ' ' LEU . 0.5 OUTLIER -62.06 -24.54 34.88 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.173 0 CA-C-O 118.174 -0.917 . . . . 0.0 113.469 -176.829 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 71.9 p -101.07 -26.27 13.76 Favored 'General case' 0 N--CA 1.51 2.567 0 CA-C-O 117.955 -1.021 . . . . 0.0 110.913 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 26.2 ptt180 -75.77 -22.83 56.07 Favored 'General case' 0 N--CA 1.535 3.806 0 CA-C-N 119.82 1.191 . . . . 0.0 108.545 174.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -68.15 -32.22 76.09 Favored Glycine 0 N--CA 1.516 3.979 0 N-CA-C 109.043 -1.623 . . . . 0.0 109.043 175.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 6.6 t -63.68 -31.5 72.69 Favored 'General case' 0 N--CA 1.536 3.869 0 CA-C-N 118.18 0.99 . . . . 0.0 110.117 177.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -59.65 -33.41 71.5 Favored 'General case' 1 N--CA 1.545 4.291 0 C-N-CA 123.604 0.762 . . . . 0.0 110.311 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.15 -31.98 73.44 Favored 'General case' 0 N--CA 1.538 3.932 0 C-N-CA 123.791 0.837 . . . . 0.0 111.3 179.564 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 38.8 mt -57.26 -44.21 83.7 Favored 'General case' 0 N--CA 1.531 3.619 0 C-N-CA 123.759 0.824 . . . . 0.0 111.232 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -65.99 -20.29 66.14 Favored 'General case' 0 N--CA 1.537 3.921 0 CA-C-O 118.193 -0.908 . . . . 0.0 112.901 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.57 -32.06 18.32 Favored 'General case' 0 N--CA 1.523 3.183 0 CA-C-N 119.323 0.965 . . . . 0.0 113.133 -178.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.87 153.23 88.84 Favored Pre-proline 1 N--CA 1.54 4.07 0 CA-C-O 118.087 -0.959 . . . . 0.0 113.527 -178.218 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -87.41 171.59 6.29 Favored 'Trans proline' 0 C--N 1.387 2.576 0 C-N-CA 122.695 2.263 . . . . 0.0 111.084 177.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.4 t -87.76 -27.22 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.306 0 CA-C-O 117.803 -1.094 . . . . 0.0 111.216 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -62.14 -41.4 98.23 Favored 'General case' 0 N--CA 1.518 2.942 0 CA-C-N 120.187 1.358 . . . . 0.0 109.598 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.508 ' CD2' HD22 ' B' ' 534' ' ' LEU . 6.8 mp -98.84 -9.96 23.59 Favored 'General case' 0 N--CA 1.507 2.417 0 C-N-CA 123.569 0.748 . . . . 0.0 111.666 178.357 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -35.99 82.75 Favored 'General case' 1 N--CA 1.545 4.298 0 N-CA-C 102.528 -3.138 . . . . 0.0 102.528 166.894 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -52.6 -35.25 53.95 Favored 'General case' 0 N--CA 1.52 3.036 0 C-N-CA 124.316 1.047 . . . . 0.0 111.499 175.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.614 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 43.1 t90 -67.68 -39.26 84.49 Favored 'General case' 0 N--CA 1.53 3.563 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 177.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.403 ' O ' HD13 ' A' ' 104' ' ' LEU . 10.4 mp -55.61 -30.13 60.35 Favored 'General case' 0 N--CA 1.536 3.853 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 176.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -74.3 -37.79 63.55 Favored 'General case' 0 N--CA 1.532 3.652 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 175.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.59 -21.4 65.59 Favored 'General case' 0 N--CA 1.535 3.797 0 CA-C-O 118.325 -0.845 . . . . 0.0 111.581 177.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.5 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -119.73 -8.14 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.838 0 CA-C-O 117.884 -1.055 . . . . 0.0 113.247 -176.131 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.403 HD13 ' O ' ' A' ' 100' ' ' LEU . 8.2 mp -105.68 -51.31 3.02 Favored 'General case' 0 N--CA 1.531 3.602 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 176.192 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.0 tt . . . . . 0 N--CA 1.536 3.855 0 C-N-CA 124.141 0.976 . . . . 0.0 110.381 179.678 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 . . . . . 0 N--CA 1.524 3.259 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 519' ' ' TRP . . . . . 0.66 ' CE2' HD22 ' A' ' 39' ' ' LEU . 71.0 t-105 -42.81 -28.33 0.24 Allowed 'General case' 1 N--CA 1.552 4.639 0 C-N-CA 124.388 1.075 . . . . 0.0 113.685 -179.694 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 520' ' ' LEU . . . . . 0.573 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.2 mm? -96.09 -29.92 13.83 Favored 'General case' 0 N--CA 1.527 3.392 0 CA-C-O 117.895 -1.05 . . . . 0.0 113.449 -172.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 23.3 mtp180 -62.23 -26.17 68.23 Favored 'General case' 1 N--CA 1.54 4.055 0 N-CA-C 105.485 -2.043 . . . . 0.0 105.485 171.651 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . 0.521 ' O ' HD23 ' B' ' 526' ' ' LEU . 1.8 m-85 -78.11 -39.77 40.33 Favored 'General case' 0 N--CA 1.515 2.8 0 N-CA-C 107.397 -1.334 . . . . 0.0 107.397 174.253 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 37.1 t -66.55 -23.36 31.29 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.259 0 CA-C-N 119.96 1.254 . . . . 0.0 112.493 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -78.01 -52.01 9.45 Favored 'General case' 0 N--CA 1.532 3.654 0 CA-C-N 120.345 1.429 . . . . 0.0 108.19 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 1.2 tp -68.16 -23.04 64.83 Favored 'General case' 0 N--CA 1.53 3.528 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 176.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 526' ' ' LEU . . . . . 0.521 HD23 ' O ' ' B' ' 522' ' ' PHE . 1.7 mm? -71.23 -36.16 71.72 Favored 'General case' 0 N--CA 1.522 3.157 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 176.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 527' ' ' LYS . . . . . 0.462 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 27.3 ttmt -66.21 -21.69 66.32 Favored 'General case' 0 N--CA 1.516 2.872 0 CA-C-O 118.383 -0.818 . . . . 0.0 111.003 177.029 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -72.43 -39.41 67.87 Favored 'General case' 0 N--CA 1.53 3.566 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 529' ' ' ALA . . . . . 0.614 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -91.63 -7.83 48.94 Favored 'General case' 0 N--CA 1.506 2.362 0 CA-C-O 118.317 -0.849 . . . . 0.0 110.802 177.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 530' ' ' TYR . . . . . 0.462 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.6 OUTLIER -81.69 -33.06 31.41 Favored 'General case' 0 N--CA 1.531 3.596 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 177.513 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -54.61 -49.31 70.76 Favored 'General case' 0 N--CA 1.536 3.833 0 C-N-CA 124.557 1.143 . . . . 0.0 108.255 176.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -93.38 -85.12 0.28 Allowed 'General case' 0 N--CA 1.515 2.816 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 177.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.9 p30 153.53 45.83 0.0 OUTLIER 'General case' 1 N--CA 1.559 4.989 0 C-N-CA 127.707 2.403 . . . . 0.0 108.44 177.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 534' ' ' LEU . . . . . 0.508 HD22 ' CD2' ' A' ' 96' ' ' LEU . 6.3 mt -103.26 13.31 34.16 Favored 'General case' 0 N--CA 1.518 2.953 0 C-N-CA 124.854 1.262 . . . . 0.0 110.068 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 535' ' ' HIS . . . . . 0.579 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 37.1 p-80 -84.37 4.15 32.63 Favored 'General case' 0 N--CA 1.512 2.657 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 174.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 536' ' ' LEU . . . . . 0.455 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 26.9 mt -94.83 -50.79 0.25 Allowed Pre-proline 0 N--CA 1.502 2.128 0 CA-C-O 116.302 -1.809 . . . . 0.0 108.296 -176.205 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 537' ' ' PRO . . . . . 0.455 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 5.7 Cg_exo -67.18 -32.32 34.04 Favored 'Trans proline' 0 C--N 1.4 3.244 0 C-N-CA 122.109 1.873 . . . . 0.0 107.485 170.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 538' ' ' LEU . . . . . 0.466 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 0.3 OUTLIER -65.86 -40.21 91.47 Favored 'General case' 0 N--CA 1.528 3.448 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 174.812 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 7.7 mt -67.76 -23.14 65.2 Favored 'General case' 1 N--CA 1.54 4.067 0 CA-C-O 118.289 -0.863 . . . . 0.0 109.965 176.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -76.71 -29.03 56.09 Favored 'General case' 0 N--CA 1.523 3.202 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 177.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 5.5 tp -70.84 -43.99 67.36 Favored 'General case' 0 N--CA 1.532 3.63 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 177.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -96.96 47.95 1.05 Allowed 'General case' 0 CA--C 1.61 3.251 0 N-CA-C 101.44 -3.541 . . . . 0.0 101.44 171.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -29.34 -91.08 0.0 OUTLIER 'General case' 0 N--CA 1.534 3.766 0 C-N-CA 127.698 2.399 . . . . 0.0 116.246 -171.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 38.0 p 44.08 85.56 0.16 Allowed Pre-proline 0 N--CA 1.531 3.602 0 C-N-CA 124.988 1.315 . . . . 0.0 112.783 -178.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -67.43 -27.89 39.49 Favored 'Trans proline' 0 C--N 1.395 2.994 0 C-N-CA 122.417 2.078 . . . . 0.0 110.032 177.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -58.68 -17.45 22.68 Favored 'General case' 0 N--CA 1.538 3.939 0 CA-C-O 118.491 -0.766 . . . . 0.0 111.169 176.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -66.55 -49.69 65.62 Favored 'General case' 0 N--CA 1.527 3.423 0 CA-C-N 119.25 0.932 . . . . 0.0 108.819 178.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 24.4 ptt-85 -80.55 -11.62 59.63 Favored 'General case' 0 N--CA 1.522 3.165 0 CA-C-O 118.097 -0.954 . . . . 0.0 112.295 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -72.15 -53.58 12.3 Favored 'General case' 0 N--CA 1.534 3.729 0 N-CA-C 106.533 -1.655 . . . . 0.0 106.533 174.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -82.91 -12.33 57.45 Favored 'General case' 0 N--CA 1.508 2.459 0 CA-C-O 117.301 -1.333 . . . . 0.0 111.926 178.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 551' ' ' LEU . . . . . 0.583 HD21 ' CG ' ' A' ' 22' ' ' PHE . 18.8 tp -82.2 -31.6 30.28 Favored 'General case' 0 N--CA 1.528 3.443 0 CA-C-N 121.088 1.767 . . . . 0.0 107.69 175.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -72.3 -53.66 8.69 Favored Glycine 0 N--CA 1.496 2.69 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 178.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 5.3 m -71.03 -28.41 64.37 Favored 'General case' 0 N--CA 1.534 3.741 0 CA-C-O 117.96 -1.019 . . . . 0.0 111.973 -178.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -68.33 -55.24 12.76 Favored 'General case' 1 N--CA 1.543 4.205 0 N-CA-C 106.546 -1.65 . . . . 0.0 106.546 176.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 38.3 t -59.07 -18.61 14.02 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.999 0 CA-C-O 117.937 -1.03 . . . . 0.0 110.428 176.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 5.2 mmm180 -79.81 -44.11 21.18 Favored 'General case' 0 N--CA 1.526 3.356 0 CA-C-O 117.436 -1.269 . . . . 0.0 111.862 178.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 557' ' ' ILE . . . . . 0.456 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -72.72 -20.63 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.569 0 CA-C-N 121.365 1.893 . . . . 0.0 110.715 -179.941 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 558' ' ' VAL . . . . . 0.456 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -88.92 -51.04 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.871 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 -179.584 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -60.0 -23.58 63.77 Favored 'General case' 0 N--CA 1.53 3.569 0 CA-C-O 118.892 -0.575 . . . . 0.0 110.483 177.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -95.93 -23.15 17.0 Favored 'General case' 0 N--CA 1.523 3.191 0 CA-C-O 117.875 -1.059 . . . . 0.0 111.151 178.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 6.1 tp -80.84 -60.04 2.45 Favored 'General case' 0 N--CA 1.529 3.496 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 178.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 38.8 mt -39.11 -37.44 0.39 Allowed 'General case' 1 N--CA 1.549 4.482 0 C-N-CA 126.051 1.74 . . . . 0.0 112.415 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 29.6 mmm180 -83.47 -53.41 5.72 Favored 'General case' 0 N--CA 1.519 3.002 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 79.3 54.02 4.2 Favored Glycine 0 N--CA 1.509 3.537 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 178.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -83.15 -63.02 1.44 Allowed 'General case' 0 N--CA 1.518 2.954 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 178.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 19.0 ttm 176.75 85.29 0.01 OUTLIER 'General case' 1 N--CA 1.539 4.011 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 177.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 58.8 m -141.54 36.24 1.65 Allowed 'General case' 0 N--CA 1.518 2.944 0 C-N-CA 122.706 0.403 . . . . 0.0 111.463 -177.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -100.4 -47.75 4.8 Favored 'General case' 0 N--CA 1.522 3.157 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 177.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 1.9 mmt-85 -107.91 -31.79 7.85 Favored 'General case' 0 N--CA 1.522 3.159 0 C-N-CA 123.787 0.835 . . . . 0.0 112.059 -178.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -92.77 -13.23 29.53 Favored 'General case' 0 N--CA 1.519 2.994 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 -176.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 571' ' ' LEU . . . . . 0.784 HD23 HD11 ' B' ' 582' ' ' ILE . 14.5 tp -75.1 -45.7 39.45 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-N 120.644 1.566 . . . . 0.0 111.348 -177.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.79 -33.49 16.69 Favored 'General case' 1 N--CA 1.547 4.421 0 CA-C-N 119.71 1.141 . . . . 0.0 113.208 -179.913 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -64.97 -36.06 83.19 Favored 'General case' 1 N--CA 1.541 4.082 0 C-N-CA 122.93 0.492 . . . . 0.0 111.566 -178.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -49.2 -57.55 6.54 Favored 'General case' 0 N--CA 1.53 3.546 0 C-N-CA 124.573 1.149 . . . . 0.0 113.141 -178.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -132.96 -38.91 0.97 Allowed 'General case' 0 N--CA 1.534 3.726 0 CA-C-O 118.526 -0.75 . . . . 0.0 111.848 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 130.7 63.67 0.1 OUTLIER Glycine 1 N--CA 1.52 4.271 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 179.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -114.81 98.55 6.91 Favored 'General case' 0 N--CA 1.518 2.934 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -42.16 168.82 0.01 OUTLIER Glycine 1 N--CA 1.541 5.645 0 C-N-CA 125.012 1.292 . . . . 0.0 115.493 -176.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 579' ' ' ILE . . . . . 0.437 ' HA ' HG22 ' B' ' 582' ' ' ILE . 1.9 mt -83.66 -14.19 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.335 0 CA-C-O 117.61 -1.186 . . . . 0.0 109.002 178.341 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -69.86 -36.63 75.67 Favored 'General case' 0 N--CA 1.525 3.313 0 CA-C-N 120.091 1.314 . . . . 0.0 108.973 175.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.1 p -79.49 -36.54 38.51 Favored 'General case' 1 N--CA 1.541 4.109 0 CA-C-N 118.924 0.784 . . . . 0.0 111.825 178.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 582' ' ' ILE . . . . . 0.784 HD11 HD23 ' B' ' 571' ' ' LEU . 0.8 OUTLIER -69.66 -36.54 71.0 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.414 0 C-N-CA 123.379 0.672 . . . . 0.0 111.736 -175.643 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 81.4 p -99.57 -28.1 13.38 Favored 'General case' 0 N--CA 1.515 2.777 0 CA-C-O 117.974 -1.012 . . . . 0.0 111.396 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 11.1 ptt180 -75.94 -19.41 58.79 Favored 'General case' 0 N--CA 1.531 3.579 0 CA-C-N 120.081 1.309 . . . . 0.0 108.217 174.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -62.03 -36.42 92.87 Favored Glycine 1 N--CA 1.517 4.052 0 N-CA-C 108.645 -1.782 . . . . 0.0 108.645 175.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 84.3 p -63.3 -36.84 85.0 Favored 'General case' 0 N--CA 1.537 3.89 0 CA-C-N 117.976 0.888 . . . . 0.0 109.792 176.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -56.75 -32.47 65.62 Favored 'General case' 1 N--CA 1.546 4.361 0 C-N-CA 123.638 0.775 . . . . 0.0 111.535 179.094 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 8.7 m -61.39 -41.11 96.59 Favored 'General case' 1 N--CA 1.542 4.174 0 C-N-CA 123.39 0.676 . . . . 0.0 110.527 179.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 51.4 mt -58.93 -45.32 90.66 Favored 'General case' 0 N--CA 1.525 3.286 0 C-N-CA 123.907 0.883 . . . . 0.0 111.11 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? -62.0 -24.49 67.07 Favored 'General case' 1 N--CA 1.539 4.005 0 CA-C-O 118.549 -0.739 . . . . 0.0 112.038 179.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -78.16 -40.38 38.06 Favored 'General case' 0 N--CA 1.516 2.84 0 CA-C-N 118.729 0.695 . . . . 0.0 110.755 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -65.28 159.24 67.66 Favored Pre-proline 0 N--CA 1.537 3.918 0 CA-C-O 118.535 -0.745 . . . . 0.0 112.673 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -79.42 179.76 6.1 Favored 'Trans proline' 0 C--N 1.381 2.257 0 C-N-CA 122.105 1.87 . . . . 0.0 110.834 178.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.2 t -97.25 -27.03 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.083 0 CA-C-O 117.676 -1.154 . . . . 0.0 111.683 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -63.22 -40.52 97.69 Favored 'General case' 0 N--CA 1.515 2.804 0 CA-C-N 120.045 1.293 . . . . 0.0 110.559 -178.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 596' ' ' LEU . . . . . 0.467 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.9 mp -98.76 -15.84 19.17 Favored 'General case' 0 N--CA 1.51 2.56 0 C-N-CA 123.388 0.675 . . . . 0.0 111.76 178.461 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -29.98 69.44 Favored 'General case' 1 N--CA 1.54 4.058 0 N-CA-C 103.328 -2.841 . . . . 0.0 103.328 168.05 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -54.62 -38.24 66.58 Favored 'General case' 0 N--CA 1.52 3.043 0 C-N-CA 124.099 0.96 . . . . 0.0 110.039 174.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 599' ' ' TRP . . . . . 0.633 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 45.1 t90 -63.46 -38.11 89.88 Favored 'General case' 0 N--CA 1.534 3.729 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 176.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.6 -34.87 52.88 Favored 'General case' 1 N--CA 1.541 4.077 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 177.019 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -71.69 -38.32 70.6 Favored 'General case' 1 N--CA 1.54 4.073 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 175.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -60.11 -23.21 63.67 Favored 'General case' 1 N--CA 1.542 4.137 0 C-N-CA 123.857 0.863 . . . . 0.0 110.815 176.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 603' ' ' VAL . . . . . 0.534 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.1 OUTLIER -115.81 7.11 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.466 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -176.751 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 73.0 mt -118.88 -61.19 1.68 Allowed 'General case' 0 N--CA 1.529 3.519 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.538 3.934 0 C-N-CA 124.691 1.197 . . . . 0.0 111.681 -178.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 . . . . . 0 N--CA 1.528 3.452 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.5 ' HE1' HD22 ' B' ' 536' ' ' LEU . 29.7 t-105 -46.91 -40.55 14.35 Favored 'General case' 0 N--CA 1.533 3.681 0 C-N-CA 125.081 1.353 . . . . 0.0 110.888 176.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -88.41 -26.6 22.06 Favored 'General case' 0 N--CA 1.531 3.582 0 CA-C-O 118.154 -0.927 . . . . 0.0 111.251 -179.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.2 mtt-85 -56.17 -20.78 19.27 Favored 'General case' 0 N--CA 1.537 3.89 0 CA-C-N 119.618 1.099 . . . . 0.0 108.138 173.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.519 ' CZ ' HD21 ' A' ' 26' ' ' LEU . 57.4 t80 -96.3 -34.42 11.6 Favored 'General case' 0 N--CA 1.509 2.518 0 CA-C-O 116.799 -1.572 . . . . 0.0 109.2 171.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 64.5 t -70.69 -63.26 1.01 Allowed 'Isoleucine or valine' 1 N--CA 1.569 5.515 0 CA-C-N 121.713 2.052 . . . . 0.0 110.81 -177.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -55.6 -39.5 70.82 Favored 'General case' 1 N--CA 1.547 4.383 0 CA-C-N 119.006 0.821 . . . . 0.0 110.537 -179.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.84 -31.79 72.64 Favored 'General case' 1 N--CA 1.543 4.188 0 C-N-CA 123.081 0.552 . . . . 0.0 109.558 177.17 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.519 HD21 ' CZ ' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -65.97 -34.8 78.93 Favored 'General case' 0 N--CA 1.53 3.545 0 CA-C-O 118.747 -0.644 . . . . 0.0 109.741 177.421 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 54.0 tttt -67.83 -24.67 65.3 Favored 'General case' 0 N--CA 1.526 3.334 0 CA-C-O 118.589 -0.719 . . . . 0.0 111.132 177.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -69.61 -43.38 72.86 Favored 'General case' 1 N--CA 1.541 4.083 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 176.396 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.623 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -81.67 -9.6 59.61 Favored 'General case' 0 N--CA 1.501 2.115 0 CA-C-O 118.407 -0.806 . . . . 0.0 110.424 177.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.43 ' CE1' HD12 ' A' ' 26' ' ' LEU . 6.4 m-30 -78.74 -34.72 45.58 Favored 'General case' 0 N--CA 1.525 3.281 0 CA-C-N 120.234 1.379 . . . . 0.0 109.448 179.117 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 -62.42 -41.27 98.58 Favored 'General case' 0 N--CA 1.537 3.903 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -92.31 -86.95 0.23 Allowed 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 106.927 -1.509 . . . . 0.0 106.927 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.8 p30 148.59 51.98 0.0 OUTLIER 'General case' 1 N--CA 1.561 5.124 0 C-N-CA 128.387 2.675 . . . . 0.0 107.24 177.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.415 HD22 ' CD2' ' B' ' 596' ' ' LEU . 5.4 mt -111.14 11.7 21.9 Favored 'General case' 0 N--CA 1.526 3.371 0 C-N-CA 124.649 1.179 . . . . 0.0 110.858 -177.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.542 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 54.6 p-80 -84.09 3.84 32.95 Favored 'General case' 0 N--CA 1.507 2.398 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.765 ' HA ' HD23 ' A' ' 39' ' ' LEU . 20.0 mt -92.16 -50.75 0.29 Allowed Pre-proline 0 N--CA 1.505 2.276 0 CA-C-O 116.868 -1.539 . . . . 0.0 108.348 -176.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.459 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 7.3 Cg_exo -62.49 -36.24 66.72 Favored 'Trans proline' 0 C--N 1.395 2.979 0 N-CA-C 106.438 -2.178 . . . . 0.0 106.438 170.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.4 -44.02 79.89 Favored 'General case' 0 N--CA 1.528 3.428 0 C-N-CA 123.881 0.872 . . . . 0.0 110.439 175.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.765 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -75.68 -28.32 58.63 Favored 'General case' 1 N--CA 1.542 4.126 0 N-CA-C 113.96 1.096 . . . . 0.0 113.96 -176.176 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 30.1 p30 -88.39 6.1 39.02 Favored 'General case' 0 N--CA 1.536 3.853 0 CA-C-N 119.845 1.202 . . . . 0.0 112.36 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.493 ' O ' HD12 ' A' ' 41' ' ' LEU . 0.3 OUTLIER -119.85 -43.74 2.55 Favored 'General case' 0 N--CA 1.519 2.999 0 CA-C-N 118.942 0.792 . . . . 0.0 110.003 -179.511 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -35.76 74.59 Favored 'General case' 0 N--CA 1.534 3.726 0 CA-C-N 119.006 0.821 . . . . 0.0 111.924 -176.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.465 ' O ' HG23 ' A' ' 44' ' ' THR . 3.4 tt -135.3 -77.58 0.44 Allowed 'General case' 0 N--CA 1.504 2.271 0 CA-C-O 118.54 -0.743 . . . . 0.0 110.972 179.033 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.465 HG23 ' O ' ' A' ' 43' ' ' LEU . 6.1 p -167.24 172.91 3.3 Favored Pre-proline 1 N--CA 1.55 4.559 0 C-N-CA 124.012 0.925 . . . . 0.0 111.284 -177.707 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -68.68 -18.69 42.33 Favored 'Trans proline' 0 CA--C 1.588 3.207 0 C-N-CA 121.999 1.799 . . . . 0.0 108.761 172.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -63.09 -15.39 56.51 Favored 'General case' 0 N--CA 1.529 3.493 0 CA-C-O 118.303 -0.856 . . . . 0.0 111.196 176.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -67.02 -38.62 86.27 Favored 'General case' 0 N--CA 1.53 3.572 0 CA-C-N 119.344 0.975 . . . . 0.0 108.917 177.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 19.0 ptt180 -86.26 -14.29 44.24 Favored 'General case' 0 N--CA 1.533 3.696 0 CA-C-O 118.229 -0.891 . . . . 0.0 109.775 174.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -73.38 -27.59 61.56 Favored 'General case' 0 N--CA 1.533 3.679 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 173.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.22 -46.59 8.33 Favored 'General case' 0 N--CA 1.509 2.486 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.491 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 18.9 tp -64.01 -23.65 67.41 Favored 'General case' 1 N--CA 1.54 4.054 0 CA-C-N 120.0 1.273 . . . . 0.0 107.714 174.069 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.45 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -67.46 -77.53 0.32 Allowed Glycine 0 N--CA 1.504 3.231 0 C-N-CA 125.449 1.499 . . . . 0.0 111.845 176.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.8 m -69.82 -26.66 64.35 Favored 'General case' 0 N--CA 1.538 3.964 0 CA-C-O 118.328 -0.844 . . . . 0.0 113.005 -176.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -70.73 -47.77 58.0 Favored 'General case' 0 N--CA 1.533 3.71 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 178.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 22.7 t -65.8 -18.73 24.45 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.168 0 CA-C-N 120.008 1.277 . . . . 0.0 109.373 174.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.9 mtp180 -72.58 -46.83 52.38 Favored 'General case' 0 N--CA 1.529 3.515 0 CA-C-O 117.555 -1.212 . . . . 0.0 111.826 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.41 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -74.41 -24.39 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.609 0 CA-C-N 121.147 1.794 . . . . 0.0 111.359 -178.896 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.712 HG11 HD21 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -86.26 -52.46 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.999 0 CA-C-N 120.144 1.338 . . . . 0.0 107.984 -178.382 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -60.2 -30.53 69.43 Favored 'General case' 0 N--CA 1.529 3.522 0 C-N-CA 123.387 0.675 . . . . 0.0 109.796 178.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -76.6 -33.53 58.42 Favored 'General case' 0 N--CA 1.529 3.501 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 176.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.7 mp -75.8 -24.84 55.96 Favored 'General case' 0 N--CA 1.529 3.514 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 176.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 22.7 mt -76.99 -26.5 53.96 Favored 'General case' 0 N--CA 1.52 3.068 0 C-N-CA 123.774 0.83 . . . . 0.0 109.482 177.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? -77.38 -44.9 27.71 Favored 'General case' 0 N--CA 1.522 3.132 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 179.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.67 52.07 6.76 Favored Glycine 1 N--CA 1.516 4.029 0 CA-C-O 119.239 -0.756 . . . . 0.0 111.607 177.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -95.19 -42.04 8.77 Favored 'General case' 0 N--CA 1.523 3.223 0 CA-C-N 117.888 0.844 . . . . 0.0 109.519 178.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 5.0 ttt 119.95 82.14 0.0 OUTLIER 'General case' 1 N--CA 1.545 4.288 0 C-N-CA 127.61 2.364 . . . . 0.0 105.309 -179.319 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 19.8 m -139.39 49.13 1.83 Allowed 'General case' 0 N--CA 1.514 2.751 0 CA-C-O 122.036 0.922 . . . . 0.0 110.135 -177.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -110.83 -49.13 3.06 Favored 'General case' 0 N--CA 1.52 3.057 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 178.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -91.35 -46.63 7.92 Favored 'General case' 0 N--CA 1.522 3.147 0 C-N-CA 123.776 0.83 . . . . 0.0 109.076 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -76.46 -10.47 59.42 Favored 'General case' 0 N--CA 1.518 2.941 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -179.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 43.0 tp -83.72 -50.94 7.67 Favored 'General case' 0 N--CA 1.531 3.587 0 CA-C-O 117.591 -1.195 . . . . 0.0 113.325 -177.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -37.9 -36.6 0.2 Allowed 'General case' 1 N--CA 1.549 4.506 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 -176.354 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -66.02 -38.32 88.14 Favored 'General case' 1 N--CA 1.542 4.139 0 CA-C-N 118.569 0.622 . . . . 0.0 111.847 -177.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -50.65 -34.09 24.97 Favored 'General case' 0 N--CA 1.532 3.66 0 C-N-CA 124.427 1.091 . . . . 0.0 113.675 -178.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 pp -151.01 -44.52 0.12 Allowed 'General case' 0 N--CA 1.53 3.558 0 CA-C-N 119.045 0.839 . . . . 0.0 112.108 -179.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 114.47 81.68 1.01 Allowed Glycine 1 N--CA 1.517 4.053 0 N-CA-C 110.895 -0.882 . . . . 0.0 110.895 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -106.14 -50.65 3.12 Favored 'General case' 0 N--CA 1.522 3.165 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 177.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 119.2 158.58 10.73 Favored Glycine 1 N--CA 1.516 4.001 0 N-CA-C 110.112 -1.195 . . . . 0.0 110.112 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -81.01 -18.53 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.984 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 177.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.78 -36.05 77.83 Favored 'General case' 0 N--CA 1.518 2.928 0 CA-C-O 117.658 -1.163 . . . . 0.0 110.111 177.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 10.5 p -76.77 -50.82 12.64 Favored 'General case' 0 N--CA 1.534 3.739 0 CA-C-N 119.604 1.093 . . . . 0.0 111.895 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.41 HG22 ' HB ' ' A' ' 57' ' ' ILE . 0.1 OUTLIER -64.7 -28.54 45.05 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.038 0 CA-C-O 118.102 -0.951 . . . . 0.0 113.087 -176.833 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 44.4 p -99.77 -29.13 12.8 Favored 'General case' 0 N--CA 1.515 2.81 0 CA-C-N 119.456 1.025 . . . . 0.0 111.294 -178.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.3 ptt180 -73.85 -24.73 59.8 Favored 'General case' 0 N--CA 1.535 3.815 0 CA-C-N 119.651 1.114 . . . . 0.0 108.892 175.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.62 -32.32 82.82 Favored Glycine 1 N--CA 1.519 4.196 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 175.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 6.4 t -65.77 -42.37 90.92 Favored 'General case' 1 N--CA 1.54 4.028 0 CA-C-N 117.899 0.85 . . . . 0.0 110.126 177.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -64.14 -30.29 71.36 Favored 'General case' 0 N--CA 1.537 3.913 0 C-N-CA 123.395 0.678 . . . . 0.0 111.115 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.2 m -67.57 -38.3 83.89 Favored 'General case' 0 N--CA 1.532 3.654 0 C-N-CA 123.355 0.662 . . . . 0.0 110.576 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 21.5 mt -55.73 -44.89 77.97 Favored 'General case' 0 N--CA 1.53 3.564 0 C-N-CA 124.151 0.981 . . . . 0.0 111.387 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -28.29 69.25 Favored 'General case' 1 N--CA 1.542 4.139 0 CA-C-O 118.786 -0.626 . . . . 0.0 111.442 179.868 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -69.91 -39.95 75.86 Favored 'General case' 0 N--CA 1.52 3.033 0 CA-C-N 118.426 0.557 . . . . 0.0 110.849 179.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.44 161.11 6.14 Favored Pre-proline 1 N--CA 1.542 4.127 0 CA-C-O 118.428 -0.796 . . . . 0.0 112.712 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -79.68 156.67 24.55 Favored 'Trans proline' 0 C--N 1.377 2.059 0 C-N-CA 122.077 1.851 . . . . 0.0 110.931 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.6 t -88.8 -27.79 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.096 0 CA-C-O 117.734 -1.127 . . . . 0.0 111.947 -178.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -64.06 -34.93 79.14 Favored 'General case' 0 N--CA 1.516 2.857 0 CA-C-N 120.262 1.392 . . . . 0.0 109.987 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.412 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.1 mp -96.94 -19.61 18.68 Favored 'General case' 0 N--CA 1.51 2.538 0 C-N-CA 123.85 0.86 . . . . 0.0 110.776 177.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.29 -33.58 74.93 Favored 'General case' 1 N--CA 1.547 4.387 0 N-CA-C 104.521 -2.399 . . . . 0.0 104.521 169.721 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -51.17 -42.8 61.06 Favored 'General case' 0 N--CA 1.522 3.164 0 C-N-CA 124.535 1.134 . . . . 0.0 110.803 175.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.632 ' CZ3' HD21 ' B' ' 538' ' ' LEU . 38.3 t90 -63.18 -36.04 82.3 Favored 'General case' 0 N--CA 1.532 3.662 0 N-CA-C 107.637 -1.246 . . . . 0.0 107.637 177.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.43 ' O ' ' HB2' ' A' ' 104' ' ' LEU . 1.5 tt -50.77 -40.9 56.23 Favored 'General case' 0 N--CA 1.537 3.905 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 175.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -69.17 -37.21 78.07 Favored 'General case' 1 N--CA 1.545 4.313 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 176.028 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.501 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 1.3 mm-40 -58.02 -23.23 53.34 Favored 'General case' 1 N--CA 1.545 4.276 0 C-N-CA 123.662 0.785 . . . . 0.0 110.55 175.814 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.564 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.4 OUTLIER -122.39 -0.64 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.314 0 CA-C-O 118.28 -0.867 . . . . 0.0 113.007 -176.924 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 100' ' ' LEU . 0.1 OUTLIER -112.31 -59.04 2.06 Favored 'General case' 0 N--CA 1.517 2.919 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 176.813 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 1 N--CA 1.544 4.225 0 C-N-CA 124.776 1.23 . . . . 0.0 111.714 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 . . . . . 0 N--CA 1.524 3.256 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 519' ' ' TRP . . . . . 0.729 ' CE2' HD22 ' A' ' 39' ' ' LEU . 64.5 t-105 -47.02 -26.67 1.09 Allowed 'General case' 1 N--CA 1.542 4.137 0 C-N-CA 124.261 1.024 . . . . 0.0 112.588 177.056 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 520' ' ' LEU . . . . . 0.599 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.1 mm? -96.13 -28.23 14.68 Favored 'General case' 0 N--CA 1.529 3.494 0 CA-C-O 117.558 -1.21 . . . . 0.0 113.105 -173.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 55.4 ttt180 -61.71 -25.45 67.43 Favored 'General case' 1 N--CA 1.542 4.174 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 170.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . 0.57 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.6 m-85 -77.93 -41.97 34.57 Favored 'General case' 0 N--CA 1.51 2.557 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 174.088 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 86.0 t -65.17 -18.22 23.39 Favored 'Isoleucine or valine' 1 N--CA 1.574 5.775 0 CA-C-N 120.116 1.325 . . . . 0.0 111.918 178.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -78.13 -57.06 3.99 Favored 'General case' 0 N--CA 1.534 3.726 0 CA-C-N 120.406 1.457 . . . . 0.0 107.338 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.1 -24.68 67.28 Favored 'General case' 0 N--CA 1.537 3.881 0 O-C-N 123.248 0.343 . . . . 0.0 110.287 175.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 526' ' ' LEU . . . . . 0.492 HD23 ' O ' ' B' ' 522' ' ' PHE . 2.0 mm? -73.06 -36.77 66.94 Favored 'General case' 0 N--CA 1.516 2.868 0 CA-C-O 118.171 -0.918 . . . . 0.0 109.452 178.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 3.5 tttt -68.42 -22.89 64.59 Favored 'General case' 0 N--CA 1.528 3.455 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.037 178.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -71.91 -44.07 64.3 Favored 'General case' 0 N--CA 1.532 3.647 0 CA-C-N 119.282 0.946 . . . . 0.0 108.809 177.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 529' ' ' ALA . . . . . 0.573 ' HB1' ' N ' ' B' ' 535' ' ' HIS . . . -82.13 -13.51 57.12 Favored 'General case' 0 N--CA 1.511 2.575 0 CA-C-O 119.028 -0.51 . . . . 0.0 110.934 178.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -78.51 -30.89 47.38 Favored 'General case' 0 N--CA 1.534 3.742 0 CA-C-N 119.566 1.076 . . . . 0.0 109.65 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -66.1 -44.44 84.34 Favored 'General case' 0 N--CA 1.535 3.793 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 177.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -87.76 -90.31 0.12 Allowed 'General case' 0 N--CA 1.515 2.781 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 176.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.1 p30 156.46 50.08 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.831 0 C-N-CA 127.041 2.136 . . . . 0.0 108.667 176.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 534' ' ' LEU . . . . . 0.702 ' O ' HD13 ' B' ' 538' ' ' LEU . 7.8 mt -107.46 5.19 26.99 Favored 'General case' 0 N--CA 1.518 2.961 0 C-N-CA 124.901 1.28 . . . . 0.0 110.569 -178.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 535' ' ' HIS . . . . . 0.587 ' HA ' HD22 ' B' ' 538' ' ' LEU . 50.5 p-80 -77.84 3.73 13.62 Favored 'General case' 0 N--CA 1.522 3.132 0 O-C-N 121.824 -0.548 . . . . 0.0 109.6 174.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 536' ' ' LEU . . . . . 0.5 HD22 ' HE1' ' A' ' 19' ' ' TRP . 24.5 mt -93.21 -52.57 0.26 Allowed Pre-proline 0 N--CA 1.504 2.264 0 CA-C-O 116.783 -1.58 . . . . 0.0 108.42 -176.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 537' ' ' PRO . . . . . 0.476 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 4.8 Cg_exo -60.75 -33.32 93.2 Favored 'Trans proline' 0 C--N 1.397 3.124 0 C-N-CA 122.152 1.901 . . . . 0.0 107.942 171.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 538' ' ' LEU . . . . . 0.702 HD13 ' O ' ' B' ' 534' ' ' LEU . 7.5 mp -62.01 -49.06 77.54 Favored 'General case' 0 N--CA 1.536 3.865 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 174.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 29.4 mt -70.74 -11.5 60.98 Favored 'General case' 0 N--CA 1.534 3.757 0 CA-C-O 118.311 -0.852 . . . . 0.0 112.374 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -81.3 -15.74 54.54 Favored 'General case' 0 N--CA 1.52 3.072 0 CA-C-O 118.108 -0.949 . . . . 0.0 110.996 177.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 541' ' ' LEU . . . . . 0.712 HD21 HG11 ' A' ' 58' ' ' VAL . 0.0 OUTLIER -117.68 -30.3 5.5 Favored 'General case' 0 N--CA 1.525 3.325 0 CA-C-N 119.774 1.17 . . . . 0.0 112.497 -177.302 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 542' ' ' MET . . . . . 0.631 ' N ' HD13 ' B' ' 541' ' ' LEU . 4.6 ptt? -101.64 10.87 39.76 Favored 'General case' 1 N--CA 1.544 4.254 0 CA-C-N 120.286 1.403 . . . . 0.0 112.726 -179.233 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 543' ' ' LEU . . . . . 0.414 ' O ' HG23 ' B' ' 544' ' ' THR . 1.3 tt -128.72 -95.77 0.41 Allowed 'General case' 0 N--CA 1.528 3.459 0 CA-C-O 117.477 -1.249 . . . . 0.0 112.372 178.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 544' ' ' THR . . . . . 0.414 HG23 ' O ' ' B' ' 543' ' ' LEU . 0.3 OUTLIER 162.75 177.77 0.03 OUTLIER Pre-proline 1 N--CA 1.585 6.319 0 CA-C-N 120.916 1.689 . . . . 0.0 109.549 -176.698 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -57.09 -21.45 42.49 Favored 'Trans proline' 1 N--CA 1.538 4.104 0 C-N-CA 122.31 2.007 . . . . 0.0 111.225 173.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -64.46 -0.37 1.31 Allowed 'General case' 0 N--CA 1.532 3.632 0 C-N-CA 123.613 0.765 . . . . 0.0 111.47 175.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -55.45 -79.8 0.02 OUTLIER 'General case' 0 N--CA 1.521 3.112 0 CA-C-O 116.608 -1.663 . . . . 0.0 108.632 178.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 25.4 ptt180 -88.07 -8.95 54.76 Favored 'General case' 0 N--CA 1.523 3.198 0 CA-C-N 121.878 2.126 . . . . 0.0 111.976 177.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -68.94 -54.88 12.99 Favored 'General case' 0 N--CA 1.534 3.753 0 CA-C-N 120.569 1.532 . . . . 0.0 107.676 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -85.33 -30.24 23.85 Favored 'General case' 0 N--CA 1.513 2.713 0 CA-C-O 117.843 -1.075 . . . . 0.0 111.809 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 551' ' ' LEU . . . . . 0.413 HD23 ' CE3' ' A' ' 19' ' ' TRP . 14.0 tp -67.88 -36.38 80.16 Favored 'General case' 1 N--CA 1.542 4.171 0 CA-C-N 121.136 1.789 . . . . 0.0 109.787 178.385 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -74.38 -55.71 5.47 Favored Glycine 0 N--CA 1.496 2.693 0 CA-C-O 118.642 -1.088 . . . . 0.0 112.563 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.6 m -76.74 -22.59 53.62 Favored 'General case' 1 N--CA 1.543 4.22 0 CA-C-N 118.953 1.377 . . . . 0.0 113.588 -176.034 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -81.14 -41.9 21.74 Favored 'General case' 0 N--CA 1.538 3.941 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 176.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 555' ' ' VAL . . . . . 0.48 HG21 ' HB2' ' A' ' 22' ' ' PHE . 93.1 t -64.49 -18.54 23.36 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.958 0 O-C-N 121.182 -0.949 . . . . 0.0 108.684 173.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -76.47 -43.45 39.77 Favored 'General case' 0 N--CA 1.522 3.137 0 CA-C-O 116.958 -1.496 . . . . 0.0 111.657 176.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 557' ' ' ILE . . . . . 0.546 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -72.96 -24.01 20.74 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.526 0 CA-C-N 121.938 2.153 . . . . 0.0 110.555 -179.3 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 558' ' ' VAL . . . . . 0.546 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.0 OUTLIER -82.31 -44.24 19.52 Favored 'Isoleucine or valine' 1 N--CA 1.546 4.336 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 -179.806 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -64.02 -28.78 70.04 Favored 'General case' 0 N--CA 1.528 3.463 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -89.51 -19.34 25.16 Favored 'General case' 0 N--CA 1.525 3.291 0 CA-C-O 118.467 -0.778 . . . . 0.0 110.421 177.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 32.5 tp -76.12 -47.17 25.43 Favored 'General case' 0 N--CA 1.532 3.673 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 1.5 tt -46.98 -33.87 5.07 Favored 'General case' 1 N--CA 1.547 4.385 0 C-N-CA 125.09 1.356 . . . . 0.0 110.972 178.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 19.6 mmm180 -81.4 -58.85 2.85 Favored 'General case' 0 N--CA 1.518 2.973 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 178.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 51.67 37.83 43.05 Favored Glycine 1 N--CA 1.535 5.238 0 C-N-CA 124.322 0.963 . . . . 0.0 112.909 178.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -99.48 -51.8 3.67 Favored 'General case' 0 N--CA 1.519 2.996 0 CA-C-N 117.777 0.789 . . . . 0.0 109.148 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 8.2 ptt? -157.35 44.48 0.36 Allowed 'General case' 0 N--CA 1.53 3.531 0 CA-C-O 121.659 0.742 . . . . 0.0 109.795 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 28.1 m -135.36 37.72 2.93 Favored 'General case' 0 N--CA 1.517 2.922 0 C-N-CA 123.554 0.742 . . . . 0.0 109.793 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -109.84 -54.85 2.51 Favored 'General case' 0 N--CA 1.514 2.741 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 569' ' ' ARG . . . . . 0.455 ' HA ' HD11 ' B' ' 579' ' ' ILE . 0.1 OUTLIER -97.37 -43.61 7.23 Favored 'General case' 0 N--CA 1.524 3.272 0 C-N-CA 122.957 0.503 . . . . 0.0 110.998 -179.196 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -79.21 -12.59 59.97 Favored 'General case' 0 N--CA 1.523 3.203 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -177.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 571' ' ' LEU . . . . . 0.835 HD23 HD11 ' B' ' 582' ' ' ILE . 17.9 tp -70.81 -44.11 67.25 Favored 'General case' 0 N--CA 1.532 3.669 0 CA-C-N 119.749 1.159 . . . . 0.0 111.493 -178.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -40.66 -29.6 0.1 Allowed 'General case' 1 N--CA 1.558 4.939 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -179.64 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -69.68 -48.7 58.79 Favored 'General case' 0 N--CA 1.538 3.958 0 CA-C-N 119.04 0.836 . . . . 0.0 109.336 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -55.3 -39.23 69.67 Favored 'General case' 0 N--CA 1.53 3.537 0 C-N-CA 124.908 1.283 . . . . 0.0 112.609 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 42.0 mt -114.34 -60.32 1.9 Allowed 'General case' 0 N--CA 1.53 3.555 0 C-N-CA 122.88 0.472 . . . . 0.0 111.457 -177.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 114.41 28.51 3.0 Favored Glycine 1 N--CA 1.522 4.412 0 CA-C-O 118.495 -1.17 . . . . 0.0 111.307 -178.406 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -101.28 115.94 31.66 Favored 'General case' 0 N--CA 1.517 2.882 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 178.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -38.5 166.26 0.01 OUTLIER Glycine 1 N--CA 1.536 5.358 0 C-N-CA 125.303 1.43 . . . . 0.0 115.414 -177.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 579' ' ' ILE . . . . . 0.575 ' HA ' HG22 ' B' ' 582' ' ' ILE . 0.6 OUTLIER -79.78 -17.7 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.963 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 177.239 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -65.62 -20.08 66.17 Favored 'General case' 0 N--CA 1.519 3.018 0 CA-C-O 116.996 -1.478 . . . . 0.0 111.192 176.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.2 p -101.59 -35.82 8.99 Favored 'General case' 1 N--CA 1.542 4.152 0 CA-C-N 120.811 1.642 . . . . 0.0 111.208 178.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 582' ' ' ILE . . . . . 0.835 HD11 HD23 ' B' ' 571' ' ' LEU . 2.9 tt -66.51 -39.06 83.03 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.565 0 C-N-CA 123.32 0.648 . . . . 0.0 110.575 -177.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 583' ' ' THR . . . . . 0.445 HG23 HG23 ' B' ' 582' ' ' ILE . 77.8 p -96.08 -19.58 19.32 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 118.301 -0.857 . . . . 0.0 110.437 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 10.5 ttp180 -64.69 -31.3 72.47 Favored 'General case' 1 N--CA 1.549 4.503 0 N-CA-C 106.688 -1.597 . . . . 0.0 106.688 172.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -66.46 -36.96 92.27 Favored Glycine 0 N--CA 1.514 3.835 0 N-CA-C 110.215 -1.154 . . . . 0.0 110.215 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 59.7 p -61.85 -30.14 70.65 Favored 'General case' 1 N--CA 1.55 4.537 0 CA-C-N 118.614 1.207 . . . . 0.0 112.407 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -66.93 -28.8 68.59 Favored 'General case' 0 N--CA 1.539 3.977 0 CA-C-N 118.681 0.673 . . . . 0.0 110.624 178.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 14.9 m -64.04 -34.98 79.25 Favored 'General case' 0 N--CA 1.533 3.721 0 C-N-CA 123.512 0.725 . . . . 0.0 111.692 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 13.4 mt -56.36 -41.73 76.63 Favored 'General case' 0 N--CA 1.536 3.831 0 C-N-CA 123.947 0.899 . . . . 0.0 111.776 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.96 -19.57 65.24 Favored 'General case' 1 N--CA 1.543 4.205 0 CA-C-O 118.359 -0.829 . . . . 0.0 112.787 -179.23 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -108.27 -21.92 12.56 Favored 'General case' 0 N--CA 1.521 3.098 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 -178.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -66.36 160.99 62.06 Favored Pre-proline 0 N--CA 1.538 3.972 0 CA-C-N 119.598 1.09 . . . . 0.0 112.424 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -83.82 148.47 12.31 Favored 'Trans proline' 0 C--N 1.379 2.162 0 C-N-CA 122.272 1.981 . . . . 0.0 108.935 178.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -82.91 -28.03 8.12 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.948 0 CA-C-O 117.858 -1.068 . . . . 0.0 112.045 -178.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -61.88 -37.8 85.91 Favored 'General case' 0 N--CA 1.519 3.013 0 CA-C-N 120.183 1.356 . . . . 0.0 110.513 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 596' ' ' LEU . . . . . 0.416 HD12 ' N ' ' B' ' 596' ' ' LEU . 6.9 mp -99.84 -17.86 17.43 Favored 'General case' 0 N--CA 1.513 2.679 0 C-N-CA 123.887 0.875 . . . . 0.0 111.269 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.12 -36.65 82.41 Favored 'General case' 1 N--CA 1.545 4.301 0 N-CA-C 103.823 -2.658 . . . . 0.0 103.823 170.022 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -56.92 -39.3 74.21 Favored 'General case' 0 N--CA 1.513 2.714 0 C-N-CA 124.405 1.082 . . . . 0.0 111.79 175.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 599' ' ' TRP . . . . . 0.623 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 63.6 t90 -63.31 -32.76 74.26 Favored 'General case' 0 N--CA 1.531 3.604 0 CA-C-O 117.832 -1.08 . . . . 0.0 108.331 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 46.5 mt -55.3 -37.94 68.0 Favored 'General case' 1 N--CA 1.541 4.077 0 CA-C-N 119.162 0.892 . . . . 0.0 109.167 176.099 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -73.05 -30.31 63.63 Favored 'General case' 0 N--CA 1.529 3.48 0 O-C-N 123.935 0.772 . . . . 0.0 109.532 176.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 602' ' ' GLU . . . . . 0.459 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.6 OUTLIER -65.17 -27.4 68.68 Favored 'General case' 1 N--CA 1.542 4.137 0 C-N-CA 123.928 0.891 . . . . 0.0 110.076 175.495 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' B' B ' 603' ' ' VAL . . . . . 0.511 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.0 OUTLIER -111.21 -4.44 11.01 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.245 0 CA-C-O 118.08 -0.962 . . . . 0.0 112.365 -177.081 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -94.39 -59.68 1.89 Allowed 'General case' 0 N--CA 1.512 2.632 0 N-CA-C 104.349 -2.464 . . . . 0.0 104.349 175.263 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.526 3.367 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 176.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 N--CA 1.532 3.664 0 CA-C-O 118.598 -0.715 . . . . 0.0 111.95 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.921 ' CE3' HD22 ' B' ' 551' ' ' LEU . 64.8 t-105 -49.07 -42.53 39.02 Favored 'General case' 0 N--CA 1.527 3.415 0 CA-C-N 119.629 1.104 . . . . 0.0 112.919 -177.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.428 HD22 ' N ' ' A' ' 20' ' ' LEU . 2.3 mm? -81.2 -24.7 37.29 Favored 'General case' 0 N--CA 1.528 3.451 0 CA-C-O 117.595 -1.193 . . . . 0.0 112.859 -175.007 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -61.38 -29.53 69.97 Favored 'General case' 0 N--CA 1.532 3.675 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 173.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.681 ' CD1' HD21 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -85.24 -29.76 24.39 Favored 'General case' 0 N--CA 1.519 3.004 0 CA-C-O 116.203 -1.856 . . . . 0.0 109.723 174.913 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 86.1 t -72.79 -31.01 34.84 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.239 0 CA-C-N 121.908 2.14 . . . . 0.0 111.315 -177.289 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -73.82 -49.68 24.04 Favored 'General case' 0 N--CA 1.532 3.633 0 CA-C-N 119.335 0.97 . . . . 0.0 108.5 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.0 mp -70.15 -18.56 63.22 Favored 'General case' 0 N--CA 1.531 3.611 0 CA-C-O 119.515 -0.279 . . . . 0.0 110.323 176.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.403 HD22 ' HA ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -73.09 -33.65 65.72 Favored 'General case' 0 N--CA 1.526 3.33 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 175.256 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -64.51 -22.49 66.98 Favored 'General case' 0 N--CA 1.521 3.084 0 CA-C-O 118.502 -0.761 . . . . 0.0 110.849 175.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -72.51 -46.03 56.56 Favored 'General case' 0 N--CA 1.534 3.757 0 CA-C-N 119.114 0.87 . . . . 0.0 108.864 177.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.636 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -80.93 -10.09 59.76 Favored 'General case' 0 N--CA 1.51 2.537 0 CA-C-O 118.645 -0.693 . . . . 0.0 110.988 178.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -81.01 -34.83 32.6 Favored 'General case' 0 N--CA 1.53 3.565 0 CA-C-N 119.995 1.27 . . . . 0.0 109.061 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -61.4 -40.81 95.74 Favored 'General case' 0 N--CA 1.534 3.757 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 177.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -94.38 -88.66 0.24 Allowed 'General case' 0 N--CA 1.512 2.66 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 177.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.7 p30 151.63 53.32 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.871 0 C-N-CA 127.737 2.415 . . . . 0.0 107.795 177.072 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.498 HD22 ' CD2' ' B' ' 596' ' ' LEU . 4.5 mt -112.91 9.86 18.91 Favored 'General case' 0 N--CA 1.529 3.518 0 C-N-CA 124.176 0.99 . . . . 0.0 111.246 -178.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.565 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 53.7 p-80 -82.4 4.57 23.56 Favored 'General case' 0 N--CA 1.516 2.827 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 174.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.799 ' HA ' HD23 ' A' ' 39' ' ' LEU . 19.7 mt -93.75 -52.13 0.25 Allowed Pre-proline 0 N--CA 1.511 2.577 0 CA-C-O 116.892 -1.527 . . . . 0.0 108.689 -176.133 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.526 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 3.5 Cg_exo -65.38 -31.07 52.86 Favored 'Trans proline' 0 C--N 1.392 2.839 0 N-CA-C 106.615 -2.11 . . . . 0.0 106.615 170.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.496 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.1 OUTLIER -65.67 -37.95 87.93 Favored 'General case' 0 N--CA 1.522 3.141 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 175.823 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.799 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -73.46 -19.44 60.95 Favored 'General case' 1 N--CA 1.545 4.295 0 CA-C-N 119.826 1.194 . . . . 0.0 111.083 176.708 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -88.56 9.14 24.97 Favored 'General case' 0 N--CA 1.528 3.445 0 CA-C-N 119.099 0.863 . . . . 0.0 110.785 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.655 HD13 ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -127.33 -49.35 1.42 Allowed 'General case' 0 N--CA 1.522 3.14 0 CA-C-N 119.494 1.043 . . . . 0.0 111.188 -178.165 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.655 ' N ' HD13 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -89.53 -18.25 27.01 Favored 'General case' 1 N--CA 1.541 4.118 0 CA-C-N 120.113 1.324 . . . . 0.0 112.182 -178.275 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.513 HD11 HD12 ' B' ' 551' ' ' LEU . 2.2 mp -111.86 -87.69 0.54 Allowed 'General case' 0 N--CA 1.501 2.102 0 CA-C-O 117.833 -1.079 . . . . 0.0 108.294 -179.277 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.506 HG23 ' O ' ' A' ' 43' ' ' LEU . 0.7 OUTLIER 160.33 166.62 0.04 OUTLIER Pre-proline 1 N--CA 1.557 4.883 0 C-N-CA 125.148 1.379 . . . . 0.0 109.452 -179.193 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -68.62 -36.64 14.16 Favored 'Trans proline' 0 N--CA 1.512 2.575 0 C-N-CA 122.322 2.015 . . . . 0.0 107.723 173.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -62.52 -23.15 66.81 Favored 'General case' 0 N--CA 1.53 3.561 0 C-N-CA 123.953 0.901 . . . . 0.0 110.533 176.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -71.88 -35.54 69.81 Favored 'General case' 0 N--CA 1.521 3.096 0 CA-C-O 117.539 -1.22 . . . . 0.0 109.772 178.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.8 ptt180 -81.04 -19.2 44.37 Favored 'General case' 1 N--CA 1.539 4.001 0 CA-C-N 119.905 1.23 . . . . 0.0 108.519 174.067 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -68.91 -30.95 69.54 Favored 'General case' 0 N--CA 1.528 3.431 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 173.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -88.57 -29.53 19.95 Favored 'General case' 0 N--CA 1.514 2.735 0 CA-C-O 117.739 -1.124 . . . . 0.0 110.74 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 26.7 tp -73.72 -21.26 60.28 Favored 'General case' 1 N--CA 1.539 4.013 0 CA-C-N 120.875 1.67 . . . . 0.0 106.69 173.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.43 -67.3 1.9 Allowed Glycine 0 N--CA 1.501 3.021 0 C-N-CA 125.26 1.41 . . . . 0.0 110.768 177.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.0 m -67.96 -27.46 66.61 Favored 'General case' 0 N--CA 1.532 3.669 0 CA-C-O 118.102 -0.952 . . . . 0.0 112.366 -178.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 17.1 mtm180 -70.52 -48.01 57.63 Favored 'General case' 0 N--CA 1.531 3.581 0 CA-C-N 119.594 1.088 . . . . 0.0 108.526 178.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.405 HG11 ' CD1' ' B' ' 522' ' ' PHE . 34.3 t -67.97 -15.71 20.06 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.074 0 O-C-N 120.742 -1.224 . . . . 0.0 109.618 174.969 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 66.4 mtt-85 -78.25 -42.94 29.64 Favored 'General case' 0 N--CA 1.53 3.557 0 CA-C-N 120.213 1.369 . . . . 0.0 111.565 178.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.403 ' CG2' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -72.17 -24.32 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.6 0 CA-C-N 121.533 1.969 . . . . 0.0 110.379 -179.908 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.499 HG11 HD11 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -86.94 -51.21 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.928 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 -179.549 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -58.86 -25.14 63.01 Favored 'General case' 0 N--CA 1.536 3.851 0 CA-C-O 118.96 -0.543 . . . . 0.0 110.2 177.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -96.62 -20.94 17.94 Favored 'General case' 0 N--CA 1.525 3.32 0 CA-C-O 118.1 -0.953 . . . . 0.0 111.073 178.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 5.3 mt -73.56 -55.4 6.35 Favored 'General case' 0 N--CA 1.539 3.978 0 CA-C-N 119.799 1.181 . . . . 0.0 108.232 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 42.4 mt -50.58 -30.92 14.41 Favored 'General case' 1 N--CA 1.543 4.2 0 C-N-CA 124.099 0.96 . . . . 0.0 112.434 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 28.6 mmm180 -82.97 -45.52 14.0 Favored 'General case' 0 N--CA 1.525 3.32 0 CA-C-N 118.213 0.46 . . . . 0.0 110.169 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.68 59.34 5.26 Favored Glycine 1 N--CA 1.522 4.383 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -116.36 -52.64 2.57 Favored 'General case' 0 N--CA 1.521 3.104 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 14.0 ptm -162.92 79.86 0.48 Allowed 'General case' 0 N--CA 1.529 3.516 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 96.1 p -133.87 1.62 3.32 Favored 'General case' 0 N--CA 1.518 2.956 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 -176.035 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -113.93 -63.99 1.37 Allowed 'General case' 0 N--CA 1.532 3.64 0 CA-C-N 120.212 1.369 . . . . 0.0 111.323 -178.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 15.5 mtt180 -103.99 -41.48 5.84 Favored 'General case' 0 N--CA 1.533 3.698 0 CA-C-N 118.525 0.602 . . . . 0.0 110.639 -178.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -74.65 -5.79 45.03 Favored 'General case' 0 N--CA 1.515 2.791 0 CA-C-O 118.389 -0.815 . . . . 0.0 112.82 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.533 HD23 HG21 ' A' ' 82' ' ' ILE . 35.2 tp -93.89 -49.5 5.78 Favored 'General case' 0 N--CA 1.527 3.398 0 CA-C-N 120.064 1.302 . . . . 0.0 113.094 -177.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -44.94 -29.46 0.83 Allowed 'General case' 1 N--CA 1.546 4.351 0 CA-C-N 120.026 1.284 . . . . 0.0 114.003 -177.54 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 15.9 t30 -80.48 -38.31 30.14 Favored 'General case' 0 N--CA 1.531 3.621 0 CA-C-O 119.02 -0.514 . . . . 0.0 112.022 -178.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -53.37 -58.83 5.71 Favored 'General case' 0 N--CA 1.532 3.655 0 N-CA-C 114.077 1.139 . . . . 0.0 114.077 -177.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.95 -39.31 2.73 Favored 'General case' 0 N--CA 1.538 3.948 0 CA-C-N 118.993 0.815 . . . . 0.0 111.808 -178.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 125.11 86.05 0.64 Allowed Glycine 1 N--CA 1.523 4.477 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -149.97 104.82 3.33 Favored 'General case' 0 N--CA 1.522 3.146 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 178.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -45.31 169.07 0.03 OUTLIER Glycine 1 N--CA 1.54 5.617 0 C-N-CA 124.268 0.937 . . . . 0.0 114.389 -177.34 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.8 mt -80.35 -13.72 12.98 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.759 0 CA-C-N 119.055 1.427 . . . . 0.0 109.613 179.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.38 -37.26 74.51 Favored 'General case' 0 N--CA 1.524 3.249 0 CA-C-N 120.025 1.284 . . . . 0.0 110.491 177.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 3.2 p -78.97 -44.88 21.49 Favored 'General case' 0 N--CA 1.535 3.809 0 CA-C-N 119.296 0.953 . . . . 0.0 111.563 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.533 HG21 HD23 ' A' ' 71' ' ' LEU . 8.5 pt -70.41 -14.72 18.41 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.873 0 CA-C-O 117.658 -1.163 . . . . 0.0 114.09 -176.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 66.7 p -111.68 -35.78 5.66 Favored 'General case' 0 N--CA 1.517 2.925 0 CA-C-N 120.132 1.333 . . . . 0.0 110.134 178.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -70.17 -23.92 63.06 Favored 'General case' 0 N--CA 1.529 3.515 0 CA-C-N 119.04 0.837 . . . . 0.0 109.357 176.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.26 -32.66 84.51 Favored Glycine 1 N--CA 1.522 4.38 0 N-CA-C 109.336 -1.505 . . . . 0.0 109.336 175.58 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.7 t -70.46 -34.19 72.14 Favored 'General case' 0 N--CA 1.532 3.65 0 CA-C-N 118.146 0.973 . . . . 0.0 110.467 177.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -65.83 -22.78 66.57 Favored 'General case' 0 N--CA 1.535 3.806 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.66 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.1 m -67.38 -37.18 82.76 Favored 'General case' 0 N--CA 1.531 3.624 0 CA-C-N 118.611 0.641 . . . . 0.0 110.539 179.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.0 mt -55.12 -51.79 65.32 Favored 'General case' 0 N--CA 1.525 3.31 0 C-N-CA 124.292 1.037 . . . . 0.0 112.362 -179.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 6.7 ptpt -68.46 -9.28 47.68 Favored 'General case' 0 N--CA 1.536 3.84 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 -178.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.23 -44.81 10.59 Favored 'General case' 0 N--CA 1.521 3.089 0 CA-C-N 119.675 1.125 . . . . 0.0 110.262 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.423 ' HB1' ' HD2' ' A' ' 93' ' ' PRO . . . -56.69 167.03 1.11 Allowed Pre-proline 1 N--CA 1.546 4.374 0 CA-C-O 117.861 -1.066 . . . . 0.0 112.088 179.457 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.423 ' HD2' ' HB1' ' A' ' 92' ' ' ALA . 30.3 Cg_endo -74.31 -179.93 5.23 Favored 'Trans proline' 0 C--N 1.384 2.446 0 C-N-CA 121.055 1.17 . . . . 0.0 110.951 178.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.7 t -102.23 -30.07 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.91 0 CA-C-O 117.506 -1.235 . . . . 0.0 111.683 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -63.02 -40.92 99.21 Favored 'General case' 0 N--CA 1.517 2.907 0 CA-C-N 119.952 1.251 . . . . 0.0 110.839 -177.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.403 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.0 mp -97.84 -20.08 17.73 Favored 'General case' 0 N--CA 1.512 2.649 0 C-N-CA 123.417 0.687 . . . . 0.0 111.445 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.59 -28.63 67.92 Favored 'General case' 0 N--CA 1.536 3.866 0 N-CA-C 103.798 -2.668 . . . . 0.0 103.798 169.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -56.76 -39.84 74.76 Favored 'General case' 0 N--CA 1.515 2.822 0 C-N-CA 124.179 0.991 . . . . 0.0 110.046 173.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.634 ' CH2' ' HB2' ' B' ' 529' ' ' ALA . 54.5 t90 -64.66 -34.69 78.89 Favored 'General case' 0 N--CA 1.524 3.267 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.15 -37.57 47.05 Favored 'General case' 1 N--CA 1.542 4.174 0 CA-C-N 119.279 0.945 . . . . 0.0 108.514 175.589 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -69.11 -40.34 78.41 Favored 'General case' 1 N--CA 1.539 4.021 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 175.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.44 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 2.9 mt-10 -58.78 -22.86 59.2 Favored 'General case' 1 N--CA 1.549 4.5 0 C-N-CA 123.499 0.72 . . . . 0.0 111.031 175.893 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.543 ' HB ' HD23 ' B' ' 525' ' ' LEU . 0.0 OUTLIER -116.44 -2.65 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.508 0 CA-C-O 118.193 -0.908 . . . . 0.0 112.056 -176.87 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.31 -57.36 2.28 Favored 'General case' 0 N--CA 1.515 2.814 0 N-CA-C 104.176 -2.527 . . . . 0.0 104.176 174.645 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 47.2 mt . . . . . 0 N--CA 1.535 3.804 0 C-N-CA 124.935 1.294 . . . . 0.0 109.411 175.839 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 . . . . . 0 N--CA 1.527 3.422 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 519' ' ' TRP . . . . . 0.761 ' CE2' HD22 ' A' ' 39' ' ' LEU . 60.7 t-105 -44.33 -26.32 0.32 Allowed 'General case' 1 N--CA 1.551 4.603 0 C-N-CA 124.188 0.995 . . . . 0.0 113.236 178.216 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 520' ' ' LEU . . . . . 0.539 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.4 mm? -95.39 -32.18 13.05 Favored 'General case' 0 N--CA 1.523 3.212 0 CA-C-O 117.655 -1.164 . . . . 0.0 113.815 -172.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 521' ' ' ARG . . . . . 0.449 HH11 ' HG2' ' B' ' 521' ' ' ARG . 10.7 tpt180 -63.83 -23.28 67.29 Favored 'General case' 0 N--CA 1.529 3.495 0 N-CA-C 106.047 -1.834 . . . . 0.0 106.047 172.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . 0.505 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.7 m-85 -77.93 -42.06 34.33 Favored 'General case' 0 N--CA 1.505 2.302 0 N-CA-C 106.555 -1.646 . . . . 0.0 106.555 174.082 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 523' ' ' VAL . . . . . 0.486 HG23 ' O ' ' B' ' 519' ' ' TRP . 79.0 t -67.34 -20.27 26.41 Favored 'Isoleucine or valine' 1 N--CA 1.563 5.194 0 CA-C-O 117.665 -1.159 . . . . 0.0 112.374 179.008 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -77.15 -54.39 6.58 Favored 'General case' 0 N--CA 1.533 3.713 0 CA-C-N 120.37 1.441 . . . . 0.0 108.43 -178.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . 0.543 HD23 ' HB ' ' A' ' 103' ' ' VAL . 5.1 mp -70.96 -17.42 62.66 Favored 'General case' 0 N--CA 1.527 3.416 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 175.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 526' ' ' LEU . . . . . 0.464 ' HB2' ' HA ' ' B' ' 523' ' ' VAL . 0.6 OUTLIER -69.08 -38.32 78.95 Favored 'General case' 0 N--CA 1.516 2.828 0 N-CA-C 107.162 -1.421 . . . . 0.0 107.162 175.153 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 527' ' ' LYS . . . . . 0.712 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 8.4 tptm -68.85 -19.9 64.27 Favored 'General case' 0 N--CA 1.516 2.87 0 CA-C-O 118.029 -0.986 . . . . 0.0 111.473 176.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -66.95 -38.56 86.36 Favored 'General case' 1 N--CA 1.541 4.122 0 CA-C-N 119.798 1.181 . . . . 0.0 108.325 174.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 529' ' ' ALA . . . . . 0.634 ' HB2' ' CH2' ' A' ' 99' ' ' TRP . . . -89.37 -14.35 35.77 Favored 'General case' 0 N--CA 1.504 2.272 0 CA-C-O 118.52 -0.752 . . . . 0.0 111.012 177.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 530' ' ' TYR . . . . . 0.712 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.7 OUTLIER -75.9 -32.02 59.46 Favored 'General case' 0 N--CA 1.538 3.974 0 CA-C-N 120.098 1.317 . . . . 0.0 109.683 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -65.09 -44.24 89.5 Favored 'General case' 0 N--CA 1.534 3.755 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 177.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -90.63 -87.47 0.19 Allowed 'General case' 0 N--CA 1.518 2.928 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 177.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.8 p30 152.71 52.88 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.827 0 C-N-CA 127.406 2.282 . . . . 0.0 108.025 177.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 534' ' ' LEU . . . . . 0.403 HD22 ' CD2' ' A' ' 96' ' ' LEU . 5.6 mt -111.45 9.38 21.37 Favored 'General case' 0 N--CA 1.529 3.485 0 C-N-CA 124.718 1.207 . . . . 0.0 110.858 -178.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 535' ' ' HIS . . . . . 0.593 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 47.9 p-80 -83.82 1.66 41.98 Favored 'General case' 0 N--CA 1.517 2.879 0 C-N-CA 123.501 0.72 . . . . 0.0 109.499 175.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 536' ' ' LEU . . . . . 0.461 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 42.8 mt -95.17 -51.01 0.24 Allowed Pre-proline 0 N--CA 1.497 1.878 0 CA-C-O 116.507 -1.711 . . . . 0.0 108.488 -176.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 537' ' ' PRO . . . . . 0.461 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 4.5 Cg_exo -66.94 -33.73 31.91 Favored 'Trans proline' 0 C--N 1.394 2.943 0 N-CA-C 107.51 -1.765 . . . . 0.0 107.51 172.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.16 -44.14 93.04 Favored 'General case' 0 N--CA 1.522 3.165 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 175.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 43.3 mt -76.5 -11.38 59.87 Favored 'General case' 0 N--CA 1.535 3.804 0 CA-C-O 118.183 -0.913 . . . . 0.0 112.41 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -83.96 -0.66 52.41 Favored 'General case' 0 N--CA 1.526 3.343 0 CA-C-N 119.56 1.073 . . . . 0.0 109.428 174.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 541' ' ' LEU . . . . . 0.617 HD13 ' N ' ' B' ' 542' ' ' MET . 0.0 OUTLIER -114.46 -50.09 2.81 Favored 'General case' 0 N--CA 1.51 2.536 0 C-N-CA 124.979 1.312 . . . . 0.0 108.416 -179.312 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 542' ' ' MET . . . . . 0.617 ' N ' HD13 ' B' ' 541' ' ' LEU . 4.7 ptm -95.85 7.55 46.02 Favored 'General case' 0 N--CA 1.534 3.738 0 CA-C-O 118.266 -0.874 . . . . 0.0 112.89 -178.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 543' ' ' LEU . . . . . 0.43 ' O ' HG23 ' B' ' 544' ' ' THR . 0.2 OUTLIER -130.39 -102.14 0.3 Allowed 'General case' 0 N--CA 1.531 3.612 0 CA-C-N 120.274 1.397 . . . . 0.0 113.187 -179.576 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 544' ' ' THR . . . . . 0.43 HG23 ' O ' ' B' ' 543' ' ' LEU . 0.3 OUTLIER 165.04 156.38 0.08 OUTLIER Pre-proline 1 N--CA 1.571 5.621 0 CA-C-N 121.425 1.921 . . . . 0.0 110.562 -178.118 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -74.11 -45.7 0.35 Allowed 'Trans proline' 0 C--N 1.388 2.615 0 C-N-CA 123.194 2.596 . . . . 0.0 110.076 177.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -56.33 -28.22 58.3 Favored 'General case' 1 N--CA 1.54 4.037 0 CA-C-O 118.759 -0.639 . . . . 0.0 112.025 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -75.61 -34.66 60.6 Favored 'General case' 0 N--CA 1.524 3.228 0 CA-C-O 117.766 -1.111 . . . . 0.0 110.927 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 9.5 ptt-85 -71.95 -28.55 63.53 Favored 'General case' 0 N--CA 1.534 3.768 0 CA-C-N 119.902 1.228 . . . . 0.0 109.909 177.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -64.29 -48.61 75.02 Favored 'General case' 1 N--CA 1.54 4.048 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 175.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -76.83 -8.91 58.22 Favored 'General case' 0 N--CA 1.52 3.064 0 CA-C-O 118.155 -0.926 . . . . 0.0 111.398 177.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 551' ' ' LEU . . . . . 0.921 HD22 ' CE3' ' A' ' 19' ' ' TRP . 4.2 tp -78.88 -40.38 32.54 Favored 'General case' 0 N--CA 1.519 3.02 0 CA-C-N 120.141 1.337 . . . . 0.0 108.143 176.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -73.85 -42.47 38.18 Favored Glycine 0 N--CA 1.513 3.797 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 3.3 m -71.38 -35.45 71.09 Favored 'General case' 0 N--CA 1.532 3.633 0 CA-C-N 117.612 0.706 . . . . 0.0 110.878 -178.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -67.54 -45.68 74.98 Favored 'General case' 0 N--CA 1.537 3.883 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 177.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 555' ' ' VAL . . . . . 0.471 HG23 ' O ' ' B' ' 551' ' ' LEU . 44.0 t -66.55 -17.87 23.22 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.059 0 CA-C-O 117.703 -1.141 . . . . 0.0 109.622 175.897 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -81.83 -40.08 23.03 Favored 'General case' 0 N--CA 1.519 2.985 0 CA-C-O 116.943 -1.503 . . . . 0.0 111.703 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 557' ' ' ILE . . . . . 0.448 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -73.02 -23.82 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.31 0 CA-C-N 122.277 2.308 . . . . 0.0 109.955 179.057 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 558' ' ' VAL . . . . . 0.554 HG11 HD11 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -85.56 -48.0 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.981 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 179.626 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -61.93 -22.46 65.63 Favored 'General case' 0 N--CA 1.532 3.626 0 CA-C-O 118.801 -0.619 . . . . 0.0 109.856 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -87.79 -29.98 20.59 Favored 'General case' 0 N--CA 1.522 3.159 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 13.5 mt -66.4 -46.58 76.1 Favored 'General case' 1 N--CA 1.542 4.144 0 CA-C-N 118.9 0.773 . . . . 0.0 109.305 178.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 33.1 mt -54.41 -27.02 33.95 Favored 'General case' 0 N--CA 1.537 3.906 0 C-N-CA 123.685 0.794 . . . . 0.0 111.762 178.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 1.9 mmm-85 -79.78 -52.07 8.39 Favored 'General case' 0 N--CA 1.526 3.348 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 59.62 72.07 0.67 Allowed Glycine 1 N--CA 1.527 4.728 0 CA-C-O 119.341 -0.699 . . . . 0.0 112.833 178.001 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -145.76 -56.31 0.3 Allowed 'General case' 0 N--CA 1.525 3.305 0 N-CA-C 108.558 -0.905 . . . . 0.0 108.558 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 46.2 mtt -144.59 61.41 1.33 Allowed 'General case' 0 N--CA 1.526 3.363 0 N-CA-C 106.174 -1.787 . . . . 0.0 106.174 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 65.0 m -131.12 4.26 4.41 Favored 'General case' 0 N--CA 1.52 3.027 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -175.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -96.03 -80.15 0.43 Allowed 'General case' 0 N--CA 1.524 3.241 0 CA-C-N 119.81 1.186 . . . . 0.0 110.28 -179.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.62 -34.3 11.0 Favored 'General case' 0 N--CA 1.539 3.996 0 CA-C-N 119.578 1.081 . . . . 0.0 111.515 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -70.45 -10.1 58.25 Favored 'General case' 0 N--CA 1.518 2.971 0 CA-C-O 118.358 -0.83 . . . . 0.0 112.793 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 571' ' ' LEU . . . . . 0.768 HD23 HD11 ' B' ' 582' ' ' ILE . 14.8 tp -89.6 -43.67 10.61 Favored 'General case' 0 N--CA 1.527 3.395 0 CA-C-N 119.767 1.167 . . . . 0.0 111.106 -178.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -38.48 -32.31 0.07 Allowed 'General case' 1 N--CA 1.558 4.939 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 -178.96 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -74.27 -46.95 38.08 Favored 'General case' 0 N--CA 1.529 3.507 0 CA-C-N 118.183 0.447 . . . . 0.0 110.278 -179.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -46.81 -45.8 20.31 Favored 'General case' 0 N--CA 1.534 3.769 0 C-N-CA 124.94 1.296 . . . . 0.0 113.891 -178.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 1.8 pp -132.39 -44.04 0.93 Allowed 'General case' 0 N--CA 1.535 3.813 0 CA-C-N 118.68 0.673 . . . . 0.0 112.067 -178.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 109.69 81.65 1.28 Allowed Glycine 1 N--CA 1.525 4.603 0 N-CA-C 110.975 -0.85 . . . . 0.0 110.975 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -111.06 -50.99 2.9 Favored 'General case' 0 N--CA 1.522 3.161 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 114.16 163.36 14.74 Favored Glycine 1 N--CA 1.528 4.787 0 N-CA-C 110.219 -1.152 . . . . 0.0 110.219 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 579' ' ' ILE . . . . . 0.432 ' HA ' HG22 ' B' ' 582' ' ' ILE . 0.6 OUTLIER -82.9 -21.02 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.377 0 CA-C-N 119.54 1.67 . . . . 0.0 108.229 177.828 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -68.88 -54.58 14.78 Favored 'General case' 0 N--CA 1.519 2.979 0 CA-C-N 119.578 1.081 . . . . 0.0 109.57 177.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -69.26 -36.75 77.43 Favored 'General case' 1 N--CA 1.539 4.018 0 CA-C-N 118.662 0.665 . . . . 0.0 112.699 -179.026 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 582' ' ' ILE . . . . . 0.768 HD11 HD23 ' B' ' 571' ' ' LEU . 2.1 tt -64.3 -38.18 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.874 0 CA-C-N 118.543 0.61 . . . . 0.0 110.682 -177.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 80.6 p -98.98 -8.75 24.97 Favored 'General case' 0 N--CA 1.509 2.499 0 CA-C-O 118.604 -0.712 . . . . 0.0 111.023 178.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 10.3 ttp180 -72.95 -36.95 67.26 Favored 'General case' 0 N--CA 1.538 3.934 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 174.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -63.32 -38.44 96.44 Favored Glycine 1 N--CA 1.52 4.288 0 N-CA-C 109.075 -1.61 . . . . 0.0 109.075 176.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 19.6 m -58.75 -41.23 86.03 Favored 'General case' 1 N--CA 1.543 4.186 0 C-N-CA 123.217 0.607 . . . . 0.0 111.196 178.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -63.39 -32.47 73.9 Favored 'General case' 1 N--CA 1.539 4.009 0 C-N-CA 123.268 0.627 . . . . 0.0 111.026 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 15.7 m -68.2 -42.05 80.46 Favored 'General case' 0 N--CA 1.534 3.735 0 C-N-CA 123.059 0.544 . . . . 0.0 109.833 178.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 22.1 mt -58.9 -41.06 86.32 Favored 'General case' 0 N--CA 1.53 3.535 0 C-N-CA 124.387 1.075 . . . . 0.0 111.601 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -65.62 -27.08 68.13 Favored 'General case' 0 N--CA 1.539 3.979 0 CA-C-O 118.575 -0.726 . . . . 0.0 112.427 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -95.49 -25.0 16.4 Favored 'General case' 0 N--CA 1.523 3.195 0 CA-C-O 118.524 -0.751 . . . . 0.0 112.606 -179.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -61.59 164.31 9.78 Favored Pre-proline 0 N--CA 1.537 3.903 0 CA-C-N 119.132 0.878 . . . . 0.0 111.758 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -77.48 146.91 24.88 Favored 'Trans proline' 0 C--N 1.381 2.26 0 C-N-CA 121.751 1.634 . . . . 0.0 108.84 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 594' ' ' VAL . . . . . 0.511 ' HA ' ' HB3' ' B' ' 597' ' ' ARG . 2.8 t -80.95 -25.55 10.78 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.826 0 CA-C-O 117.514 -1.232 . . . . 0.0 112.64 -177.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -63.74 -38.42 91.02 Favored 'General case' 0 N--CA 1.519 3.003 0 CA-C-N 120.386 1.448 . . . . 0.0 110.783 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 596' ' ' LEU . . . . . 0.498 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.8 mp -99.68 -18.01 17.49 Favored 'General case' 0 N--CA 1.513 2.689 0 C-N-CA 123.958 0.903 . . . . 0.0 111.064 179.016 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . 0.511 ' HB3' ' HA ' ' B' ' 594' ' ' VAL . 0.0 OUTLIER -63.66 -32.49 73.99 Favored 'General case' 1 N--CA 1.547 4.376 0 N-CA-C 103.635 -2.728 . . . . 0.0 103.635 168.69 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -59.19 -38.77 80.65 Favored 'General case' 0 N--CA 1.521 3.116 0 C-N-CA 125.081 1.352 . . . . 0.0 110.835 174.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 599' ' ' TRP . . . . . 0.636 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 48.0 t90 -59.4 -34.48 72.5 Favored 'General case' 0 N--CA 1.535 3.776 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.464 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 75.6 mt -52.91 -39.86 63.1 Favored 'General case' 0 N--CA 1.539 3.998 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 177.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -70.73 -33.31 70.71 Favored 'General case' 0 N--CA 1.529 3.478 0 O-C-N 123.927 0.767 . . . . 0.0 109.399 176.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -61.71 -23.68 66.28 Favored 'General case' 1 N--CA 1.546 4.374 0 C-N-CA 123.473 0.709 . . . . 0.0 109.858 174.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 603' ' ' VAL . . . . . 0.508 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.1 OUTLIER -117.7 10.47 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.708 0 C-N-CA 123.766 0.826 . . . . 0.0 112.352 -177.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -115.36 -57.82 2.2 Favored 'General case' 0 N--CA 1.512 2.634 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 177.334 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 4.9 tt . . . . . 0 N--CA 1.539 3.996 0 C-N-CA 125.281 1.432 . . . . 0.0 111.689 179.991 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 . . . . . 0 N--CA 1.519 2.988 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.688 ' O ' HG23 ' A' ' 23' ' ' VAL . 71.2 t-105 -52.31 -25.19 8.93 Favored 'General case' 0 N--CA 1.538 3.931 0 CA-C-O 118.083 -0.961 . . . . 0.0 111.794 177.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.52 HD22 ' N ' ' A' ' 20' ' ' LEU . 2.6 mm? -90.2 -30.76 17.38 Favored 'General case' 0 N--CA 1.53 3.573 0 CA-C-O 118.253 -0.88 . . . . 0.0 112.153 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.06 -27.47 68.92 Favored 'General case' 0 N--CA 1.534 3.735 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 173.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -88.28 -28.5 21.04 Favored 'General case' 0 N--CA 1.511 2.62 0 CA-C-O 116.359 -1.782 . . . . 0.0 108.245 174.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.688 HG23 ' O ' ' A' ' 19' ' ' TRP . 69.5 t -72.15 -22.89 21.26 Favored 'Isoleucine or valine' 1 N--CA 1.567 5.393 0 CA-C-N 122.241 2.291 . . . . 0.0 111.045 179.286 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -77.93 -51.46 10.37 Favored 'General case' 0 N--CA 1.53 3.536 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 178.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.61 -27.79 69.48 Favored 'General case' 0 N--CA 1.536 3.83 0 O-C-N 123.267 0.354 . . . . 0.0 110.609 176.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.95 -33.25 63.84 Favored 'General case' 0 N--CA 1.524 3.274 0 CA-C-O 118.214 -0.898 . . . . 0.0 109.033 177.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.421 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 13.4 mttt -68.98 -24.09 64.19 Favored 'General case' 0 N--CA 1.524 3.261 0 CA-C-O 118.378 -0.82 . . . . 0.0 110.74 177.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -73.44 -43.32 60.61 Favored 'General case' 0 N--CA 1.533 3.722 0 CA-C-N 119.166 0.894 . . . . 0.0 108.893 177.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.639 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -85.85 -8.64 57.94 Favored 'General case' 0 N--CA 1.508 2.463 0 CA-C-O 118.314 -0.85 . . . . 0.0 110.71 178.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.421 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 1.4 m-85 -80.16 -27.45 39.0 Favored 'General case' 0 N--CA 1.53 3.55 0 CA-C-N 120.032 1.287 . . . . 0.0 107.672 177.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -62.53 -48.84 77.76 Favored 'General case' 0 N--CA 1.531 3.602 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 176.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -91.82 -89.92 0.18 Allowed 'General case' 0 N--CA 1.514 2.738 0 N-CA-C 106.29 -1.744 . . . . 0.0 106.29 177.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 p30 156.18 50.16 0.0 OUTLIER 'General case' 1 N--CA 1.555 4.805 0 C-N-CA 127.489 2.316 . . . . 0.0 107.809 177.493 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.433 HD22 ' CD2' ' B' ' 596' ' ' LEU . 8.7 mt -107.05 10.36 30.29 Favored 'General case' 0 N--CA 1.53 3.525 0 C-N-CA 124.644 1.178 . . . . 0.0 110.606 -178.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.543 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 42.2 p-80 -85.06 5.14 30.8 Favored 'General case' 0 N--CA 1.507 2.38 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 175.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.803 ' HA ' HD23 ' A' ' 39' ' ' LEU . 26.5 mt -93.95 -51.47 0.26 Allowed Pre-proline 0 N--CA 1.506 2.361 0 CA-C-O 116.8 -1.572 . . . . 0.0 108.773 -176.13 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.487 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 4.0 Cg_exo -65.57 -34.5 41.96 Favored 'Trans proline' 0 C--N 1.397 3.13 0 N-CA-C 106.1 -2.308 . . . . 0.0 106.1 170.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.543 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.3 OUTLIER -63.27 -37.7 88.26 Favored 'General case' 0 N--CA 1.518 2.938 0 C-N-CA 124.078 0.951 . . . . 0.0 109.337 176.363 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.803 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -71.43 -25.89 62.51 Favored 'General case' 1 N--CA 1.551 4.579 0 CA-C-N 120.06 1.3 . . . . 0.0 110.186 176.945 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -72.36 -19.28 61.65 Favored 'General case' 0 N--CA 1.526 3.354 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.366 177.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.5 pp -101.48 -46.32 5.02 Favored 'General case' 0 N--CA 1.53 3.527 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 -177.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 6.2 ptp -105.23 -2.29 24.28 Favored 'General case' 1 N--CA 1.54 4.05 0 CA-C-O 117.994 -1.003 . . . . 0.0 112.332 -176.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.43 -87.01 0.53 Allowed 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 117.843 -1.075 . . . . 0.0 109.065 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 154.55 163.4 0.0 OUTLIER Pre-proline 1 N--CA 1.564 5.256 0 C-N-CA 125.71 1.604 . . . . 0.0 109.888 179.672 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -71.84 -36.59 6.02 Favored 'Trans proline' 0 C--N 1.383 2.36 0 C-N-CA 122.827 2.351 . . . . 0.0 108.033 173.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -70.43 -16.61 62.96 Favored 'General case' 0 N--CA 1.525 3.288 0 CA-C-O 117.928 -1.034 . . . . 0.0 110.536 176.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -71.57 -35.25 70.52 Favored 'General case' 0 N--CA 1.527 3.415 0 CA-C-N 119.629 1.104 . . . . 0.0 108.364 176.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 10.1 ptt180 -85.5 -19.23 31.51 Favored 'General case' 0 N--CA 1.527 3.405 0 CA-C-O 118.477 -0.773 . . . . 0.0 109.549 175.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -70.01 -33.0 71.45 Favored 'General case' 0 N--CA 1.534 3.727 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 174.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.444 ' HB1' ' CZ ' ' A' ' 54' ' ' ARG . . . -88.7 -31.56 18.41 Favored 'General case' 0 N--CA 1.506 2.359 0 CA-C-O 117.719 -1.134 . . . . 0.0 110.094 179.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.531 HD23 ' CE3' ' B' ' 519' ' ' TRP . 12.3 tp -70.58 -23.28 62.56 Favored 'General case' 0 N--CA 1.535 3.818 0 CA-C-N 120.856 1.662 . . . . 0.0 107.588 175.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.425 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -72.97 -69.97 1.31 Allowed Glycine 0 N--CA 1.502 3.089 0 C-N-CA 124.802 1.191 . . . . 0.0 111.181 176.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.9 m -67.09 -24.7 65.97 Favored 'General case' 1 N--CA 1.542 4.145 0 CA-C-N 117.897 0.848 . . . . 0.0 112.505 -177.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.444 ' CZ ' ' HB1' ' A' ' 50' ' ' ALA . 84.0 mtt180 -70.0 -50.51 40.87 Favored 'General case' 0 N--CA 1.527 3.401 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 176.433 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 23.1 t -63.53 -17.77 20.73 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.103 0 CA-C-O 118.073 -0.965 . . . . 0.0 110.209 175.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 57.4 mtt-85 -70.8 -56.36 6.5 Favored 'General case' 0 N--CA 1.528 3.427 0 CA-C-N 119.635 1.107 . . . . 0.0 111.09 177.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.432 ' CG2' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -68.76 -24.48 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.91 0 CA-C-N 119.871 1.214 . . . . 0.0 112.202 -177.194 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -83.26 -48.91 17.17 Favored 'Isoleucine or valine' 1 N--CA 1.55 4.531 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 -179.803 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -63.13 -21.78 66.42 Favored 'General case' 0 N--CA 1.528 3.458 0 CA-C-O 118.693 -0.67 . . . . 0.0 110.418 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -90.65 -23.76 20.68 Favored 'General case' 0 N--CA 1.529 3.505 0 CA-C-O 118.137 -0.935 . . . . 0.0 110.27 177.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 14.5 tp -81.57 -53.09 6.55 Favored 'General case' 0 N--CA 1.522 3.132 0 CA-C-N 119.515 1.052 . . . . 0.0 109.12 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 28.9 mt -48.12 -29.58 3.76 Favored 'General case' 1 N--CA 1.541 4.117 0 C-N-CA 124.99 1.316 . . . . 0.0 112.96 -178.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 19.5 mmm-85 -89.98 -42.24 11.28 Favored 'General case' 0 N--CA 1.528 3.447 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.07 85.37 0.76 Allowed Glycine 0 N--CA 1.513 3.783 0 N-CA-C 110.071 -1.211 . . . . 0.0 110.071 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -156.7 -57.56 0.09 Allowed 'General case' 0 N--CA 1.521 3.103 0 CA-C-N 117.398 0.599 . . . . 0.0 110.546 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 36.1 mtt -139.49 80.65 1.79 Allowed 'General case' 0 N--CA 1.513 2.675 0 CA-C-O 121.976 0.893 . . . . 0.0 108.939 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.3 t -135.53 2.92 3.0 Favored 'General case' 0 N--CA 1.525 3.299 0 CA-C-N 115.582 -0.735 . . . . 0.0 112.747 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -120.41 -77.88 0.59 Allowed 'General case' 0 N--CA 1.525 3.322 0 CA-C-N 119.912 1.233 . . . . 0.0 113.147 -178.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -103.53 -44.21 5.18 Favored 'General case' 0 N--CA 1.53 3.556 0 CA-C-N 119.336 0.971 . . . . 0.0 112.019 -176.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -71.81 -9.8 58.83 Favored 'General case' 0 N--CA 1.513 2.703 0 CA-C-O 117.761 -1.114 . . . . 0.0 112.553 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.597 HD23 HG21 ' A' ' 82' ' ' ILE . 24.4 tp -80.79 -52.24 7.74 Favored 'General case' 0 N--CA 1.523 3.223 0 CA-C-N 120.185 1.357 . . . . 0.0 112.273 -178.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -43.81 -30.87 0.72 Allowed 'General case' 1 N--CA 1.547 4.414 0 CA-C-N 119.353 0.979 . . . . 0.0 113.358 -177.809 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -82.28 -38.66 24.07 Favored 'General case' 0 N--CA 1.527 3.377 0 CA-C-O 118.795 -0.621 . . . . 0.0 111.551 -178.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -47.34 -56.77 6.21 Favored 'General case' 1 N--CA 1.539 4.004 0 C-N-CA 124.365 1.066 . . . . 0.0 113.155 -178.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -124.03 -43.35 2.1 Favored 'General case' 0 N--CA 1.534 3.747 0 CA-C-O 118.777 -0.63 . . . . 0.0 111.088 -179.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 128.9 76.8 0.19 Allowed Glycine 1 N--CA 1.521 4.31 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -140.12 114.22 9.02 Favored 'General case' 0 N--CA 1.52 3.072 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 178.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -47.06 171.43 0.03 OUTLIER Glycine 1 N--CA 1.542 5.748 0 C-N-CA 124.202 0.906 . . . . 0.0 113.781 -178.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -81.7 -18.77 11.27 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.684 0 CA-C-N 118.871 1.336 . . . . 0.0 108.404 178.473 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.39 -45.78 78.85 Favored 'General case' 0 N--CA 1.52 3.036 0 CA-C-N 119.972 1.26 . . . . 0.0 110.774 177.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -72.57 -39.31 67.53 Favored 'General case' 0 N--CA 1.536 3.83 0 CA-C-N 119.335 0.97 . . . . 0.0 112.524 -178.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.597 HG21 HD23 ' A' ' 71' ' ' LEU . 10.1 pt -71.33 -26.03 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.968 0 CA-C-N 119.255 0.934 . . . . 0.0 111.541 -179.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 73.1 p -102.2 -4.69 25.38 Favored 'General case' 0 N--CA 1.517 2.895 0 CA-C-N 119.125 0.875 . . . . 0.0 110.228 174.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -80.13 -33.02 38.95 Favored 'General case' 0 N--CA 1.533 3.689 0 N-CA-C 105.506 -2.035 . . . . 0.0 105.506 172.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -66.57 -28.59 73.83 Favored Glycine 1 N--CA 1.524 4.543 0 CA-C-O 118.407 -1.219 . . . . 0.0 110.634 176.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 90.7 p -64.21 -21.03 66.42 Favored 'General case' 1 N--CA 1.542 4.174 0 CA-C-N 119.015 1.407 . . . . 0.0 111.339 177.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -55.33 -23.42 23.69 Favored 'General case' 1 N--CA 1.544 4.244 0 CA-C-N 118.659 0.663 . . . . 0.0 110.549 176.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.406 ' HB3' ' HG ' ' B' ' 541' ' ' LEU . 78.5 p -45.33 -48.79 13.19 Favored 'General case' 1 N--CA 1.546 4.358 0 C-N-CA 125.709 1.603 . . . . 0.0 111.743 178.213 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.9 mt -67.69 -39.67 84.41 Favored 'General case' 0 N--CA 1.522 3.169 0 C-N-CA 124.195 0.998 . . . . 0.0 110.703 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.15 0.25 55.59 Favored 'General case' 0 N--CA 1.53 3.566 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -178.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -125.04 -61.88 1.26 Allowed 'General case' 0 N--CA 1.523 3.215 0 CA-C-N 120.218 1.372 . . . . 0.0 110.449 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.1 161.6 6.89 Favored Pre-proline 1 N--CA 1.54 4.066 0 C-N-CA 123.755 0.822 . . . . 0.0 113.146 -179.467 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.444 ' O ' ' HB2' ' A' ' 97' ' ' ARG . 41.3 Cg_endo -80.73 -179.14 4.92 Favored 'Trans proline' 0 C--N 1.38 2.214 0 C-N-CA 121.886 1.724 . . . . 0.0 110.437 178.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.1 t -99.67 -27.23 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.283 0 CA-C-O 117.864 -1.065 . . . . 0.0 111.65 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -61.73 -39.81 92.86 Favored 'General case' 0 N--CA 1.522 3.144 0 CA-C-N 119.989 1.268 . . . . 0.0 111.035 -178.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.469 ' CD2' HD22 ' B' ' 534' ' ' LEU . 6.6 mp -97.77 -18.11 18.98 Favored 'General case' 0 N--CA 1.511 2.624 0 C-N-CA 123.882 0.873 . . . . 0.0 110.817 179.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -62.37 -37.66 86.58 Favored 'General case' 1 N--CA 1.544 4.256 0 N-CA-C 103.826 -2.657 . . . . 0.0 103.826 168.725 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -53.83 -39.66 65.74 Favored 'General case' 0 N--CA 1.516 2.828 0 C-N-CA 125.102 1.361 . . . . 0.0 111.289 174.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.59 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 45.7 t90 -59.54 -36.59 76.43 Favored 'General case' 0 N--CA 1.533 3.703 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 179.171 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 44.3 mt -53.11 -40.2 63.98 Favored 'General case' 1 N--CA 1.546 4.35 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 176.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -68.85 -34.4 75.42 Favored 'General case' 0 N--CA 1.526 3.332 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 176.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.402 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 2.0 mt-10 -61.45 -25.42 67.22 Favored 'General case' 1 N--CA 1.548 4.433 0 C-N-CA 123.655 0.782 . . . . 0.0 110.051 174.604 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -116.79 6.14 7.2 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.34 0 C-N-CA 124.147 0.979 . . . . 0.0 112.093 -177.197 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 29.2 mt -112.68 -61.56 1.71 Allowed 'General case' 0 N--CA 1.521 3.098 0 N-CA-C 106.091 -1.818 . . . . 0.0 106.091 176.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.4 tp . . . . . 0 N--CA 1.535 3.794 0 C-N-CA 125.138 1.375 . . . . 0.0 111.787 178.811 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 . . . . . 0 N--CA 1.52 3.043 0 CA-C-O 119.145 -0.455 . . . . 0.0 110.976 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 519' ' ' TRP . . . . . 0.662 ' NE1' HD22 ' A' ' 39' ' ' LEU . 69.0 t-105 -36.37 -55.28 0.82 Allowed 'General case' 1 N--CA 1.55 4.552 0 C-N-CA 124.951 1.3 . . . . 0.0 114.033 -176.551 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 520' ' ' LEU . . . . . 0.628 HD13 ' H ' ' B' ' 520' ' ' LEU . 0.0 OUTLIER -73.85 -24.76 59.81 Favored 'General case' 0 N--CA 1.533 3.709 0 CA-C-O 117.275 -1.345 . . . . 0.0 114.518 -175.347 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.65 -25.71 64.96 Favored 'General case' 0 N--CA 1.534 3.752 0 N-CA-C 105.626 -1.99 . . . . 0.0 105.626 172.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . 0.511 ' CD2' ' HG ' ' A' ' 51' ' ' LEU . 3.2 m-85 -76.46 -35.25 58.56 Favored 'General case' 0 N--CA 1.515 2.814 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 172.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 80.1 t -69.09 -19.24 23.58 Favored 'Isoleucine or valine' 1 N--CA 1.55 4.526 0 CA-C-O 117.599 -1.191 . . . . 0.0 111.025 176.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -73.23 -52.53 13.7 Favored 'General case' 0 N--CA 1.535 3.81 0 CA-C-N 120.614 1.552 . . . . 0.0 107.985 -179.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 5.4 mp -67.98 -23.88 65.08 Favored 'General case' 0 N--CA 1.531 3.619 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 175.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.1 -34.17 77.04 Favored 'General case' 0 N--CA 1.522 3.138 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 175.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 527' ' ' LYS . . . . . 0.424 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 0.9 OUTLIER -69.31 -26.84 64.93 Favored 'General case' 0 N--CA 1.518 2.958 0 CA-C-O 118.297 -0.858 . . . . 0.0 110.385 176.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -67.98 -37.16 81.17 Favored 'General case' 0 N--CA 1.534 3.758 0 CA-C-N 119.125 0.875 . . . . 0.0 109.16 176.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 529' ' ' ALA . . . . . 0.59 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -91.62 -8.74 46.4 Favored 'General case' 0 CA--C 1.582 2.187 0 CA-C-O 118.369 -0.825 . . . . 0.0 110.476 178.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 530' ' ' TYR . . . . . 0.424 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.1 OUTLIER -81.11 -33.62 33.16 Favored 'General case' 0 N--CA 1.533 3.716 0 CA-C-N 120.468 1.486 . . . . 0.0 108.977 179.635 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -62.14 -44.43 96.65 Favored 'General case' 0 N--CA 1.535 3.808 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 177.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 -89.74 -86.72 0.19 Allowed 'General case' 0 N--CA 1.522 3.148 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 177.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.9 p30 151.7 48.79 0.0 OUTLIER 'General case' 1 N--CA 1.559 5.023 0 C-N-CA 127.426 2.291 . . . . 0.0 108.688 177.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 534' ' ' LEU . . . . . 0.469 HD22 ' CD2' ' A' ' 96' ' ' LEU . 6.5 mt -108.45 12.54 26.13 Favored 'General case' 0 N--CA 1.524 3.273 0 C-N-CA 124.665 1.186 . . . . 0.0 110.276 -179.303 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 535' ' ' HIS . . . . . 0.55 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 46.9 p-80 -83.93 4.38 29.88 Favored 'General case' 0 N--CA 1.516 2.829 0 C-N-CA 123.595 0.758 . . . . 0.0 109.076 175.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 536' ' ' LEU . . . . . 0.464 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 35.5 mt -97.12 -49.61 0.23 Allowed Pre-proline 0 N--CA 1.506 2.365 0 CA-C-O 116.526 -1.702 . . . . 0.0 109.125 -175.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 537' ' ' PRO . . . . . 0.464 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 2.9 Cg_exo -67.69 -34.38 25.12 Favored 'Trans proline' 0 C--N 1.394 2.963 0 C-N-CA 122.386 2.057 . . . . 0.0 107.417 171.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.78 -47.12 79.3 Favored 'General case' 0 N--CA 1.523 3.185 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 176.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 76.4 mt -77.67 -6.59 54.39 Favored 'General case' 0 N--CA 1.533 3.71 0 CA-C-O 118.702 -0.666 . . . . 0.0 111.228 178.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -63.76 -30.65 71.73 Favored 'General case' 0 N--CA 1.532 3.648 0 CA-C-N 119.584 1.084 . . . . 0.0 109.52 176.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 541' ' ' LEU . . . . . 0.406 ' HG ' ' HB3' ' A' ' 88' ' ' SER . 3.4 tm? -104.31 -50.9 3.23 Favored 'General case' 0 N--CA 1.509 2.489 0 CA-C-O 118.63 -0.7 . . . . 0.0 109.942 179.07 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 9.9 ptp -82.51 17.91 1.64 Allowed 'General case' 0 N--CA 1.533 3.698 0 CA-C-N 118.938 0.79 . . . . 0.0 112.859 -177.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 7.6 tp -138.85 -73.71 0.39 Allowed 'General case' 0 N--CA 1.528 3.428 0 CA-C-N 119.674 1.124 . . . . 0.0 111.542 174.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 66.5 p 116.73 152.82 0.0 OUTLIER Pre-proline 1 N--CA 1.571 5.591 0 C-N-CA 127.947 2.499 . . . . 0.0 111.02 -179.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -69.57 -40.91 5.03 Favored 'Trans proline' 0 C--N 1.396 3.052 0 C-N-CA 123.027 2.485 . . . . 0.0 110.04 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -57.9 -29.47 65.11 Favored 'General case' 1 N--CA 1.543 4.195 0 C-N-CA 123.422 0.689 . . . . 0.0 110.773 178.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -75.05 -36.54 61.82 Favored 'General case' 0 N--CA 1.521 3.116 0 CA-C-O 118.279 -0.867 . . . . 0.0 108.744 177.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 548' ' ' ARG . . . . . 0.482 ' HA ' HD12 ' B' ' 551' ' ' LEU . 35.3 ptt180 -83.26 3.7 30.13 Favored 'General case' 0 N--CA 1.531 3.623 0 CA-C-N 118.993 0.815 . . . . 0.0 111.036 174.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -85.09 -48.96 8.67 Favored 'General case' 0 N--CA 1.519 2.99 0 N-CA-C 102.663 -3.088 . . . . 0.0 102.663 170.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -77.52 -11.91 59.91 Favored 'General case' 0 N--CA 1.504 2.253 0 CA-C-O 116.947 -1.501 . . . . 0.0 112.357 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 551' ' ' LEU . . . . . 0.679 HD11 ' N ' ' A' ' 19' ' ' TRP . 0.0 OUTLIER -75.32 -39.02 59.91 Favored 'General case' 1 N--CA 1.54 4.032 0 CA-C-N 121.559 1.982 . . . . 0.0 106.457 174.682 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' B' B ' 552' ' ' GLY . . . . . 0.667 ' N ' HD13 ' B' ' 551' ' ' LEU . . . -66.6 -56.23 14.16 Favored Glycine 0 N--CA 1.495 2.629 0 N-CA-C 109.021 -1.632 . . . . 0.0 109.021 -178.058 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.6 m -64.57 -30.52 71.55 Favored 'General case' 1 N--CA 1.542 4.141 0 CA-C-O 118.495 -0.764 . . . . 0.0 112.302 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -65.97 -52.93 45.17 Favored 'General case' 1 N--CA 1.545 4.306 0 N-CA-C 107.184 -1.413 . . . . 0.0 107.184 177.126 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 555' ' ' VAL . . . . . 0.502 HG23 ' O ' ' B' ' 551' ' ' LEU . 28.1 t -64.15 -18.51 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.738 0 CA-C-O 117.88 -1.057 . . . . 0.0 110.176 177.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -79.42 -43.6 23.04 Favored 'General case' 0 N--CA 1.529 3.498 0 CA-C-O 117.554 -1.213 . . . . 0.0 111.499 179.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 557' ' ' ILE . . . . . 0.467 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -73.46 -23.89 19.89 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.248 0 CA-C-N 121.017 1.735 . . . . 0.0 110.678 -179.701 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 558' ' ' VAL . . . . . 0.467 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -84.33 -50.62 14.87 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.809 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -179.444 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -61.34 -23.54 65.82 Favored 'General case' 0 N--CA 1.532 3.646 0 CA-C-O 118.797 -0.621 . . . . 0.0 110.049 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -96.89 -20.35 18.2 Favored 'General case' 0 N--CA 1.525 3.321 0 CA-C-O 117.541 -1.218 . . . . 0.0 111.757 179.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 3.3 pp -88.8 -33.39 17.44 Favored 'General case' 0 N--CA 1.538 3.961 0 CA-C-N 120.59 1.541 . . . . 0.0 110.102 179.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 1.1 tt -58.54 -36.57 74.07 Favored 'General case' 0 N--CA 1.537 3.906 0 C-N-CA 124.15 0.98 . . . . 0.0 110.301 178.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 11.8 mmm-85 -74.36 -52.25 12.72 Favored 'General case' 0 N--CA 1.532 3.644 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 70.76 89.09 0.1 OUTLIER Glycine 0 N--CA 1.513 3.81 0 CA-C-O 119.512 -0.604 . . . . 0.0 112.991 176.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -148.25 -54.23 0.2 Allowed 'General case' 0 N--CA 1.525 3.303 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 14.5 ptm -148.2 61.87 1.11 Allowed 'General case' 0 N--CA 1.525 3.297 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 6.8 t -123.84 1.47 8.72 Favored 'General case' 0 N--CA 1.522 3.153 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -88.17 -71.56 0.57 Allowed 'General case' 0 N--CA 1.522 3.131 0 CA-C-N 119.754 1.161 . . . . 0.0 110.67 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.53 -19.89 12.38 Favored 'General case' 0 N--CA 1.536 3.845 0 CA-C-O 118.338 -0.839 . . . . 0.0 112.36 -179.214 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -83.98 -7.7 59.34 Favored 'General case' 0 N--CA 1.518 2.957 0 CA-C-N 119.245 0.929 . . . . 0.0 113.251 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 571' ' ' LEU . . . . . 0.607 HD23 HD11 ' B' ' 582' ' ' ILE . 60.6 tp -89.69 -50.02 6.31 Favored 'General case' 0 N--CA 1.535 3.811 0 CA-C-N 120.313 1.415 . . . . 0.0 113.635 -177.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -36.18 -33.56 0.04 OUTLIER 'General case' 1 N--CA 1.548 4.475 0 N-CA-C 116.173 1.916 . . . . 0.0 116.173 -175.03 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -66.21 -44.63 83.32 Favored 'General case' 1 N--CA 1.543 4.186 0 CA-C-N 118.724 0.693 . . . . 0.0 109.816 -179.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -62.78 -43.46 98.75 Favored 'General case' 0 N--CA 1.523 3.192 0 C-N-CA 124.77 1.228 . . . . 0.0 112.282 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 51.0 mt -102.68 -64.45 1.07 Allowed 'General case' 0 N--CA 1.533 3.685 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -176.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 101.86 45.43 1.77 Allowed Glycine 0 N--CA 1.512 3.745 0 N-CA-C 108.494 -1.843 . . . . 0.0 108.494 -176.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -93.44 -37.08 12.15 Favored 'General case' 0 N--CA 1.527 3.41 0 CA-C-N 117.475 0.637 . . . . 0.0 110.329 179.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 109.48 164.56 20.01 Favored Glycine 1 N--CA 1.523 4.456 0 N-CA-C 110.0 -1.24 . . . . 0.0 110.0 -178.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 579' ' ' ILE . . . . . 0.445 ' HA ' HG22 ' B' ' 582' ' ' ILE . 1.9 mt -84.69 -16.88 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.719 0 CA-C-N 119.227 1.514 . . . . 0.0 108.36 177.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -69.66 -39.56 76.99 Favored 'General case' 0 N--CA 1.524 3.249 0 CA-C-N 119.874 1.215 . . . . 0.0 109.159 176.113 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 2.6 p -74.78 -40.55 61.1 Favored 'General case' 0 N--CA 1.537 3.879 0 CA-C-N 118.449 0.568 . . . . 0.0 111.527 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 582' ' ' ILE . . . . . 0.607 HD11 HD23 ' B' ' 571' ' ' LEU . 2.8 tt -66.12 -37.35 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.518 0 C-N-CA 123.243 0.617 . . . . 0.0 112.336 -175.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 80.5 p -95.92 -33.12 12.3 Favored 'General case' 0 N--CA 1.515 2.812 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.221 -178.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -71.31 -21.57 62.05 Favored 'General case' 0 N--CA 1.529 3.509 0 CA-C-N 119.188 0.904 . . . . 0.0 109.333 176.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -69.37 -33.31 72.67 Favored Glycine 1 N--CA 1.517 4.052 0 N-CA-C 108.784 -1.726 . . . . 0.0 108.784 174.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 37.5 m -63.5 -39.34 94.2 Favored 'General case' 1 N--CA 1.544 4.234 0 CA-C-N 118.376 1.088 . . . . 0.0 110.166 177.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -60.13 -27.88 67.42 Favored 'General case' 1 N--CA 1.543 4.217 0 C-N-CA 123.614 0.766 . . . . 0.0 111.314 178.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 73.7 m -58.88 -44.73 91.2 Favored 'General case' 0 N--CA 1.537 3.914 0 C-N-CA 123.771 0.828 . . . . 0.0 111.57 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 33.5 mt -57.44 -42.65 82.87 Favored 'General case' 0 N--CA 1.528 3.457 0 C-N-CA 123.862 0.865 . . . . 0.0 111.127 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.54 -26.38 68.54 Favored 'General case' 1 N--CA 1.541 4.084 0 CA-C-O 118.638 -0.696 . . . . 0.0 111.889 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -76.54 -42.84 41.56 Favored 'General case' 0 N--CA 1.518 2.949 0 CA-C-N 118.598 0.635 . . . . 0.0 110.522 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -62.64 159.54 42.38 Favored Pre-proline 0 N--CA 1.536 3.844 0 CA-C-O 118.386 -0.816 . . . . 0.0 111.863 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -78.83 -176.46 3.3 Favored 'Trans proline' 0 C--N 1.377 2.059 0 C-N-CA 121.63 1.554 . . . . 0.0 110.981 178.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.4 t -96.68 -29.86 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.95 0 CA-C-O 117.8 -1.095 . . . . 0.0 111.099 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -65.83 -38.25 88.39 Favored 'General case' 0 N--CA 1.515 2.808 0 CA-C-N 119.63 1.104 . . . . 0.0 110.03 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 596' ' ' LEU . . . . . 0.433 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.7 mp -98.51 -18.33 18.24 Favored 'General case' 0 N--CA 1.511 2.579 0 C-N-CA 123.776 0.831 . . . . 0.0 111.27 178.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.52 -30.14 69.73 Favored 'General case' 0 N--CA 1.535 3.783 0 N-CA-C 103.124 -2.917 . . . . 0.0 103.124 167.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -55.34 -38.87 69.31 Favored 'General case' 0 N--CA 1.518 2.942 0 C-N-CA 123.859 0.863 . . . . 0.0 110.174 173.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 599' ' ' TRP . . . . . 0.639 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 50.5 t90 -62.17 -37.39 85.04 Favored 'General case' 0 N--CA 1.527 3.388 0 CA-C-O 117.75 -1.119 . . . . 0.0 108.168 178.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 11.2 mp -54.19 -38.17 65.33 Favored 'General case' 1 N--CA 1.542 4.165 0 CA-C-N 119.226 0.921 . . . . 0.0 108.638 176.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -71.1 -32.53 69.15 Favored 'General case' 0 N--CA 1.531 3.624 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 176.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 602' ' ' GLU . . . . . 0.426 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 2.2 mm-40 -64.4 -22.17 66.87 Favored 'General case' 1 N--CA 1.544 4.265 0 C-N-CA 123.687 0.795 . . . . 0.0 110.133 174.899 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 603' ' ' VAL . . . . . 0.562 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.1 OUTLIER -121.05 3.45 6.51 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.495 0 C-N-CA 123.807 0.843 . . . . 0.0 112.295 -177.521 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -110.91 -56.95 2.3 Favored 'General case' 0 N--CA 1.514 2.761 0 N-CA-C 105.774 -1.936 . . . . 0.0 105.774 176.307 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 2.5 tt . . . . . 0 N--CA 1.532 3.659 0 C-N-CA 124.901 1.281 . . . . 0.0 111.486 -179.977 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 . . . . . 0 N--CA 1.528 3.426 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.587 ' CZ3' HD22 ' B' ' 551' ' ' LEU . 72.5 t-105 -52.99 -46.98 68.54 Favored 'General case' 0 N--CA 1.539 4.0 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 175.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.419 HD22 ' N ' ' A' ' 20' ' ' LEU . 3.6 mm? -74.15 -27.38 60.81 Favored 'General case' 0 N--CA 1.514 2.736 0 O-C-N 125.339 1.649 . . . . 0.0 112.087 -177.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.0 ttt180 -56.95 -29.51 63.22 Favored 'General case' 1 N--CA 1.544 4.242 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 173.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.48 ' O ' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -83.57 -38.71 21.31 Favored 'General case' 0 CA--C 1.586 2.338 0 CA-C-O 116.387 -1.768 . . . . 0.0 109.003 173.733 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.558 HG11 ' NE2' ' B' ' 535' ' ' HIS . 19.2 t -70.15 -27.53 32.64 Favored 'Isoleucine or valine' 1 N--CA 1.574 5.73 0 CA-C-N 121.042 1.746 . . . . 0.0 112.985 -175.185 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -73.91 -50.52 19.75 Favored 'General case' 0 N--CA 1.535 3.814 0 CA-C-N 119.994 1.27 . . . . 0.0 108.258 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.2 mp -72.51 -15.62 61.79 Favored 'General case' 0 N--CA 1.528 3.447 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 175.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -70.44 -35.2 73.22 Favored 'General case' 0 N--CA 1.518 2.951 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 174.611 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.449 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 29.6 ttmt -64.03 -24.19 67.62 Favored 'General case' 0 N--CA 1.525 3.302 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.485 176.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -69.55 -41.23 76.17 Favored 'General case' 0 N--CA 1.534 3.766 0 CA-C-N 119.282 0.946 . . . . 0.0 108.583 176.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.631 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -87.21 -7.99 57.34 Favored 'General case' 0 N--CA 1.504 2.263 0 CA-C-O 118.59 -0.719 . . . . 0.0 110.738 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.449 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -84.1 -31.83 25.06 Favored 'General case' 0 N--CA 1.534 3.743 0 CA-C-N 120.433 1.47 . . . . 0.0 109.059 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -64.5 -41.33 96.5 Favored 'General case' 0 N--CA 1.531 3.607 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 51.6 m-80 -92.75 -90.78 0.18 Allowed 'General case' 0 N--CA 1.514 2.766 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 177.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.0 p30 155.19 51.16 0.0 OUTLIER 'General case' 1 N--CA 1.555 4.782 0 C-N-CA 127.381 2.272 . . . . 0.0 108.222 177.19 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.529 HD22 ' CD2' ' B' ' 596' ' ' LEU . 7.2 mt -110.08 12.21 23.61 Favored 'General case' 0 N--CA 1.522 3.149 0 C-N-CA 124.209 1.003 . . . . 0.0 110.459 -179.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.53 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 50.0 p-80 -84.47 5.82 25.92 Favored 'General case' 0 N--CA 1.515 2.781 0 C-N-CA 123.723 0.809 . . . . 0.0 108.854 174.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.59 ' HA ' HD23 ' A' ' 39' ' ' LEU . 31.7 mt -96.09 -52.39 0.23 Allowed Pre-proline 0 N--CA 1.502 2.151 0 CA-C-O 117.058 -1.448 . . . . 0.0 108.746 -176.199 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.463 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 6.1 Cg_exo -66.41 -32.04 41.36 Favored 'Trans proline' 0 C--N 1.391 2.799 0 N-CA-C 107.106 -1.921 . . . . 0.0 107.106 170.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.53 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 1.0 OUTLIER -65.58 -41.64 92.66 Favored 'General case' 0 N--CA 1.52 3.034 0 CA-C-O 118.212 -0.899 . . . . 0.0 108.739 176.79 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.59 HD23 ' HA ' ' A' ' 36' ' ' LEU 0.274 0.1 OUTLIER -78.28 -8.58 58.56 Favored 'General case' 1 N--CA 1.552 4.653 0 CA-C-N 119.612 1.096 . . . . 0.0 111.448 177.272 . . . . . . . . 5 4 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -90.22 8.57 32.43 Favored 'General case' 0 N--CA 1.524 3.245 0 CA-C-N 118.727 0.694 . . . . 0.0 109.618 174.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.57 HD11 HG11 ' B' ' 558' ' ' VAL . 0.3 OUTLIER -125.47 -56.32 1.51 Allowed 'General case' 0 N--CA 1.513 2.723 0 C-N-CA 124.048 0.939 . . . . 0.0 109.629 -178.748 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.566 ' N ' HD13 ' A' ' 41' ' ' LEU . 15.7 ptp -98.06 7.72 45.88 Favored 'General case' 0 N--CA 1.538 3.943 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -176.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.47 ' O ' HG23 ' A' ' 44' ' ' THR . 1.8 mp -120.63 -71.36 0.74 Allowed 'General case' 0 N--CA 1.514 2.726 0 CA-C-O 117.333 -1.318 . . . . 0.0 110.229 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.47 HG23 ' O ' ' A' ' 43' ' ' LEU . 24.9 p 128.41 161.75 0.0 OUTLIER Pre-proline 1 N--CA 1.579 6.014 0 C-N-CA 127.533 2.333 . . . . 0.0 109.071 -179.194 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -68.16 -33.36 25.07 Favored 'Trans proline' 0 C--N 1.392 2.82 0 C-N-CA 121.934 1.756 . . . . 0.0 108.929 176.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -64.56 -22.78 67.06 Favored 'General case' 0 N--CA 1.532 3.644 0 CA-C-O 118.278 -0.867 . . . . 0.0 110.561 176.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -71.26 -37.11 71.93 Favored 'General case' 0 N--CA 1.524 3.245 0 CA-C-O 117.745 -1.121 . . . . 0.0 109.658 178.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.9 ptt180 -81.85 -20.31 39.21 Favored 'General case' 1 N--CA 1.541 4.113 0 CA-C-N 119.589 1.086 . . . . 0.0 108.896 174.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -71.99 -26.3 62.18 Favored 'General case' 0 N--CA 1.523 3.217 0 N-CA-C 107.559 -1.275 . . . . 0.0 107.559 174.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.02 -35.48 16.35 Favored 'General case' 0 N--CA 1.504 2.268 0 CA-C-O 117.365 -1.302 . . . . 0.0 110.114 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.492 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 29.5 tp -74.27 -19.98 60.31 Favored 'General case' 1 N--CA 1.541 4.1 0 CA-C-N 120.646 1.566 . . . . 0.0 106.94 173.689 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.41 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -69.01 -70.24 1.21 Allowed Glycine 0 N--CA 1.497 2.742 0 C-N-CA 125.346 1.45 . . . . 0.0 110.254 177.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.4 t -72.93 -22.14 60.77 Favored 'General case' 0 N--CA 1.526 3.368 0 CA-C-O 117.628 -1.177 . . . . 0.0 113.019 -179.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 12.2 mtt180 -70.57 -51.02 31.27 Favored 'General case' 0 N--CA 1.531 3.604 0 CA-C-N 120.073 1.306 . . . . 0.0 108.035 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 20.3 t -65.66 -18.75 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.978 0 CA-C-O 117.875 -1.059 . . . . 0.0 109.39 175.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.4 mmt180 -75.71 -45.19 38.13 Favored 'General case' 0 N--CA 1.525 3.325 0 CA-C-O 117.376 -1.297 . . . . 0.0 111.807 178.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.424 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -73.6 -25.62 21.05 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.261 0 CA-C-N 121.26 1.846 . . . . 0.0 111.137 -178.371 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.517 HG11 HD11 ' B' ' 541' ' ' LEU . 0.0 OUTLIER -85.23 -47.16 17.08 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.108 0 CA-C-N 120.128 1.331 . . . . 0.0 107.536 -179.946 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -62.03 -24.28 66.97 Favored 'General case' 0 N--CA 1.534 3.741 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 177.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -92.73 -21.23 20.09 Favored 'General case' 0 N--CA 1.518 2.929 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.373 177.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 12.6 tp -74.75 -56.47 4.76 Favored 'General case' 0 N--CA 1.526 3.337 0 CA-C-N 120.091 1.314 . . . . 0.0 109.395 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 57.2 mt -51.15 -27.99 9.94 Favored 'General case' 1 N--CA 1.544 4.233 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -178.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.72 -57.45 2.98 Favored 'General case' 0 N--CA 1.524 3.261 0 N-CA-C 106.91 -1.515 . . . . 0.0 106.91 178.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 66.76 64.92 3.03 Favored Glycine 1 N--CA 1.517 4.094 0 C-N-CA 124.0 0.809 . . . . 0.0 112.698 178.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -115.17 -54.93 2.52 Favored 'General case' 0 N--CA 1.524 3.257 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 11.8 ptm -147.01 65.72 1.16 Allowed 'General case' 0 N--CA 1.528 3.463 0 N-CA-C 106.39 -1.707 . . . . 0.0 106.39 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.415 ' HA ' ' HB2' ' A' ' 71' ' ' LEU . 14.8 m -124.03 6.49 8.6 Favored 'General case' 0 N--CA 1.524 3.233 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -174.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -114.91 -70.09 0.82 Allowed 'General case' 0 N--CA 1.527 3.418 0 CA-C-N 119.61 1.096 . . . . 0.0 111.502 -179.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 8.6 mtt180 -91.44 -43.6 9.62 Favored 'General case' 0 N--CA 1.533 3.706 0 CA-C-N 118.591 0.632 . . . . 0.0 111.536 -177.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -77.07 -13.59 59.93 Favored 'General case' 0 N--CA 1.519 3.011 0 CA-C-O 118.321 -0.847 . . . . 0.0 112.925 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.547 HD23 HG21 ' A' ' 82' ' ' ILE . 24.4 tp -81.41 -50.46 9.43 Favored 'General case' 0 N--CA 1.523 3.198 0 CA-C-N 119.767 1.167 . . . . 0.0 111.522 -178.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.92 -31.79 1.39 Allowed 'General case' 1 N--CA 1.545 4.289 0 CA-C-N 119.57 1.077 . . . . 0.0 113.666 -179.171 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -77.86 -38.9 44.99 Favored 'General case' 0 N--CA 1.527 3.423 0 CA-C-O 119.232 -0.413 . . . . 0.0 111.217 -178.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -51.09 -59.19 4.44 Favored 'General case' 0 N--CA 1.529 3.521 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -177.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -119.08 -36.86 3.31 Favored 'General case' 0 N--CA 1.537 3.893 0 CA-C-O 118.455 -0.783 . . . . 0.0 112.075 -178.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 119.95 77.71 0.52 Allowed Glycine 1 N--CA 1.525 4.593 0 N-CA-C 110.76 -0.936 . . . . 0.0 110.76 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -146.0 100.83 3.45 Favored 'General case' 0 N--CA 1.524 3.242 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 178.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -40.18 170.48 0.01 OUTLIER Glycine 1 N--CA 1.54 5.624 0 C-N-CA 125.351 1.453 . . . . 0.0 116.094 -176.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -77.14 -20.81 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.04 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 178.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.94 -50.26 62.93 Favored 'General case' 0 N--CA 1.516 2.839 0 CA-C-O 117.944 -1.027 . . . . 0.0 109.302 177.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.09 -41.6 94.86 Favored 'General case' 1 N--CA 1.541 4.082 0 CA-C-O 117.875 -1.059 . . . . 0.0 113.459 -178.494 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.547 HG21 HD23 ' A' ' 71' ' ' LEU . 0.1 OUTLIER -69.68 -32.16 51.34 Favored 'Isoleucine or valine' 1 N--CA 1.549 4.508 0 CA-C-N 120.392 1.451 . . . . 0.0 110.96 -179.616 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 71.3 p -98.9 -2.15 38.33 Favored 'General case' 0 N--CA 1.518 2.947 0 CA-C-N 119.101 0.864 . . . . 0.0 111.443 177.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -88.22 -32.87 18.34 Favored 'General case' 0 N--CA 1.529 3.478 0 N-CA-C 105.519 -2.03 . . . . 0.0 105.519 173.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.64 -29.64 72.54 Favored Glycine 1 N--CA 1.519 4.196 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 176.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 62.2 p -69.4 -35.89 76.19 Favored 'General case' 0 N--CA 1.538 3.942 0 CA-C-N 118.544 1.172 . . . . 0.0 110.259 177.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -63.16 -26.35 68.77 Favored 'General case' 0 N--CA 1.538 3.965 0 C-N-CA 123.146 0.578 . . . . 0.0 110.721 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.3 m -68.61 -38.68 80.8 Favored 'General case' 0 N--CA 1.534 3.757 0 C-N-CA 123.584 0.754 . . . . 0.0 110.375 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 13.5 mt -57.47 -37.96 73.73 Favored 'General case' 0 N--CA 1.533 3.682 0 C-N-CA 124.05 0.94 . . . . 0.0 111.468 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -68.43 -27.98 66.67 Favored 'General case' 0 N--CA 1.531 3.618 0 CA-C-O 118.563 -0.732 . . . . 0.0 111.757 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -76.42 -46.31 27.66 Favored 'General case' 0 N--CA 1.518 2.963 0 CA-C-N 118.782 0.719 . . . . 0.0 110.992 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.25 160.04 52.76 Favored Pre-proline 0 N--CA 1.538 3.955 0 CA-C-O 118.29 -0.862 . . . . 0.0 112.571 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -81.85 175.46 9.29 Favored 'Trans proline' 0 C--N 1.377 2.072 0 C-N-CA 121.737 1.625 . . . . 0.0 111.123 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 t -95.69 -25.19 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.192 0 CA-C-O 117.945 -1.026 . . . . 0.0 111.242 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -59.79 -44.94 93.69 Favored 'General case' 0 N--CA 1.516 2.85 0 CA-C-N 120.071 1.305 . . . . 0.0 109.966 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.597 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.9 mp -98.49 -9.98 24.24 Favored 'General case' 0 N--CA 1.505 2.282 0 CA-C-O 118.061 -0.971 . . . . 0.0 112.268 178.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.1 -33.93 76.9 Favored 'General case' 1 N--CA 1.549 4.52 0 N-CA-C 102.881 -3.007 . . . . 0.0 102.881 168.014 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -53.23 -41.26 65.22 Favored 'General case' 0 N--CA 1.519 3.007 0 C-N-CA 124.501 1.121 . . . . 0.0 110.159 174.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.671 ' CH2' ' HB2' ' B' ' 529' ' ' ALA . 51.1 t90 -64.46 -35.29 80.45 Favored 'General case' 0 N--CA 1.532 3.665 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 176.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.37 -38.56 59.14 Favored 'General case' 0 N--CA 1.537 3.901 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 176.212 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -69.97 -36.41 75.2 Favored 'General case' 0 N--CA 1.539 3.994 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 175.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.428 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 0.8 OUTLIER -59.12 -24.4 62.94 Favored 'General case' 1 N--CA 1.549 4.522 0 C-N-CA 123.419 0.688 . . . . 0.0 109.984 175.124 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.529 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -119.7 3.66 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.39 0 C-N-CA 123.615 0.766 . . . . 0.0 112.356 -177.345 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -98.68 -59.36 1.75 Allowed 'General case' 0 N--CA 1.517 2.909 0 N-CA-C 104.346 -2.464 . . . . 0.0 104.346 175.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 1.6 tp . . . . . 0 N--CA 1.528 3.464 0 C-N-CA 124.687 1.195 . . . . 0.0 109.602 176.826 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 . . . . . 0 N--CA 1.52 3.025 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 519' ' ' TRP . . . . . 0.524 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 67.9 t-105 -42.92 -28.15 0.24 Allowed 'General case' 1 N--CA 1.549 4.489 0 CA-C-N 119.641 1.11 . . . . 0.0 113.65 179.865 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 520' ' ' LEU . . . . . 0.58 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.2 mm? -95.03 -29.1 14.78 Favored 'General case' 0 N--CA 1.53 3.532 0 CA-C-O 117.84 -1.076 . . . . 0.0 113.827 -172.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -27.23 68.26 Favored 'General case' 1 N--CA 1.545 4.297 0 N-CA-C 105.426 -2.064 . . . . 0.0 105.426 171.02 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . 0.561 ' O ' HD23 ' B' ' 526' ' ' LEU . 0.9 OUTLIER -78.08 -40.37 38.67 Favored 'General case' 0 N--CA 1.507 2.402 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 174.77 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 37.0 t -63.02 -22.43 30.65 Favored 'Isoleucine or valine' 1 N--CA 1.569 5.48 0 CA-C-N 120.283 1.401 . . . . 0.0 111.965 178.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -76.89 -49.83 14.75 Favored 'General case' 0 N--CA 1.536 3.84 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 179.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 6.7 tt -63.45 -31.4 72.55 Favored 'General case' 0 N--CA 1.538 3.939 0 O-C-N 123.29 0.369 . . . . 0.0 110.115 176.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 526' ' ' LEU . . . . . 0.561 HD23 ' O ' ' B' ' 522' ' ' PHE . 3.7 mm? -68.65 -33.78 74.58 Favored 'General case' 0 N--CA 1.523 3.223 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 177.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 527' ' ' LYS . . . . . 0.433 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 31.4 ttmt -67.66 -26.57 66.28 Favored 'General case' 0 N--CA 1.518 2.971 0 CA-C-O 118.161 -0.923 . . . . 0.0 110.853 177.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -69.58 -37.43 76.95 Favored 'General case' 0 N--CA 1.536 3.854 0 CA-C-N 119.462 1.028 . . . . 0.0 108.896 176.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 529' ' ' ALA . . . . . 0.671 ' HB2' ' CH2' ' A' ' 99' ' ' TRP . . . -90.98 -9.46 45.92 Favored 'General case' 0 CA--C 1.579 2.084 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.967 178.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 530' ' ' TYR . . . . . 0.496 ' CZ ' HG13 ' A' ' 23' ' ' VAL . 1.2 m-85 -82.32 -32.11 29.59 Favored 'General case' 0 N--CA 1.531 3.6 0 CA-C-N 120.312 1.414 . . . . 0.0 109.328 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -65.85 -43.0 89.76 Favored 'General case' 0 N--CA 1.534 3.766 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 177.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 65.6 m-80 -90.82 -90.15 0.16 Allowed 'General case' 0 N--CA 1.514 2.754 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 154.86 50.74 0.0 OUTLIER 'General case' 1 N--CA 1.559 4.977 0 C-N-CA 127.574 2.35 . . . . 0.0 107.984 177.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 534' ' ' LEU . . . . . 0.597 HD22 ' CD2' ' A' ' 96' ' ' LEU . 6.9 mt -106.35 7.83 31.42 Favored 'General case' 0 N--CA 1.528 3.449 0 C-N-CA 124.297 1.039 . . . . 0.0 111.021 -178.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 535' ' ' HIS . . . . . 0.616 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 29.3 p-80 -80.57 0.01 35.77 Favored 'General case' 0 N--CA 1.514 2.732 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 175.29 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 536' ' ' LEU . . . . . 0.418 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 35.5 mt -94.23 -50.95 0.26 Allowed Pre-proline 0 N--CA 1.505 2.283 0 CA-C-O 116.486 -1.721 . . . . 0.0 109.263 -175.497 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 537' ' ' PRO . . . . . 0.418 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 5.2 Cg_exo -66.33 -35.37 31.8 Favored 'Trans proline' 0 C--N 1.394 2.966 0 N-CA-C 106.775 -2.048 . . . . 0.0 106.775 171.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 538' ' ' LEU . . . . . 0.441 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 1.0 OUTLIER -62.24 -41.7 98.66 Favored 'General case' 0 N--CA 1.524 3.251 0 C-N-CA 124.267 1.027 . . . . 0.0 108.334 175.979 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 11.5 mt -72.14 -21.76 61.42 Favored 'General case' 1 N--CA 1.54 4.057 0 CA-C-O 118.358 -0.83 . . . . 0.0 111.057 178.573 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -77.72 -6.18 53.11 Favored 'General case' 0 N--CA 1.524 3.234 0 CA-C-N 118.976 0.807 . . . . 0.0 110.44 177.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 541' ' ' LEU . . . . . 0.634 HD13 ' N ' ' B' ' 542' ' ' MET . 0.0 OUTLIER -109.88 -47.77 3.3 Favored 'General case' 0 N--CA 1.512 2.63 0 C-N-CA 124.053 0.941 . . . . 0.0 109.445 -179.092 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 542' ' ' MET . . . . . 0.634 ' N ' HD13 ' B' ' 541' ' ' LEU . 12.7 ptp -89.76 -10.54 45.21 Favored 'General case' 0 N--CA 1.536 3.852 0 CA-C-O 117.407 -1.282 . . . . 0.0 113.542 -177.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 543' ' ' LEU . . . . . 0.575 ' O ' HG23 ' B' ' 544' ' ' THR . 1.2 tt -128.2 -112.58 0.27 Allowed 'General case' 0 N--CA 1.53 3.563 0 CA-C-O 116.558 -1.687 . . . . 0.0 112.752 -178.053 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 544' ' ' THR . . . . . 0.575 HG23 ' O ' ' B' ' 543' ' ' LEU . 2.2 p -174.56 161.66 2.64 Favored Pre-proline 1 N--CA 1.561 5.087 0 CA-C-N 121.505 1.957 . . . . 0.0 111.245 -178.483 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -74.81 -42.49 0.55 Allowed 'Trans proline' 0 C--N 1.388 2.621 0 C-N-CA 123.021 2.481 . . . . 0.0 109.733 176.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -58.28 -31.9 67.91 Favored 'General case' 1 N--CA 1.543 4.192 0 C-N-CA 123.707 0.803 . . . . 0.0 111.63 179.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -71.96 -34.09 68.7 Favored 'General case' 0 N--CA 1.526 3.35 0 CA-C-O 117.843 -1.075 . . . . 0.0 110.664 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 32.1 ptt180 -79.09 -23.51 44.08 Favored 'General case' 0 N--CA 1.533 3.692 0 CA-C-N 119.597 1.09 . . . . 0.0 110.133 177.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -65.16 -41.48 94.66 Favored 'General case' 0 N--CA 1.536 3.828 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 173.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -78.14 -19.95 53.01 Favored 'General case' 0 N--CA 1.508 2.448 0 CA-C-O 116.992 -1.48 . . . . 0.0 111.185 177.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 551' ' ' LEU . . . . . 0.587 HD22 ' CZ3' ' A' ' 19' ' ' TRP . 18.0 tp -76.44 -28.19 56.5 Favored 'General case' 0 N--CA 1.529 3.497 0 CA-C-N 121.368 1.895 . . . . 0.0 108.52 175.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -72.23 -56.3 6.38 Favored Glycine 0 N--CA 1.501 2.993 0 N-CA-C 108.491 -1.844 . . . . 0.0 108.491 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.4 m -66.19 -28.18 68.56 Favored 'General case' 0 N--CA 1.537 3.913 0 CA-C-O 118.432 -0.794 . . . . 0.0 112.05 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 26.0 mtm-85 -69.22 -45.81 68.94 Favored 'General case' 1 N--CA 1.541 4.102 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 176.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 555' ' ' VAL . . . . . 0.483 HG23 ' O ' ' B' ' 551' ' ' LEU . 34.9 t -70.73 -15.47 18.93 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.66 0 CA-C-O 118.11 -0.947 . . . . 0.0 109.353 177.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -79.82 -44.35 20.72 Favored 'General case' 0 N--CA 1.523 3.222 0 CA-C-O 117.395 -1.288 . . . . 0.0 111.212 178.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 557' ' ' ILE . . . . . 0.483 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -72.3 -25.07 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.213 0 CA-C-N 121.428 1.922 . . . . 0.0 110.107 179.88 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 558' ' ' VAL . . . . . 0.57 HG11 HD11 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -84.32 -52.76 12.24 Favored 'Isoleucine or valine' 1 N--CA 1.547 4.397 0 CA-C-N 120.736 1.607 . . . . 0.0 107.541 -179.888 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -58.07 -25.69 61.59 Favored 'General case' 0 N--CA 1.529 3.507 0 CA-C-O 118.874 -0.584 . . . . 0.0 110.696 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -93.7 -24.58 17.8 Favored 'General case' 0 N--CA 1.523 3.225 0 CA-C-O 118.132 -0.937 . . . . 0.0 111.043 178.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.92 -38.71 66.76 Favored 'General case' 1 N--CA 1.541 4.092 0 CA-C-N 119.728 1.149 . . . . 0.0 108.561 177.776 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 34.7 mt -57.35 -22.32 41.63 Favored 'General case' 0 N--CA 1.536 3.857 0 C-N-CA 123.665 0.786 . . . . 0.0 111.545 177.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 24.5 mmm180 -77.77 -51.39 10.6 Favored 'General case' 0 N--CA 1.527 3.406 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 66.97 50.57 45.85 Favored Glycine 1 N--CA 1.522 4.386 0 CA-C-O 119.086 -0.841 . . . . 0.0 112.494 178.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -124.76 -54.21 1.65 Allowed 'General case' 0 N--CA 1.527 3.405 0 CA-C-N 118.362 1.081 . . . . 0.0 108.431 178.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 30.6 mtt -148.98 64.32 1.04 Allowed 'General case' 0 N--CA 1.522 3.168 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 567' ' ' SER . . . . . 0.405 ' HA ' ' HB2' ' B' ' 571' ' ' LEU . 80.0 p -130.87 -4.83 4.02 Favored 'General case' 0 N--CA 1.52 3.063 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -175.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -93.49 -78.43 0.43 Allowed 'General case' 0 N--CA 1.528 3.468 0 CA-C-N 120.164 1.347 . . . . 0.0 111.255 -179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.79 -34.86 13.02 Favored 'General case' 1 N--CA 1.541 4.086 0 CA-C-N 119.146 0.885 . . . . 0.0 112.043 -178.492 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -76.96 -11.08 59.76 Favored 'General case' 0 N--CA 1.52 3.028 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -178.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 571' ' ' LEU . . . . . 0.81 HD23 HD11 ' B' ' 582' ' ' ILE . 16.8 tp -83.17 -43.65 15.93 Favored 'General case' 0 N--CA 1.532 3.639 0 CA-C-N 119.749 1.158 . . . . 0.0 112.649 -177.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -44.63 -29.21 0.7 Allowed 'General case' 1 N--CA 1.556 4.856 0 CA-C-N 120.249 1.386 . . . . 0.0 113.474 -178.591 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -66.4 -46.35 76.88 Favored 'General case' 0 N--CA 1.538 3.96 0 CA-C-N 118.698 0.681 . . . . 0.0 109.414 179.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -57.53 -51.13 70.71 Favored 'General case' 0 N--CA 1.525 3.293 0 C-N-CA 124.662 1.185 . . . . 0.0 112.413 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 61.0 mt -108.77 -61.83 1.55 Allowed 'General case' 0 N--CA 1.53 3.534 0 C-N-CA 122.988 0.515 . . . . 0.0 111.828 -177.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 122.81 20.82 2.76 Favored Glycine 1 N--CA 1.529 4.898 0 CA-C-O 118.199 -1.334 . . . . 0.0 112.619 -178.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -86.27 119.31 26.41 Favored 'General case' 0 N--CA 1.522 3.135 0 CA-C-N 119.577 1.689 . . . . 0.0 107.021 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -42.26 167.97 0.01 OUTLIER Glycine 1 N--CA 1.538 5.444 0 C-N-CA 124.616 1.103 . . . . 0.0 115.209 -177.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 579' ' ' ILE . . . . . 0.466 ' HA ' HG22 ' B' ' 582' ' ' ILE . 0.7 OUTLIER -80.27 -19.05 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.743 0 CA-C-O 117.632 -1.175 . . . . 0.0 108.568 178.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -69.22 -37.21 77.91 Favored 'General case' 0 N--CA 1.527 3.424 0 CA-C-N 119.879 1.218 . . . . 0.0 109.501 176.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.4 -36.65 38.81 Favored 'General case' 0 N--CA 1.536 3.831 0 CA-C-N 118.978 0.808 . . . . 0.0 111.776 178.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 582' ' ' ILE . . . . . 0.81 HD11 HD23 ' B' ' 571' ' ' LEU . 3.1 tt -67.07 -38.41 81.2 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.216 0 CA-C-O 118.975 -0.535 . . . . 0.0 112.223 -175.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 583' ' ' THR . . . . . 0.445 HG23 HG23 ' B' ' 582' ' ' ILE . 69.8 p -99.11 -27.34 13.87 Favored 'General case' 0 N--CA 1.508 2.443 0 CA-C-O 117.812 -1.089 . . . . 0.0 111.837 -178.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 13.3 ptt180 -73.66 -24.87 60.04 Favored 'General case' 0 N--CA 1.531 3.584 0 CA-C-N 120.061 1.301 . . . . 0.0 109.762 176.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -68.88 -36.11 81.08 Favored Glycine 1 N--CA 1.517 4.081 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 177.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 35.2 p -78.68 -29.49 45.62 Favored 'General case' 0 N--CA 1.531 3.607 0 CA-C-N 118.05 0.925 . . . . 0.0 111.278 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -64.01 -30.89 71.93 Favored 'General case' 1 N--CA 1.544 4.233 0 CA-C-N 119.346 0.976 . . . . 0.0 110.683 179.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 3.8 m -59.02 -35.98 74.2 Favored 'General case' 1 N--CA 1.541 4.108 0 C-N-CA 123.276 0.63 . . . . 0.0 110.411 178.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 43.7 mt -52.56 -45.84 66.57 Favored 'General case' 0 N--CA 1.532 3.641 0 C-N-CA 124.582 1.153 . . . . 0.0 111.398 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.52 -34.85 69.54 Favored 'General case' 1 N--CA 1.543 4.222 0 C-N-CA 123.268 0.627 . . . . 0.0 111.815 -179.744 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -81.2 -34.01 32.58 Favored 'General case' 0 N--CA 1.519 2.992 0 CA-C-O 118.878 -0.582 . . . . 0.0 111.859 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . 0.55 ' HB1' ' HD2' ' B' ' 593' ' ' PRO . . . -61.94 171.99 1.3 Allowed Pre-proline 1 N--CA 1.54 4.061 0 CA-C-O 118.218 -0.896 . . . . 0.0 111.707 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 593' ' ' PRO . . . . . 0.55 ' HD2' ' HB1' ' B' ' 592' ' ' ALA . 61.4 Cg_endo -83.17 140.73 10.0 Favored 'Trans proline' 0 C--N 1.377 2.033 0 C-N-CA 121.775 1.65 . . . . 0.0 109.207 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.3 t -79.64 -20.82 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.019 0 CA-C-O 117.928 -1.034 . . . . 0.0 111.027 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -63.54 -41.91 98.44 Favored 'General case' 0 N--CA 1.516 2.856 0 CA-C-N 120.101 1.319 . . . . 0.0 109.786 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 596' ' ' LEU . . . . . 0.529 ' CD2' HD22 ' A' ' 34' ' ' LEU . 7.4 mp -97.64 -13.79 21.33 Favored 'General case' 0 N--CA 1.511 2.592 0 C-N-CA 123.683 0.793 . . . . 0.0 111.349 177.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.16 -32.18 73.1 Favored 'General case' 1 N--CA 1.541 4.081 0 N-CA-C 103.595 -2.743 . . . . 0.0 103.595 168.496 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -54.16 -38.26 65.33 Favored 'General case' 0 N--CA 1.519 3.003 0 C-N-CA 124.532 1.133 . . . . 0.0 109.693 174.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 599' ' ' TRP . . . . . 0.631 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 49.7 t90 -63.25 -37.16 86.15 Favored 'General case' 0 N--CA 1.528 3.432 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 176.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -51.34 -39.03 56.16 Favored 'General case' 1 N--CA 1.543 4.204 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 175.869 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -69.64 -37.15 76.67 Favored 'General case' 1 N--CA 1.543 4.177 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 175.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 602' ' ' GLU . . . . . 0.43 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 2.9 mt-10 -59.35 -23.25 62.37 Favored 'General case' 1 N--CA 1.547 4.41 0 C-N-CA 123.424 0.69 . . . . 0.0 110.141 175.101 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 603' ' ' VAL . . . . . 0.543 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.2 OUTLIER -120.77 3.49 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.323 0 C-N-CA 123.566 0.747 . . . . 0.0 112.468 -177.399 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -111.68 -61.49 1.7 Allowed 'General case' 0 N--CA 1.509 2.508 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 176.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.535 3.792 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 177.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 . . . . . 0 N--CA 1.528 3.445 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.663 ' CE3' HD22 ' B' ' 551' ' ' LEU . 61.6 t-105 -54.65 -38.26 66.67 Favored 'General case' 0 N--CA 1.531 3.598 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 173.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.478 HD22 ' N ' ' A' ' 20' ' ' LEU . 2.8 mm? -80.03 -27.27 39.5 Favored 'General case' 0 N--CA 1.517 2.881 0 CA-C-O 117.263 -1.351 . . . . 0.0 112.279 -175.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 mmt180 -57.9 -31.54 66.86 Favored 'General case' 1 N--CA 1.549 4.508 0 N-CA-C 105.335 -2.098 . . . . 0.0 105.335 172.138 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.501 ' O ' ' HB2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -76.59 -41.98 44.23 Favored 'General case' 0 N--CA 1.503 2.2 0 CA-C-O 116.718 -1.61 . . . . 0.0 109.382 173.628 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 26.8 t -69.91 -25.04 27.24 Favored 'Isoleucine or valine' 1 N--CA 1.566 5.349 0 CA-C-N 120.566 1.53 . . . . 0.0 113.981 -174.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -76.29 -51.56 11.74 Favored 'General case' 0 N--CA 1.535 3.815 0 CA-C-N 120.392 1.451 . . . . 0.0 108.276 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.5 mp -74.68 -12.33 60.4 Favored 'General case' 0 N--CA 1.52 3.059 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 175.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.501 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -70.76 -36.92 73.33 Favored 'General case' 0 N--CA 1.521 3.097 0 N-CA-C 106.495 -1.669 . . . . 0.0 106.495 173.22 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.441 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 17.5 tttt -62.79 -22.15 66.4 Favored 'General case' 0 N--CA 1.525 3.276 0 CA-C-O 118.495 -0.764 . . . . 0.0 111.006 176.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -70.36 -45.53 65.89 Favored 'General case' 0 N--CA 1.538 3.927 0 N-CA-C 108.307 -0.998 . . . . 0.0 108.307 176.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.661 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -81.67 -9.37 59.67 Favored 'General case' 0 N--CA 1.508 2.455 0 CA-C-O 118.695 -0.669 . . . . 0.0 110.841 177.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.441 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -81.4 -36.15 29.88 Favored 'General case' 0 N--CA 1.533 3.707 0 CA-C-N 120.251 1.387 . . . . 0.0 109.066 179.987 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -59.99 -42.43 94.18 Favored 'General case' 0 N--CA 1.536 3.863 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 177.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 61.3 m-80 -90.15 -85.59 0.21 Allowed 'General case' 0 N--CA 1.513 2.717 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 176.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 147.94 50.96 0.0 OUTLIER 'General case' 1 N--CA 1.555 4.792 0 C-N-CA 128.042 2.537 . . . . 0.0 108.422 177.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.447 HD22 ' CD2' ' B' ' 596' ' ' LEU . 3.7 mt -111.63 12.38 21.2 Favored 'General case' 0 N--CA 1.526 3.339 0 C-N-CA 124.822 1.249 . . . . 0.0 110.021 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.549 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 51.6 p-80 -83.91 6.66 20.88 Favored 'General case' 0 N--CA 1.507 2.41 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 175.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.834 ' HA ' HD23 ' A' ' 39' ' ' LEU . 18.6 mt -96.37 -52.04 0.23 Allowed Pre-proline 0 N--CA 1.509 2.505 0 CA-C-O 116.794 -1.574 . . . . 0.0 108.828 -175.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.477 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 5.7 Cg_exo -66.02 -32.27 44.59 Favored 'Trans proline' 0 C--N 1.396 3.04 0 N-CA-C 106.489 -2.158 . . . . 0.0 106.489 170.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.549 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.9 OUTLIER -64.14 -39.22 93.57 Favored 'General case' 0 N--CA 1.517 2.9 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 175.679 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.834 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -71.35 -21.5 62.03 Favored 'General case' 1 N--CA 1.543 4.196 0 CA-C-N 119.324 0.966 . . . . 0.0 109.978 176.547 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -85.73 -3.19 58.83 Favored 'General case' 0 N--CA 1.527 3.42 0 CA-C-N 119.106 0.866 . . . . 0.0 111.131 177.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.569 HD13 ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -112.96 -36.09 5.23 Favored 'General case' 0 N--CA 1.53 3.548 0 CA-C-N 119.698 1.135 . . . . 0.0 111.558 -178.26 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.569 ' N ' HD13 ' A' ' 41' ' ' LEU . 3.9 ptt? -126.81 27.18 6.07 Favored 'General case' 1 N--CA 1.554 4.725 0 CA-C-N 120.249 1.386 . . . . 0.0 111.674 -179.687 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.3 tp -134.1 -61.89 0.77 Allowed 'General case' 0 N--CA 1.516 2.867 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.9 p 118.5 158.8 0.0 OUTLIER Pre-proline 1 N--CA 1.566 5.345 0 C-N-CA 128.348 2.659 . . . . 0.0 109.495 -178.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -69.26 -31.26 23.1 Favored 'Trans proline' 0 C--N 1.392 2.864 0 C-N-CA 122.163 1.908 . . . . 0.0 109.058 175.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -67.17 -21.07 65.81 Favored 'General case' 0 N--CA 1.528 3.441 0 CA-C-O 118.131 -0.937 . . . . 0.0 110.243 176.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -75.46 -29.74 59.74 Favored 'General case' 0 N--CA 1.521 3.086 0 CA-C-O 117.599 -1.191 . . . . 0.0 109.853 178.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -87.18 -22.03 25.54 Favored 'General case' 0 N--CA 1.539 3.995 0 CA-C-N 119.933 1.242 . . . . 0.0 109.026 174.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -71.58 -27.94 63.49 Favored 'General case' 0 N--CA 1.527 3.423 0 N-CA-C 106.433 -1.692 . . . . 0.0 106.433 172.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.48 -27.24 20.48 Favored 'General case' 0 N--CA 1.503 2.177 0 CA-C-O 117.432 -1.27 . . . . 0.0 110.405 178.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 27.6 tp -75.55 -21.74 57.64 Favored 'General case' 0 N--CA 1.537 3.915 0 N-CA-C 106.249 -1.76 . . . . 0.0 106.249 173.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.459 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -67.85 -72.42 0.8 Allowed Glycine 0 C--N 1.376 2.802 0 N-CA-C 109.198 -1.561 . . . . 0.0 109.198 176.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.7 m -66.08 -22.38 66.41 Favored 'General case' 0 N--CA 1.535 3.82 0 CA-C-O 117.468 -1.253 . . . . 0.0 113.204 -179.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.3 mtm180 -71.27 -52.66 17.71 Favored 'General case' 0 N--CA 1.538 3.933 0 CA-C-N 120.498 1.499 . . . . 0.0 107.464 177.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.3 t -67.63 -16.2 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.903 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.84 176.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -76.09 -46.66 27.85 Favored 'General case' 0 N--CA 1.531 3.59 0 CA-C-N 120.052 1.296 . . . . 0.0 111.172 178.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.589 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -72.2 -23.04 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.376 0 CA-C-N 120.563 1.529 . . . . 0.0 111.573 -178.922 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.452 HG11 HD11 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -88.79 -53.31 9.75 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.765 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 -179.903 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -57.39 -22.61 44.03 Favored 'General case' 0 N--CA 1.531 3.609 0 CA-C-O 118.454 -0.784 . . . . 0.0 110.755 178.078 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -95.33 -29.01 14.69 Favored 'General case' 0 N--CA 1.522 3.132 0 CA-C-O 118.148 -0.929 . . . . 0.0 110.365 177.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 45.6 tp -67.6 -56.33 9.83 Favored 'General case' 1 N--CA 1.539 4.007 0 CA-C-N 119.598 1.09 . . . . 0.0 110.073 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 54.9 mt -54.02 -24.64 17.68 Favored 'General case' 1 N--CA 1.541 4.09 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 -179.26 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -79.22 -48.83 13.51 Favored 'General case' 0 N--CA 1.53 3.531 0 CA-C-N 118.669 0.668 . . . . 0.0 110.045 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 74.61 81.14 0.48 Allowed Glycine 1 N--CA 1.521 4.344 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 179.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -158.57 -57.17 0.07 Allowed 'General case' 0 N--CA 1.53 3.528 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 44.1 mtt -138.61 76.56 1.58 Allowed 'General case' 0 N--CA 1.522 3.156 0 N-CA-C 104.344 -2.465 . . . . 0.0 104.344 177.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.5 m -128.5 -33.17 2.12 Favored 'General case' 0 N--CA 1.525 3.324 0 N-CA-C 114.104 1.15 . . . . 0.0 114.104 -172.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -105.91 -65.65 1.05 Allowed 'General case' 0 N--CA 1.526 3.343 0 CA-C-N 118.727 0.694 . . . . 0.0 111.933 -176.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 10.7 mtt180 -97.24 -45.59 6.45 Favored 'General case' 0 N--CA 1.526 3.361 0 CA-C-N 118.485 0.584 . . . . 0.0 111.419 -177.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -71.81 -14.87 62.1 Favored 'General case' 0 N--CA 1.521 3.083 0 CA-C-O 118.439 -0.791 . . . . 0.0 112.297 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.605 HD23 HG21 ' A' ' 82' ' ' ILE . 24.1 tp -79.14 -54.9 5.53 Favored 'General case' 0 N--CA 1.525 3.298 0 CA-C-N 119.484 1.038 . . . . 0.0 111.62 -178.666 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -41.77 -36.55 1.03 Allowed 'General case' 1 N--CA 1.549 4.511 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -178.174 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 14.1 t30 -74.12 -39.97 62.99 Favored 'General case' 0 N--CA 1.532 3.642 0 CA-C-N 118.112 0.415 . . . . 0.0 111.035 -178.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -46.3 -54.38 9.04 Favored 'General case' 0 N--CA 1.537 3.886 0 C-N-CA 124.824 1.25 . . . . 0.0 113.409 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -133.23 -39.88 0.92 Allowed 'General case' 0 N--CA 1.533 3.683 0 CA-C-O 118.63 -0.7 . . . . 0.0 111.835 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 117.77 86.79 1.17 Allowed Glycine 1 N--CA 1.523 4.486 0 N-CA-C 110.51 -1.036 . . . . 0.0 110.51 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -115.92 -47.1 2.8 Favored 'General case' 0 N--CA 1.522 3.152 0 C-N-CA 123.613 0.765 . . . . 0.0 109.397 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.99 161.67 22.84 Favored Glycine 1 N--CA 1.525 4.629 0 N-CA-C 109.771 -1.331 . . . . 0.0 109.771 -179.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -83.11 -14.98 11.76 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.858 0 CA-C-N 119.439 1.619 . . . . 0.0 108.133 177.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.94 -30.72 67.11 Favored 'General case' 0 N--CA 1.518 2.949 0 CA-C-O 117.463 -1.256 . . . . 0.0 111.239 177.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.9 p -93.4 -36.38 12.52 Favored 'General case' 1 N--CA 1.545 4.316 0 CA-C-N 120.45 1.477 . . . . 0.0 112.133 -179.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.605 HG21 HD23 ' A' ' 71' ' ' LEU . 1.0 OUTLIER -73.93 -25.38 20.24 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.056 0 CA-C-O 118.101 -0.952 . . . . 0.0 111.898 -179.122 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.5 p -103.95 -29.67 10.79 Favored 'General case' 0 N--CA 1.513 2.697 0 CA-C-O 117.954 -1.022 . . . . 0.0 110.554 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.0 ptt180 -73.28 -25.59 60.74 Favored 'General case' 1 N--CA 1.545 4.287 0 CA-C-N 120.042 1.292 . . . . 0.0 108.154 173.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -64.71 -27.58 72.18 Favored Glycine 1 N--CA 1.524 4.543 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 174.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 20.1 m -70.33 -35.47 73.63 Favored 'General case' 0 N--CA 1.535 3.795 0 CA-C-N 117.973 0.886 . . . . 0.0 108.753 176.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -60.92 -30.69 70.35 Favored 'General case' 1 N--CA 1.542 4.143 0 C-N-CA 123.457 0.703 . . . . 0.0 110.096 177.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.481 ' HB3' ' HA ' ' B' ' 541' ' ' LEU . 1.6 m -64.76 -38.14 89.98 Favored 'General case' 0 N--CA 1.533 3.711 0 C-N-CA 123.509 0.723 . . . . 0.0 110.716 179.33 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.8 mt -53.39 -37.91 62.9 Favored 'General case' 0 N--CA 1.538 3.935 0 C-N-CA 123.734 0.813 . . . . 0.0 111.135 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -68.27 -36.3 79.19 Favored 'General case' 0 N--CA 1.534 3.755 0 C-N-CA 123.096 0.558 . . . . 0.0 111.174 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.67 -36.77 81.32 Favored 'General case' 0 N--CA 1.525 3.276 0 C-N-CA 123.216 0.607 . . . . 0.0 111.905 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.35 158.41 88.06 Favored Pre-proline 0 N--CA 1.526 3.363 0 CA-C-O 118.535 -0.745 . . . . 0.0 111.851 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -86.46 -178.54 2.75 Favored 'Trans proline' 0 CA--C 1.563 1.972 0 C-N-CA 122.331 2.021 . . . . 0.0 111.189 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.446 ' HA ' ' HB3' ' A' ' 97' ' ' ARG . 3.1 t -97.04 -28.76 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.101 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.773 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -59.78 -45.22 92.94 Favored 'General case' 0 N--CA 1.514 2.762 0 CA-C-N 119.666 1.121 . . . . 0.0 110.009 -178.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.587 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.6 mp -100.02 -11.63 20.42 Favored 'General case' 0 N--CA 1.511 2.591 0 CA-C-O 118.307 -0.854 . . . . 0.0 112.706 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.446 ' HB3' ' HA ' ' A' ' 94' ' ' VAL . 0.2 OUTLIER -67.56 -30.84 70.58 Favored 'General case' 1 N--CA 1.544 4.269 0 N-CA-C 102.368 -3.197 . . . . 0.0 102.368 167.849 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -56.67 -38.54 72.37 Favored 'General case' 0 N--CA 1.515 2.823 0 C-N-CA 124.134 0.973 . . . . 0.0 110.277 175.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.646 ' CH2' ' HB2' ' B' ' 529' ' ' ALA . 53.5 t90 -66.45 -34.22 77.45 Favored 'General case' 0 N--CA 1.538 3.963 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 176.282 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.52 -37.15 62.53 Favored 'General case' 0 N--CA 1.535 3.775 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 176.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -68.06 -38.94 83.0 Favored 'General case' 1 N--CA 1.541 4.089 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 175.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.51 -23.8 58.99 Favored 'General case' 1 N--CA 1.544 4.247 0 C-N-CA 123.459 0.704 . . . . 0.0 110.643 175.734 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.504 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -120.88 2.73 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.493 0 C-N-CA 123.375 0.67 . . . . 0.0 112.617 -177.143 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -109.57 -56.95 2.24 Favored 'General case' 0 N--CA 1.518 2.935 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 177.117 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.3 tp . . . . . 0 N--CA 1.531 3.591 0 C-N-CA 125.149 1.38 . . . . 0.0 111.491 179.325 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 . . . . . 0 N--CA 1.52 3.047 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 519' ' ' TRP . . . . . 0.727 ' CE2' HD22 ' A' ' 39' ' ' LEU . 63.1 t-105 -42.54 -26.43 0.12 Allowed 'General case' 1 N--CA 1.552 4.64 0 C-N-CA 124.558 1.143 . . . . 0.0 113.753 178.523 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 520' ' ' LEU . . . . . 0.54 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.4 mm? -93.88 -34.29 13.18 Favored 'General case' 0 N--CA 1.526 3.369 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -172.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.58 -25.02 68.04 Favored 'General case' 0 N--CA 1.534 3.755 0 N-CA-C 106.291 -1.744 . . . . 0.0 106.291 172.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . 0.459 ' CE2' ' HA2' ' A' ' 52' ' ' GLY . 2.2 m-85 -78.74 -37.33 41.56 Favored 'General case' 0 N--CA 1.513 2.716 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 173.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 523' ' ' VAL . . . . . 0.47 HG23 ' O ' ' B' ' 519' ' ' TRP . 25.4 t -66.4 -23.35 31.46 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.232 0 CA-C-N 120.169 1.349 . . . . 0.0 111.646 179.103 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -75.19 -49.38 19.61 Favored 'General case' 0 N--CA 1.536 3.849 0 CA-C-N 120.063 1.301 . . . . 0.0 108.345 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 1.8 tp -65.5 -29.31 69.94 Favored 'General case' 1 N--CA 1.54 4.05 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 176.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 526' ' ' LEU . . . . . 0.443 HD23 ' O ' ' B' ' 522' ' ' PHE . 0.9 OUTLIER -68.41 -33.05 73.54 Favored 'General case' 0 N--CA 1.522 3.171 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 177.128 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 527' ' ' LYS . . . . . 0.447 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 31.0 ttmt -65.89 -25.52 67.21 Favored 'General case' 0 N--CA 1.519 3.01 0 CA-C-O 118.387 -0.816 . . . . 0.0 111.144 177.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -69.22 -39.94 78.28 Favored 'General case' 0 N--CA 1.536 3.829 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 176.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 529' ' ' ALA . . . . . 0.646 ' HB2' ' CH2' ' A' ' 99' ' ' TRP . . . -88.63 -9.5 51.93 Favored 'General case' 0 N--CA 1.506 2.367 0 CA-C-O 118.417 -0.802 . . . . 0.0 111.295 178.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 530' ' ' TYR . . . . . 0.447 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.9 OUTLIER -81.61 -32.9 31.79 Favored 'General case' 0 N--CA 1.532 3.625 0 CA-C-N 120.439 1.472 . . . . 0.0 108.733 -179.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -61.6 -44.43 97.02 Favored 'General case' 0 N--CA 1.538 3.944 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 176.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 61.4 m-80 -91.56 -86.45 0.22 Allowed 'General case' 0 N--CA 1.517 2.878 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 177.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 150.72 52.41 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.855 0 C-N-CA 128.027 2.531 . . . . 0.0 107.818 178.179 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 534' ' ' LEU . . . . . 0.587 HD22 ' CD2' ' A' ' 96' ' ' LEU . 4.8 mt -111.08 10.65 22.02 Favored 'General case' 0 N--CA 1.528 3.429 0 C-N-CA 124.558 1.143 . . . . 0.0 110.831 -178.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 535' ' ' HIS . . . . . 0.611 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 39.9 p-80 -82.43 -0.32 45.67 Favored 'General case' 0 N--CA 1.517 2.888 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 174.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 536' ' ' LEU . . . . . 0.469 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 34.6 mt -93.96 -51.63 0.26 Allowed Pre-proline 0 N--CA 1.504 2.266 0 CA-C-O 116.728 -1.606 . . . . 0.0 108.952 -175.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 537' ' ' PRO . . . . . 0.469 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 6.3 Cg_exo -66.19 -33.86 38.43 Favored 'Trans proline' 0 C--N 1.394 2.941 0 C-N-CA 122.158 1.906 . . . . 0.0 107.235 171.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 538' ' ' LEU . . . . . 0.438 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 0.6 OUTLIER -64.07 -45.69 87.6 Favored 'General case' 0 N--CA 1.521 3.108 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 176.292 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . 0.262 2.2 pp -81.89 -2.86 52.67 Favored 'General case' 1 N--CA 1.542 4.161 0 CA-C-N 118.824 0.738 . . . . 0.0 111.9 178.392 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -81.51 -12.01 58.99 Favored 'General case' 0 N--CA 1.518 2.946 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 172.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 541' ' ' LEU . . . . . 0.629 HD13 ' N ' ' B' ' 542' ' ' MET . 0.0 OUTLIER -108.3 -45.05 3.99 Favored 'General case' 0 N--CA 1.512 2.635 0 C-N-CA 124.476 1.11 . . . . 0.0 109.639 -178.838 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 542' ' ' MET . . . . . 0.629 ' N ' HD13 ' B' ' 541' ' ' LEU . 12.2 ptp -84.51 -28.28 26.81 Favored 'General case' 1 N--CA 1.546 4.326 0 CA-C-O 117.61 -1.186 . . . . 0.0 111.988 -178.939 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 5.7 mp -107.35 -99.14 0.36 Allowed 'General case' 0 N--CA 1.527 3.392 0 CA-C-O 117.111 -1.423 . . . . 0.0 112.759 -176.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 544' ' ' THR . . . . . 0.428 HG23 ' HG3' ' B' ' 547' ' ' GLU . 3.1 t 153.77 147.48 0.0 OUTLIER Pre-proline 1 N--CA 1.574 5.774 0 C-N-CA 126.224 1.809 . . . . 0.0 109.023 -177.855 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -58.67 -34.33 98.84 Favored 'Trans proline' 0 N--CA 1.524 3.301 0 C-N-CA 123.32 2.68 . . . . 0.0 113.502 -179.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -57.79 -30.02 65.35 Favored 'General case' 1 N--CA 1.542 4.135 0 CA-C-N 118.508 0.594 . . . . 0.0 111.479 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 547' ' ' GLU . . . . . 0.428 ' HG3' HG23 ' B' ' 544' ' ' THR . 39.4 mt-10 -67.86 -38.5 83.19 Favored 'General case' 0 N--CA 1.526 3.33 0 CA-C-O 118.307 -0.854 . . . . 0.0 110.6 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 548' ' ' ARG . . . . . 0.439 ' HB2' ' HB2' ' A' ' 19' ' ' TRP . 4.2 ptt180 -76.44 -20.85 56.64 Favored 'General case' 0 N--CA 1.529 3.492 0 CA-C-O 118.135 -0.936 . . . . 0.0 111.289 178.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -65.57 -49.37 69.08 Favored 'General case' 0 N--CA 1.537 3.908 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 174.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -77.58 -13.88 59.8 Favored 'General case' 0 N--CA 1.511 2.598 0 CA-C-O 117.073 -1.441 . . . . 0.0 111.817 178.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 551' ' ' LEU . . . . . 0.663 HD22 ' CE3' ' A' ' 19' ' ' TRP . 11.7 tp -79.13 -30.39 43.66 Favored 'General case' 0 N--CA 1.53 3.529 0 CA-C-N 120.817 1.644 . . . . 0.0 107.73 175.028 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -71.15 -56.9 6.56 Favored Glycine 0 N--CA 1.498 2.783 0 N-CA-C 108.949 -1.661 . . . . 0.0 108.949 178.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 3.1 m -64.43 -31.29 72.44 Favored 'General case' 1 N--CA 1.541 4.092 0 CA-C-O 118.337 -0.839 . . . . 0.0 112.059 -179.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -65.5 -50.6 64.69 Favored 'General case' 1 N--CA 1.546 4.369 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 176.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 555' ' ' VAL . . . . . 0.44 HG23 ' O ' ' B' ' 551' ' ' LEU . 32.0 t -66.05 -15.98 19.87 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.849 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.03 177.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 18.6 mmt180 -79.82 -44.32 20.79 Favored 'General case' 0 N--CA 1.526 3.363 0 CA-C-O 117.327 -1.321 . . . . 0.0 111.319 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 557' ' ' ILE . . . . . 0.47 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -72.81 -24.58 21.41 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.186 0 CA-C-N 121.425 1.921 . . . . 0.0 110.406 -179.757 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 558' ' ' VAL . . . . . 0.47 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.0 OUTLIER -86.22 -53.47 10.3 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.073 0 CA-C-N 119.997 1.271 . . . . 0.0 107.635 -179.739 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -61.36 -22.04 64.58 Favored 'General case' 0 N--CA 1.532 3.636 0 CA-C-O 118.497 -0.763 . . . . 0.0 110.971 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -93.81 -24.78 17.65 Favored 'General case' 0 N--CA 1.523 3.183 0 CA-C-O 118.081 -0.961 . . . . 0.0 110.07 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 14.3 tp -71.01 -53.77 13.6 Favored 'General case' 0 N--CA 1.535 3.813 0 CA-C-N 119.708 1.14 . . . . 0.0 108.255 178.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 36.5 mt -48.62 -30.1 5.04 Favored 'General case' 1 N--CA 1.543 4.218 0 C-N-CA 124.157 0.983 . . . . 0.0 112.583 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 20.5 mmm180 -79.68 -49.89 11.44 Favored 'General case' 0 N--CA 1.53 3.546 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 72.11 89.19 0.13 Allowed Glycine 1 N--CA 1.52 4.274 0 CA-C-O 119.346 -0.697 . . . . 0.0 111.822 178.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -155.87 -55.82 0.09 Allowed 'General case' 0 N--CA 1.528 3.428 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 2.1 ptt? -147.84 66.34 1.11 Allowed 'General case' 0 N--CA 1.527 3.388 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 178.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 7.6 t -125.55 -15.41 6.09 Favored 'General case' 0 N--CA 1.519 3.001 0 CA-C-O 117.484 -1.246 . . . . 0.0 114.05 -176.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -98.81 -55.43 2.72 Favored 'General case' 0 N--CA 1.533 3.703 0 CA-C-N 120.803 1.638 . . . . 0.0 111.582 -178.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -107.49 -38.48 5.91 Favored 'General case' 0 N--CA 1.532 3.641 0 C-N-CA 123.433 0.693 . . . . 0.0 111.728 -177.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -81.52 -8.71 59.76 Favored 'General case' 0 N--CA 1.518 2.966 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -176.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 571' ' ' LEU . . . . . 0.93 HD23 HD11 ' B' ' 582' ' ' ILE . 26.1 tp -85.85 -48.6 8.61 Favored 'General case' 0 N--CA 1.535 3.783 0 CA-C-N 120.306 1.412 . . . . 0.0 112.973 -177.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -45.57 -29.54 1.22 Allowed 'General case' 1 N--CA 1.555 4.784 0 CA-C-N 120.23 1.377 . . . . 0.0 113.866 -177.517 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -67.09 -41.53 86.15 Favored 'General case' 1 N--CA 1.54 4.034 0 CA-C-N 118.819 0.736 . . . . 0.0 110.26 -179.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -48.41 -62.22 1.61 Allowed 'General case' 0 N--CA 1.529 3.5 0 C-N-CA 125.167 1.387 . . . . 0.0 113.157 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 575' ' ' LEU . . . . . 0.544 HD11 ' HB2' ' B' ' 577' ' ' ALA . 3.4 pp -119.09 -39.76 2.89 Favored 'General case' 0 N--CA 1.532 3.666 0 CA-C-N 118.736 0.698 . . . . 0.0 111.705 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 120.62 37.24 0.74 Allowed Glycine 1 N--CA 1.527 4.729 0 CA-C-O 118.572 -1.127 . . . . 0.0 111.953 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 577' ' ' ALA . . . . . 0.544 ' HB2' HD11 ' B' ' 575' ' ' LEU . . . -89.23 108.52 19.66 Favored 'General case' 0 N--CA 1.521 3.109 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 177.661 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -43.13 170.33 0.01 OUTLIER Glycine 1 N--CA 1.53 4.903 0 C-N-CA 125.095 1.331 . . . . 0.0 115.685 -177.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 579' ' ' ILE . . . . . 0.531 ' HA ' HG22 ' B' ' 582' ' ' ILE . 0.5 OUTLIER -84.14 -15.57 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.642 0 CA-C-O 117.549 -1.215 . . . . 0.0 108.724 177.464 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -70.09 -38.65 75.72 Favored 'General case' 0 N--CA 1.523 3.217 0 CA-C-N 120.213 1.37 . . . . 0.0 108.951 176.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -79.66 -36.3 37.93 Favored 'General case' 0 N--CA 1.539 3.996 0 CA-C-N 118.609 0.641 . . . . 0.0 112.247 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 582' ' ' ILE . . . . . 0.93 HD11 HD23 ' B' ' 571' ' ' LEU . 1.6 tt -71.01 -37.67 68.69 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.212 0 C-N-CA 122.9 0.48 . . . . 0.0 111.601 -175.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 65.0 p -98.25 -23.56 15.61 Favored 'General case' 0 N--CA 1.512 2.633 0 CA-C-O 117.968 -1.015 . . . . 0.0 111.746 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 13.8 ptt180 -79.7 -22.06 43.85 Favored 'General case' 0 N--CA 1.531 3.622 0 CA-C-N 120.164 1.347 . . . . 0.0 108.355 173.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -65.36 -33.63 87.14 Favored Glycine 1 N--CA 1.519 4.214 0 N-CA-C 108.975 -1.65 . . . . 0.0 108.975 175.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 83.0 p -64.1 -32.79 74.48 Favored 'General case' 0 N--CA 1.537 3.9 0 CA-C-N 118.224 1.012 . . . . 0.0 109.97 176.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -62.1 -31.53 71.99 Favored 'General case' 0 N--CA 1.538 3.962 0 C-N-CA 123.501 0.72 . . . . 0.0 110.826 178.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 50.3 m -63.17 -43.19 98.95 Favored 'General case' 1 N--CA 1.541 4.096 0 C-N-CA 123.379 0.672 . . . . 0.0 110.318 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 36.1 mt -54.86 -44.74 74.27 Favored 'General case' 0 N--CA 1.527 3.38 0 C-N-CA 124.015 0.926 . . . . 0.0 110.96 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -29.08 66.67 Favored 'General case' 0 N--CA 1.537 3.876 0 CA-C-O 118.76 -0.638 . . . . 0.0 111.135 178.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -64.84 -42.9 94.54 Favored 'General case' 0 N--CA 1.528 3.47 0 CA-C-N 118.737 0.699 . . . . 0.0 110.957 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -65.44 162.7 39.41 Favored Pre-proline 0 N--CA 1.534 3.767 0 CA-C-O 118.426 -0.797 . . . . 0.0 112.165 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 593' ' ' PRO . . . . . 0.43 ' O ' ' HB2' ' B' ' 597' ' ' ARG . 37.9 Cg_endo -79.23 179.77 6.13 Favored 'Trans proline' 0 C--N 1.38 2.185 0 C-N-CA 122.02 1.813 . . . . 0.0 111.081 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -94.27 -26.36 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.306 0 CA-C-O 118.01 -0.995 . . . . 0.0 111.495 -178.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -61.39 -45.1 95.77 Favored 'General case' 0 N--CA 1.517 2.898 0 CA-C-N 119.837 1.198 . . . . 0.0 109.47 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 596' ' ' LEU . . . . . 0.456 HD12 ' N ' ' B' ' 596' ' ' LEU . 6.9 mp -97.06 -9.09 28.78 Favored 'General case' 0 N--CA 1.508 2.466 0 C-N-CA 123.233 0.613 . . . . 0.0 111.843 179.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' B' ' 593' ' ' PRO . 0.0 OUTLIER -64.68 -39.18 93.22 Favored 'General case' 1 N--CA 1.548 4.464 0 N-CA-C 102.516 -3.142 . . . . 0.0 102.516 167.456 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -49.84 -36.77 27.96 Favored 'General case' 0 N--CA 1.519 2.985 0 C-N-CA 124.311 1.044 . . . . 0.0 111.676 174.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 599' ' ' TRP . . . . . 0.661 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 39.0 t90 -64.5 -40.67 96.09 Favored 'General case' 0 N--CA 1.528 3.468 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 178.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 10.6 mp -54.17 -32.83 56.55 Favored 'General case' 1 N--CA 1.544 4.228 0 CA-C-N 118.92 0.782 . . . . 0.0 109.226 176.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -74.96 -34.56 62.05 Favored 'General case' 0 N--CA 1.528 3.468 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 176.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 602' ' ' GLU . . . . . 0.452 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.5 OUTLIER -63.99 -22.77 67.07 Favored 'General case' 1 N--CA 1.549 4.501 0 C-N-CA 124.903 1.281 . . . . 0.0 111.405 175.969 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' B' B ' 603' ' ' VAL . . . . . 0.546 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.0 OUTLIER -108.8 -20.77 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.611 0 CA-C-O 118.01 -0.995 . . . . 0.0 112.231 -175.067 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 7.2 mp -88.78 -58.68 2.46 Favored 'General case' 0 N--CA 1.523 3.193 0 N-CA-C 105.499 -2.038 . . . . 0.0 105.499 175.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.528 3.457 0 C-N-CA 123.636 0.774 . . . . 0.0 110.658 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 . . . . . 0 N--CA 1.521 3.092 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.811 ' CE3' HD22 ' B' ' 551' ' ' LEU . 74.4 t-105 -50.62 -39.5 50.37 Favored 'General case' 0 N--CA 1.538 3.945 0 CA-C-N 119.572 1.078 . . . . 0.0 110.969 178.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.441 HD22 ' N ' ' A' ' 20' ' ' LEU . 2.2 mm? -81.18 -27.7 35.28 Favored 'General case' 0 N--CA 1.524 3.271 0 CA-C-O 117.792 -1.099 . . . . 0.0 112.387 -174.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.31 -28.12 66.51 Favored 'General case' 1 N--CA 1.54 4.072 0 N-CA-C 106.306 -1.738 . . . . 0.0 106.306 172.338 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.577 ' CG ' HD21 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -82.52 -37.46 25.21 Favored 'General case' 0 N--CA 1.503 2.215 0 CA-C-O 116.755 -1.593 . . . . 0.0 108.822 173.778 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.9 t -67.06 -25.37 34.01 Favored 'Isoleucine or valine' 1 N--CA 1.563 5.215 0 CA-C-N 121.283 1.856 . . . . 0.0 112.444 -176.255 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -78.03 -51.46 10.29 Favored 'General case' 0 N--CA 1.534 3.736 0 CA-C-N 119.901 1.228 . . . . 0.0 107.916 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.94 -19.83 65.79 Favored 'General case' 0 N--CA 1.537 3.889 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 176.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.36 -40.4 67.35 Favored 'General case' 0 N--CA 1.515 2.797 0 CA-C-O 117.873 -1.06 . . . . 0.0 108.153 177.465 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.444 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 20.2 mttt -59.77 -20.96 59.9 Favored 'General case' 0 N--CA 1.531 3.603 0 CA-C-O 118.3 -0.857 . . . . 0.0 111.42 176.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -73.6 -43.63 59.2 Favored 'General case' 0 N--CA 1.531 3.603 0 CA-C-N 119.273 0.942 . . . . 0.0 108.684 176.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.649 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -89.5 -1.53 58.07 Favored 'General case' 0 N--CA 1.511 2.6 0 CA-C-O 118.818 -0.61 . . . . 0.0 110.843 177.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.444 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -89.03 -34.64 16.73 Favored 'General case' 0 N--CA 1.533 3.683 0 CA-C-N 120.003 1.274 . . . . 0.0 108.594 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -65.04 -40.58 94.98 Favored 'General case' 0 N--CA 1.532 3.635 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 176.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 -89.99 -89.46 0.16 Allowed 'General case' 0 N--CA 1.513 2.709 0 N-CA-C 106.766 -1.568 . . . . 0.0 106.766 176.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 p30 153.11 44.64 0.0 OUTLIER 'General case' 1 N--CA 1.561 5.103 0 C-N-CA 127.504 2.322 . . . . 0.0 109.034 177.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.61 HD22 ' CD2' ' B' ' 596' ' ' LEU . 9.1 mt -103.08 15.14 30.16 Favored 'General case' 0 N--CA 1.524 3.268 0 C-N-CA 123.966 0.907 . . . . 0.0 110.901 -179.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.597 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 54.5 p-80 -84.91 5.5 28.71 Favored 'General case' 0 CA--C 1.594 2.648 0 C-N-CA 123.38 0.672 . . . . 0.0 109.22 174.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.519 HD23 HD12 ' A' ' 39' ' ' LEU . 18.9 mt -95.53 -49.58 0.25 Allowed Pre-proline 0 N--CA 1.508 2.466 0 C-N-CA 125.792 1.637 . . . . 0.0 109.031 -175.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.456 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 4.4 Cg_exo -67.21 -37.32 18.64 Favored 'Trans proline' 0 C--N 1.388 2.64 0 N-CA-C 106.053 -2.326 . . . . 0.0 106.053 169.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.597 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 1.9 tm? -60.64 -36.75 79.42 Favored 'General case' 0 N--CA 1.53 3.565 0 C-N-CA 124.058 0.943 . . . . 0.0 108.839 175.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.742 HD11 ' CE2' ' B' ' 519' ' ' TRP . 0.5 OUTLIER -59.18 -49.43 77.9 Favored 'General case' 1 N--CA 1.553 4.71 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 176.134 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.5 t30 -59.28 -15.59 16.63 Favored 'General case' 0 N--CA 1.536 3.832 0 CA-C-O 118.113 -0.946 . . . . 0.0 113.52 -178.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.457 HD23 ' HA ' ' A' ' 38' ' ' LEU . 0.7 OUTLIER -103.72 -46.77 4.42 Favored 'General case' 0 N--CA 1.522 3.133 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 -177.178 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.3 ptt? -122.04 14.87 10.71 Favored 'General case' 1 N--CA 1.554 4.748 0 CA-C-N 120.014 1.279 . . . . 0.0 113.016 -174.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.7 mp -123.06 -48.97 1.97 Allowed 'General case' 0 N--CA 1.494 1.725 0 CA-C-O 117.702 -1.142 . . . . 0.0 110.432 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 77.5 p 107.27 158.94 0.0 OUTLIER Pre-proline 1 N--CA 1.566 5.333 0 C-N-CA 127.642 2.377 . . . . 0.0 110.919 -179.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo -71.86 -32.14 11.8 Favored 'Trans proline' 0 C--N 1.391 2.789 0 C-N-CA 122.145 1.897 . . . . 0.0 107.371 172.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -69.03 -14.79 63.24 Favored 'General case' 0 N--CA 1.521 3.114 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.695 176.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -77.94 -40.74 38.54 Favored 'General case' 0 N--CA 1.514 2.744 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 177.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.9 ptt-85 -83.36 -11.5 57.56 Favored 'General case' 0 N--CA 1.532 3.662 0 CA-C-N 119.253 0.933 . . . . 0.0 109.933 175.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -74.12 -39.44 63.34 Favored 'General case' 0 N--CA 1.525 3.302 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 174.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.42 ' HB1' ' CZ ' ' A' ' 54' ' ' ARG . . . -84.24 -31.4 25.02 Favored 'General case' 0 N--CA 1.501 2.102 0 CA-C-O 117.432 -1.271 . . . . 0.0 110.357 -179.572 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.414 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 17.9 tp -70.35 -25.53 63.32 Favored 'General case' 1 N--CA 1.545 4.28 0 CA-C-N 120.961 1.71 . . . . 0.0 106.82 173.426 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.449 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -65.28 -73.45 0.59 Allowed Glycine 0 N--CA 1.507 3.382 0 C-N-CA 125.56 1.552 . . . . 0.0 111.295 176.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 m -69.66 -25.56 63.96 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-O 117.736 -1.126 . . . . 0.0 113.159 -177.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.42 ' CZ ' ' HB1' ' A' ' 50' ' ' ALA . 36.7 mtm180 -71.54 -48.34 49.29 Favored 'General case' 0 N--CA 1.53 3.529 0 CA-C-N 120.101 1.319 . . . . 0.0 107.849 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 51' ' ' LEU . 21.6 t -67.06 -18.07 23.64 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.042 0 CA-C-N 119.543 1.065 . . . . 0.0 109.684 175.206 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.82 -48.46 31.16 Favored 'General case' 0 N--CA 1.529 3.52 0 CA-C-N 119.828 1.195 . . . . 0.0 111.559 178.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.416 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -73.93 -24.84 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.555 0 CA-C-N 120.619 1.554 . . . . 0.0 111.378 -178.83 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.56 HG11 HD11 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -85.01 -49.33 15.79 Favored 'Isoleucine or valine' 1 N--CA 1.546 4.354 0 CA-C-N 120.419 1.463 . . . . 0.0 107.666 -179.228 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -62.04 -27.33 68.81 Favored 'General case' 0 N--CA 1.528 3.441 0 CA-C-O 118.917 -0.563 . . . . 0.0 109.961 178.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -91.21 -19.62 22.84 Favored 'General case' 0 N--CA 1.521 3.106 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.683 177.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.2 mt -76.68 -47.09 23.16 Favored 'General case' 0 N--CA 1.537 3.91 0 CA-C-N 119.71 1.141 . . . . 0.0 108.55 178.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 47.4 mt -52.6 -27.6 17.59 Favored 'General case' 0 N--CA 1.539 3.986 0 C-N-CA 124.366 1.066 . . . . 0.0 112.319 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 27.9 mmm180 -92.31 -48.61 6.58 Favored 'General case' 0 N--CA 1.526 3.333 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.4 79.3 0.46 Allowed Glycine 1 N--CA 1.52 4.241 0 CA-C-O 119.433 -0.648 . . . . 0.0 111.933 178.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -143.74 -59.44 0.4 Allowed 'General case' 0 N--CA 1.524 3.265 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 38.5 mtt -137.0 70.62 1.4 Allowed 'General case' 0 N--CA 1.522 3.149 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 178.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.418 ' HA ' HD22 ' A' ' 71' ' ' LEU . 9.7 t -128.77 -25.39 2.84 Favored 'General case' 0 N--CA 1.524 3.237 0 CA-C-O 117.573 -1.203 . . . . 0.0 113.634 -176.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -104.48 -59.89 1.67 Allowed 'General case' 0 N--CA 1.531 3.589 0 CA-C-N 120.166 1.348 . . . . 0.0 112.352 -176.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.79 -62.83 1.37 Allowed 'General case' 0 N--CA 1.527 3.421 0 C-N-CA 122.916 0.486 . . . . 0.0 111.741 -176.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -73.7 -3.54 28.91 Favored 'General case' 0 N--CA 1.52 3.033 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -176.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.59 HD23 HG21 ' A' ' 82' ' ' ILE . 46.2 tp -78.51 -51.38 10.06 Favored 'General case' 0 N--CA 1.525 3.308 0 CA-C-N 120.35 1.432 . . . . 0.0 112.683 -178.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -44.65 -31.29 1.11 Allowed 'General case' 1 N--CA 1.547 4.418 0 CA-C-N 119.612 1.096 . . . . 0.0 113.787 -176.538 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 25.2 t30 -71.67 -41.09 69.14 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-N 118.389 0.54 . . . . 0.0 110.459 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -62.97 -56.43 17.21 Favored 'General case' 0 N--CA 1.524 3.235 0 C-N-CA 124.076 0.95 . . . . 0.0 112.667 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.402 HD12 HD11 ' A' ' 71' ' ' LEU . 42.7 mt -99.54 -53.44 3.2 Favored 'General case' 0 N--CA 1.531 3.599 0 C-N-CA 123.013 0.525 . . . . 0.0 111.6 -177.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 117.23 25.49 3.22 Favored Glycine 1 N--CA 1.525 4.619 0 CA-C-O 118.392 -1.226 . . . . 0.0 111.186 -177.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -93.51 119.93 33.17 Favored 'General case' 0 N--CA 1.515 2.804 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 178.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -45.24 171.3 0.01 OUTLIER Glycine 1 N--CA 1.533 5.103 0 C-N-CA 124.253 0.93 . . . . 0.0 115.07 -178.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -80.21 -17.1 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.907 0 CA-C-O 117.9 -1.047 . . . . 0.0 108.594 178.126 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.33 -36.12 76.61 Favored 'General case' 0 N--CA 1.524 3.234 0 CA-C-N 119.584 1.083 . . . . 0.0 110.747 178.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.7 p -80.21 -42.16 23.82 Favored 'General case' 0 N--CA 1.536 3.864 0 CA-C-N 119.315 0.961 . . . . 0.0 111.526 -179.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.59 HG21 HD23 ' A' ' 71' ' ' LEU . 4.8 pt -71.68 -17.32 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.903 0 CA-C-O 117.597 -1.192 . . . . 0.0 113.632 -177.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 63.3 p -111.85 -28.89 7.88 Favored 'General case' 0 N--CA 1.515 2.821 0 CA-C-N 120.039 1.29 . . . . 0.0 110.833 178.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.6 ptt180 -76.4 -22.01 55.27 Favored 'General case' 0 N--CA 1.524 3.274 0 CA-C-N 119.605 1.093 . . . . 0.0 108.175 174.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -62.13 -36.07 92.42 Favored Glycine 1 N--CA 1.516 4.023 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 177.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 74.5 p -66.5 -33.09 74.92 Favored 'General case' 0 N--CA 1.535 3.783 0 CA-C-N 118.27 1.035 . . . . 0.0 109.971 176.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -61.21 -32.74 72.51 Favored 'General case' 1 N--CA 1.543 4.179 0 C-N-CA 123.474 0.71 . . . . 0.0 111.307 178.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.1 m -58.79 -38.51 78.72 Favored 'General case' 1 N--CA 1.545 4.321 0 C-N-CA 123.5 0.72 . . . . 0.0 111.179 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 12.8 mt -58.86 -41.49 87.12 Favored 'General case' 0 N--CA 1.532 3.647 0 C-N-CA 124.303 1.041 . . . . 0.0 111.084 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.7 -20.54 65.8 Favored 'General case' 1 N--CA 1.539 4.013 0 CA-C-O 118.439 -0.791 . . . . 0.0 112.416 -179.669 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -86.54 -43.7 12.51 Favored 'General case' 0 N--CA 1.514 2.735 0 CA-C-N 118.876 0.762 . . . . 0.0 110.196 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.11 163.9 9.37 Favored Pre-proline 1 N--CA 1.543 4.192 0 CA-C-O 118.09 -0.957 . . . . 0.0 112.508 179.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -84.41 166.74 12.18 Favored 'Trans proline' 0 C--N 1.381 2.268 0 C-N-CA 121.886 1.724 . . . . 0.0 111.131 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 t -91.59 -23.08 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.075 0 CA-C-O 117.663 -1.161 . . . . 0.0 111.374 -179.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -61.15 -42.82 99.24 Favored 'General case' 0 N--CA 1.518 2.955 0 CA-C-N 120.316 1.416 . . . . 0.0 109.894 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.578 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.2 mp -98.08 -13.17 21.15 Favored 'General case' 0 N--CA 1.512 2.647 0 C-N-CA 123.527 0.731 . . . . 0.0 111.851 178.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -32.35 73.68 Favored 'General case' 1 N--CA 1.541 4.081 0 N-CA-C 103.397 -2.816 . . . . 0.0 103.397 167.732 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -53.93 -38.53 65.0 Favored 'General case' 0 N--CA 1.515 2.818 0 C-N-CA 124.735 1.214 . . . . 0.0 110.384 174.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.612 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 48.6 t90 -65.32 -37.94 88.63 Favored 'General case' 0 N--CA 1.53 3.542 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 176.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.35 -36.2 52.95 Favored 'General case' 1 N--CA 1.541 4.125 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 176.402 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -70.69 -38.42 73.71 Favored 'General case' 0 N--CA 1.539 3.989 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 175.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.444 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 2.6 mt-10 -58.62 -22.77 57.4 Favored 'General case' 1 N--CA 1.544 4.226 0 C-N-CA 123.938 0.895 . . . . 0.0 110.926 175.473 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.512 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -110.16 -2.68 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.332 0 CA-C-O 117.968 -1.015 . . . . 0.0 113.482 -175.941 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 7.0 mp -114.04 -61.37 1.75 Allowed 'General case' 0 N--CA 1.523 3.188 0 N-CA-C 106.419 -1.697 . . . . 0.0 106.419 174.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.5 tt . . . . . 1 N--CA 1.546 4.37 0 C-N-CA 125.056 1.343 . . . . 0.0 112.875 -178.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 . . . . . 0 N--CA 1.525 3.324 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 519' ' ' TRP . . . . . 0.742 ' CE2' HD11 ' A' ' 39' ' ' LEU . 63.4 t-105 -42.8 -27.58 0.19 Allowed 'General case' 1 N--CA 1.543 4.198 0 C-N-CA 124.213 1.005 . . . . 0.0 113.667 178.828 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 520' ' ' LEU . . . . . 0.53 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.3 mm? -91.83 -33.38 14.98 Favored 'General case' 0 N--CA 1.523 3.221 0 CA-C-O 117.613 -1.184 . . . . 0.0 113.738 -171.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 16.0 ttp180 -64.79 -23.08 67.13 Favored 'General case' 0 N--CA 1.531 3.594 0 N-CA-C 106.125 -1.806 . . . . 0.0 106.125 171.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . 0.565 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.1 m-85 -78.04 -37.88 45.84 Favored 'General case' 0 N--CA 1.512 2.665 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 173.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 523' ' ' VAL . . . . . 0.423 HG23 ' O ' ' B' ' 519' ' ' TRP . 44.9 t -67.2 -20.09 26.34 Favored 'Isoleucine or valine' 1 N--CA 1.559 4.992 0 CA-C-O 117.799 -1.096 . . . . 0.0 111.352 177.366 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -76.52 -53.2 8.42 Favored 'General case' 0 N--CA 1.531 3.621 0 CA-C-N 120.337 1.426 . . . . 0.0 108.058 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 6.2 mp -67.57 -21.5 65.44 Favored 'General case' 0 N--CA 1.533 3.685 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 175.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 526' ' ' LEU . . . . . 0.421 ' HB2' ' HA ' ' B' ' 523' ' ' VAL . 0.8 OUTLIER -69.78 -36.06 75.41 Favored 'General case' 0 N--CA 1.519 3.02 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 176.507 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 527' ' ' LYS . . . . . 0.408 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 9.6 tttt -67.31 -23.29 65.63 Favored 'General case' 0 N--CA 1.521 3.08 0 CA-C-O 118.409 -0.805 . . . . 0.0 110.905 176.692 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -72.21 -40.87 67.5 Favored 'General case' 0 N--CA 1.533 3.7 0 CA-C-N 119.151 0.887 . . . . 0.0 109.59 178.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 529' ' ' ALA . . . . . 0.612 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -86.79 -13.75 44.24 Favored 'General case' 0 N--CA 1.509 2.49 0 CA-C-O 118.719 -0.658 . . . . 0.0 110.517 178.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 530' ' ' TYR . . . . . 0.408 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.8 OUTLIER -74.99 -29.69 60.95 Favored 'General case' 0 N--CA 1.536 3.838 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 177.696 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -61.94 -49.62 75.39 Favored 'General case' 0 N--CA 1.532 3.659 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 177.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -91.95 -87.93 0.21 Allowed 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 177.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.6 p30 155.8 51.77 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.84 0 C-N-CA 127.325 2.25 . . . . 0.0 107.54 177.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 534' ' ' LEU . . . . . 0.578 HD22 ' CD2' ' A' ' 96' ' ' LEU . 7.1 mt -109.95 11.33 24.12 Favored 'General case' 0 N--CA 1.529 3.523 0 C-N-CA 124.54 1.136 . . . . 0.0 110.988 -178.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 535' ' ' HIS . . . . . 0.555 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 40.7 p-80 -82.9 2.53 34.0 Favored 'General case' 0 N--CA 1.515 2.792 0 C-N-CA 123.419 0.688 . . . . 0.0 109.235 175.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 536' ' ' LEU . . . . . 0.445 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 36.4 mt -97.15 -50.69 0.23 Allowed Pre-proline 0 N--CA 1.509 2.507 0 CA-C-O 116.854 -1.546 . . . . 0.0 109.22 -175.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 537' ' ' PRO . . . . . 0.445 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 3.9 Cg_exo -68.68 -29.93 28.78 Favored 'Trans proline' 0 C--N 1.391 2.795 0 N-CA-C 106.79 -2.042 . . . . 0.0 106.79 171.086 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 538' ' ' LEU . . . . . 0.456 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 0.6 OUTLIER -65.28 -45.32 84.94 Favored 'General case' 0 N--CA 1.512 2.658 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 175.36 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 1.1 pp -76.52 -7.97 56.24 Favored 'General case' 0 N--CA 1.536 3.861 0 CA-C-N 118.992 0.814 . . . . 0.0 111.828 177.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -84.78 -0.69 54.66 Favored 'General case' 0 N--CA 1.525 3.303 0 CA-C-N 119.195 0.907 . . . . 0.0 109.635 175.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 541' ' ' LEU . . . . . 0.621 HD13 ' N ' ' B' ' 542' ' ' MET . 0.0 OUTLIER -118.72 -48.37 2.48 Favored 'General case' 0 N--CA 1.512 2.671 0 C-N-CA 125.039 1.336 . . . . 0.0 108.724 -178.731 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 542' ' ' MET . . . . . 0.621 ' N ' HD13 ' B' ' 541' ' ' LEU . 4.0 ptm -101.3 11.86 38.51 Favored 'General case' 0 N--CA 1.538 3.932 0 CA-C-O 118.584 -0.722 . . . . 0.0 112.83 -178.031 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 543' ' ' LEU . . . . . 0.489 ' O ' HG23 ' B' ' 544' ' ' THR . 0.2 OUTLIER -129.58 -86.24 0.54 Allowed 'General case' 0 N--CA 1.526 3.348 0 CA-C-O 117.322 -1.323 . . . . 0.0 112.182 -179.852 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 544' ' ' THR . . . . . 0.489 HG23 ' O ' ' B' ' 543' ' ' LEU . 7.8 p 137.08 137.39 0.0 OUTLIER Pre-proline 1 N--CA 1.569 5.515 0 C-N-CA 127.8 2.44 . . . . 0.0 107.289 -178.777 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -62.55 -29.65 78.57 Favored 'Trans proline' 0 N--CA 1.516 2.835 0 C-N-CA 122.839 2.359 . . . . 0.0 112.964 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -62.8 -28.5 70.04 Favored 'General case' 1 N--CA 1.54 4.069 0 CA-C-N 118.744 0.702 . . . . 0.0 111.282 179.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -70.72 -41.87 71.32 Favored 'General case' 0 N--CA 1.525 3.322 0 CA-C-O 118.712 -0.661 . . . . 0.0 109.918 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 548' ' ' ARG . . . . . 0.428 ' HB2' ' HB2' ' A' ' 19' ' ' TRP . 28.8 ptt180 -72.9 -21.97 60.82 Favored 'General case' 0 N--CA 1.529 3.494 0 CA-C-O 118.273 -0.87 . . . . 0.0 111.276 177.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -66.36 -50.88 62.03 Favored 'General case' 1 N--CA 1.54 4.062 0 N-CA-C 106.614 -1.625 . . . . 0.0 106.614 175.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -76.55 -9.86 58.97 Favored 'General case' 0 N--CA 1.508 2.465 0 CA-C-O 117.363 -1.303 . . . . 0.0 111.026 177.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 551' ' ' LEU . . . . . 0.811 HD22 ' CE3' ' A' ' 19' ' ' TRP . 5.8 tp -79.88 -31.5 40.35 Favored 'General case' 0 N--CA 1.516 2.827 0 CA-C-N 120.158 1.344 . . . . 0.0 107.68 174.224 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -70.49 -56.17 7.88 Favored Glycine 0 N--CA 1.51 3.577 0 N-CA-C 108.68 -1.768 . . . . 0.0 108.68 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.5 m -64.88 -27.98 69.23 Favored 'General case' 0 N--CA 1.537 3.882 0 CA-C-O 118.043 -0.979 . . . . 0.0 112.042 -179.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 6.5 mtm180 -69.26 -49.84 52.48 Favored 'General case' 1 N--CA 1.543 4.188 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 176.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 555' ' ' VAL . . . . . 0.406 HG23 ' O ' ' B' ' 551' ' ' LEU . 23.6 t -65.71 -16.89 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.679 0 CA-C-O 118.067 -0.968 . . . . 0.0 109.532 176.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 11.7 mtt180 -78.16 -47.29 18.45 Favored 'General case' 0 N--CA 1.521 3.113 0 CA-C-O 117.43 -1.271 . . . . 0.0 111.257 178.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 557' ' ' ILE . . . . . 0.462 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -70.75 -22.66 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.527 0 CA-C-N 121.456 1.934 . . . . 0.0 110.918 -179.297 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 558' ' ' VAL . . . . . 0.462 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -85.8 -51.05 13.84 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.002 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 179.979 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -57.26 -26.17 60.37 Favored 'General case' 0 N--CA 1.536 3.835 0 CA-C-O 118.543 -0.742 . . . . 0.0 110.178 177.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -90.39 -28.35 18.73 Favored 'General case' 0 N--CA 1.529 3.512 0 CA-C-O 118.586 -0.721 . . . . 0.0 109.749 177.412 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 6.8 mt -66.37 -44.01 84.34 Favored 'General case' 1 N--CA 1.546 4.342 0 CA-C-N 118.96 0.8 . . . . 0.0 109.552 178.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 14.7 mt -60.7 -22.91 64.44 Favored 'General case' 0 N--CA 1.534 3.761 0 C-N-CA 124.159 0.984 . . . . 0.0 111.795 179.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -82.62 -48.36 11.03 Favored 'General case' 0 N--CA 1.525 3.307 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 66.4 79.56 0.2 Allowed Glycine 1 N--CA 1.526 4.641 0 CA-C-O 119.318 -0.712 . . . . 0.0 111.663 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -155.8 -51.57 0.08 Allowed 'General case' 0 N--CA 1.527 3.388 0 CA-C-N 117.463 0.632 . . . . 0.0 109.56 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 10.5 ptt? -152.99 63.33 0.78 Allowed 'General case' 0 N--CA 1.527 3.419 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 78.6 p -130.63 3.19 4.54 Favored 'General case' 0 N--CA 1.522 3.131 0 CA-C-N 115.166 -0.924 . . . . 0.0 113.257 -176.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 42.4 mm-40 -110.02 -55.16 2.48 Favored 'General case' 0 N--CA 1.522 3.157 0 CA-C-N 119.579 1.081 . . . . 0.0 111.873 -178.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.94 -58.87 1.8 Allowed 'General case' 0 N--CA 1.529 3.52 0 CA-C-N 118.125 0.42 . . . . 0.0 111.875 -177.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -73.64 0.44 12.76 Favored 'General case' 0 N--CA 1.517 2.904 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -176.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 571' ' ' LEU . . . . . 0.706 HD23 HD11 ' B' ' 582' ' ' ILE . 15.7 tp -77.67 -45.59 24.48 Favored 'General case' 0 N--CA 1.524 3.227 0 CA-C-N 120.299 1.409 . . . . 0.0 110.515 -179.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 572' ' ' LYS . . . . . 0.589 ' NZ ' HD13 ' B' ' 579' ' ' ILE . 0.7 OUTLIER -54.65 -37.01 65.17 Favored 'General case' 1 N--CA 1.544 4.233 0 CA-C-N 120.002 1.274 . . . . 0.0 110.889 178.303 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 31.0 t30 -61.71 -38.54 88.24 Favored 'General case' 0 N--CA 1.535 3.788 0 C-N-CA 123.154 0.581 . . . . 0.0 110.109 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -65.01 -64.01 0.97 Allowed 'General case' 0 N--CA 1.518 2.93 0 C-N-CA 124.078 0.951 . . . . 0.0 110.663 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 5.5 mp -97.81 -68.2 0.81 Allowed 'General case' 0 N--CA 1.522 3.13 0 C-N-CA 123.374 0.67 . . . . 0.0 111.044 -179.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 133.05 50.16 0.09 OUTLIER Glycine 1 N--CA 1.517 4.083 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 -178.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -111.18 114.72 28.16 Favored 'General case' 0 N--CA 1.52 3.067 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 178.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -41.88 167.34 0.01 OUTLIER Glycine 1 N--CA 1.535 5.267 0 C-N-CA 124.819 1.2 . . . . 0.0 115.914 -176.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 579' ' ' ILE . . . . . 0.589 HD13 ' NZ ' ' B' ' 572' ' ' LYS . 1.1 mp -81.86 -16.94 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.094 0 CA-C-O 117.643 -1.17 . . . . 0.0 108.438 176.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -68.74 -37.92 79.78 Favored 'General case' 0 N--CA 1.526 3.371 0 CA-C-N 120.047 1.294 . . . . 0.0 108.87 176.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.1 p -79.7 -37.24 36.14 Favored 'General case' 0 N--CA 1.534 3.733 0 C-N-CA 123.191 0.597 . . . . 0.0 112.544 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 582' ' ' ILE . . . . . 0.706 HD11 HD23 ' B' ' 571' ' ' LEU . 0.4 OUTLIER -70.86 -37.73 69.62 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.35 0 C-N-CA 123.336 0.654 . . . . 0.0 111.343 -175.096 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 82.3 p -95.22 -28.78 14.85 Favored 'General case' 0 N--CA 1.513 2.699 0 CA-C-O 117.987 -1.006 . . . . 0.0 111.003 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 14.2 ptt180 -74.65 -21.58 59.35 Favored 'General case' 0 N--CA 1.528 3.469 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 173.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -69.11 -26.49 74.62 Favored Glycine 1 N--CA 1.517 4.071 0 N-CA-C 108.464 -1.854 . . . . 0.0 108.464 173.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 16.4 m -68.41 -36.78 79.58 Favored 'General case' 1 N--CA 1.539 4.01 0 CA-C-N 118.293 1.046 . . . . 0.0 108.862 176.365 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -62.19 -22.35 65.84 Favored 'General case' 0 N--CA 1.539 3.977 0 C-N-CA 123.182 0.593 . . . . 0.0 110.478 176.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 62.4 m -47.63 -47.54 29.05 Favored 'General case' 1 N--CA 1.544 4.226 0 C-N-CA 124.97 1.308 . . . . 0.0 111.091 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 28.0 mt -69.58 -41.14 76.19 Favored 'General case' 0 N--CA 1.519 2.986 0 C-N-CA 123.655 0.782 . . . . 0.0 109.974 178.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 12.1 mmpt? -55.3 -29.11 57.57 Favored 'General case' 1 N--CA 1.545 4.297 0 C-N-CA 123.684 0.794 . . . . 0.0 112.361 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -82.81 -44.8 15.1 Favored 'General case' 0 N--CA 1.515 2.792 0 C-N-CA 123.104 0.562 . . . . 0.0 110.586 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -70.08 158.9 86.26 Favored Pre-proline 0 N--CA 1.53 3.544 0 CA-C-O 118.518 -0.753 . . . . 0.0 112.496 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -81.2 176.29 8.94 Favored 'Trans proline' 0 C--N 1.379 2.142 0 C-N-CA 122.273 1.982 . . . . 0.0 111.064 178.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.1 t -89.81 -26.71 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.522 3.149 0 CA-C-O 117.708 -1.139 . . . . 0.0 111.609 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -62.75 -39.17 93.29 Favored 'General case' 0 N--CA 1.516 2.852 0 CA-C-N 120.159 1.345 . . . . 0.0 109.872 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 596' ' ' LEU . . . . . 0.61 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.7 mp -100.26 -11.04 20.7 Favored 'General case' 0 N--CA 1.514 2.74 0 C-N-CA 123.564 0.746 . . . . 0.0 112.103 177.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -33.3 75.36 Favored 'General case' 1 N--CA 1.543 4.207 0 N-CA-C 102.344 -3.206 . . . . 0.0 102.344 165.996 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -56.63 -36.57 69.64 Favored 'General case' 0 N--CA 1.52 3.043 0 C-N-CA 124.712 1.205 . . . . 0.0 110.465 174.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 599' ' ' TRP . . . . . 0.649 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 35.4 t90 -63.25 -37.06 85.75 Favored 'General case' 1 N--CA 1.54 4.053 0 N-CA-C 107.092 -1.447 . . . . 0.0 107.092 176.439 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.79 -35.89 57.35 Favored 'General case' 0 N--CA 1.538 3.957 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 176.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -71.28 -37.0 71.89 Favored 'General case' 1 N--CA 1.541 4.111 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 175.366 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -60.34 -22.87 63.74 Favored 'General case' 1 N--CA 1.544 4.247 0 C-N-CA 123.5 0.72 . . . . 0.0 109.861 174.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 603' ' ' VAL . . . . . 0.551 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.0 OUTLIER -115.48 1.65 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.407 0 CA-C-O 118.423 -0.798 . . . . 0.0 112.471 -177.356 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 42.8 mt -108.28 -64.85 1.18 Allowed 'General case' 0 N--CA 1.523 3.212 0 N-CA-C 104.666 -2.346 . . . . 0.0 104.666 174.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 6.4 tp . . . . . 0 N--CA 1.537 3.875 0 C-N-CA 125.442 1.497 . . . . 0.0 111.912 178.461 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 . . . . . 0 N--CA 1.52 3.064 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.625 ' CZ3' HD22 ' B' ' 551' ' ' LEU . 76.4 t-105 -51.03 -42.35 60.41 Favored 'General case' 0 N--CA 1.532 3.625 0 C-N-CA 123.359 0.664 . . . . 0.0 110.085 176.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.432 HD22 ' N ' ' A' ' 20' ' ' LEU . 2.9 mm? -77.77 -28.18 50.49 Favored 'General case' 0 N--CA 1.516 2.833 0 O-C-N 124.925 1.391 . . . . 0.0 112.112 -176.019 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 27.7 tpt180 -57.9 -27.76 63.6 Favored 'General case' 1 N--CA 1.539 4.005 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 173.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.516 ' CG ' HD21 ' B' ' 551' ' ' LEU . 0.1 OUTLIER -81.6 -39.56 24.33 Favored 'General case' 0 N--CA 1.509 2.495 0 CA-C-O 117.092 -1.432 . . . . 0.0 108.829 172.876 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 26.3 t -66.97 -38.67 81.83 Favored 'Isoleucine or valine' 1 N--CA 1.561 5.085 0 CA-C-N 120.207 1.367 . . . . 0.0 113.478 -174.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -67.79 -50.87 54.61 Favored 'General case' 1 N--CA 1.542 4.135 0 CA-C-N 120.027 1.285 . . . . 0.0 109.349 -178.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.1 mp -69.86 -17.47 63.37 Favored 'General case' 0 N--CA 1.533 3.709 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 175.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.08 -37.82 84.64 Favored 'General case' 0 N--CA 1.519 3.004 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 175.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.443 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 23.9 ttmt -63.44 -23.48 67.42 Favored 'General case' 0 N--CA 1.526 3.348 0 CA-C-O 118.303 -0.856 . . . . 0.0 111.385 177.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -70.88 -41.89 70.74 Favored 'General case' 0 N--CA 1.534 3.751 0 CA-C-N 119.221 0.919 . . . . 0.0 108.525 176.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.65 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -89.24 -3.28 58.61 Favored 'General case' 0 CA--C 1.581 2.153 0 CA-C-O 118.446 -0.788 . . . . 0.0 110.672 177.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.443 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -86.5 -36.72 18.84 Favored 'General case' 0 N--CA 1.534 3.739 0 CA-C-N 120.513 1.506 . . . . 0.0 108.832 179.991 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -59.78 -44.33 93.97 Favored 'General case' 0 N--CA 1.536 3.853 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 177.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -87.44 -86.47 0.16 Allowed 'General case' 0 N--CA 1.514 2.741 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 176.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 p30 149.31 45.15 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.912 0 C-N-CA 127.656 2.382 . . . . 0.0 109.109 177.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.51 HD22 ' CD2' ' B' ' 596' ' ' LEU . 5.7 mt -104.79 15.33 28.07 Favored 'General case' 0 N--CA 1.528 3.436 0 C-N-CA 124.177 0.991 . . . . 0.0 110.25 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.556 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 48.9 p-80 -84.7 6.64 23.42 Favored 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 175.115 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.675 ' HA ' HD23 ' A' ' 39' ' ' LEU . 26.7 mt -95.58 -52.29 0.23 Allowed Pre-proline 0 N--CA 1.501 2.097 0 CA-C-O 116.942 -1.504 . . . . 0.0 108.633 -175.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.496 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 4.3 Cg_exo -67.16 -33.5 31.06 Favored 'Trans proline' 0 C--N 1.39 2.726 0 N-CA-C 106.64 -2.1 . . . . 0.0 106.64 170.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.556 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.6 OUTLIER -63.45 -40.64 97.68 Favored 'General case' 0 N--CA 1.517 2.884 0 CA-C-O 118.01 -0.995 . . . . 0.0 109.203 176.887 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.675 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -75.91 -18.45 59.37 Favored 'General case' 1 N--CA 1.544 4.231 0 CA-C-N 119.921 1.237 . . . . 0.0 110.46 177.333 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -80.09 -7.39 58.86 Favored 'General case' 0 N--CA 1.525 3.325 0 CA-C-N 119.45 1.023 . . . . 0.0 110.062 175.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.549 HD13 ' N ' ' A' ' 42' ' ' MET . 0.8 OUTLIER -106.46 -60.26 1.68 Allowed 'General case' 0 N--CA 1.521 3.112 0 C-N-CA 124.019 0.927 . . . . 0.0 111.58 -178.487 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.549 ' N ' HD13 ' A' ' 41' ' ' LEU . 13.5 ptt? -93.47 3.76 55.05 Favored 'General case' 1 N--CA 1.546 4.353 0 CA-C-N 119.442 1.019 . . . . 0.0 113.504 -177.056 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.532 HD11 HD11 ' B' ' 551' ' ' LEU . 5.1 mp -120.73 -94.63 0.5 Allowed 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 178.139 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.445 HG23 ' O ' ' A' ' 43' ' ' LEU . 0.7 OUTLIER 156.55 169.82 0.01 OUTLIER Pre-proline 1 N--CA 1.575 5.801 0 C-N-CA 125.747 1.619 . . . . 0.0 109.685 179.706 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -68.29 -37.37 14.02 Favored 'Trans proline' 0 C--N 1.392 2.841 0 C-N-CA 121.918 1.745 . . . . 0.0 108.099 174.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -64.25 -22.33 66.91 Favored 'General case' 0 N--CA 1.527 3.404 0 C-N-CA 123.518 0.727 . . . . 0.0 110.418 176.174 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -70.22 -38.45 75.25 Favored 'General case' 0 N--CA 1.524 3.257 0 CA-C-O 117.438 -1.267 . . . . 0.0 109.867 178.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 26.1 ptt180 -80.91 -17.34 50.92 Favored 'General case' 0 N--CA 1.539 3.986 0 CA-C-N 119.992 1.269 . . . . 0.0 108.32 173.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -74.47 -18.63 60.6 Favored 'General case' 0 N--CA 1.52 3.045 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 172.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 54' ' ' ARG . . . -90.14 -46.81 8.21 Favored 'General case' 0 N--CA 1.504 2.264 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 178.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.494 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 23.6 tp -66.81 -21.12 66.04 Favored 'General case' 1 N--CA 1.546 4.357 0 CA-C-N 120.613 1.551 . . . . 0.0 108.005 173.966 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.454 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -71.04 -72.21 0.93 Allowed Glycine 0 N--CA 1.502 3.089 0 C-N-CA 125.707 1.623 . . . . 0.0 111.421 177.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.9 m -70.18 -25.21 63.32 Favored 'General case' 0 N--CA 1.532 3.659 0 CA-C-O 117.639 -1.172 . . . . 0.0 112.526 -177.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 2.5 mpt_? -73.61 -51.8 15.59 Favored 'General case' 0 N--CA 1.53 3.539 0 CA-C-N 120.213 1.37 . . . . 0.0 107.545 177.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.2 t -62.23 -18.41 19.97 Favored 'Isoleucine or valine' 1 N--CA 1.545 4.309 0 CA-C-N 119.472 1.033 . . . . 0.0 109.853 175.067 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.6 mmm180 -75.86 -48.48 21.3 Favored 'General case' 0 N--CA 1.517 2.897 0 CA-C-O 117.343 -1.313 . . . . 0.0 111.903 178.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -71.32 -21.63 21.89 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.439 0 CA-C-N 121.171 1.805 . . . . 0.0 111.303 -178.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -87.69 -52.01 11.97 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.011 0 CA-C-N 119.96 1.255 . . . . 0.0 107.869 -178.91 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -62.73 -21.6 65.92 Favored 'General case' 0 N--CA 1.528 3.474 0 CA-C-O 118.58 -0.724 . . . . 0.0 110.202 177.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -91.86 -23.96 19.49 Favored 'General case' 0 N--CA 1.526 3.338 0 CA-C-O 118.082 -0.961 . . . . 0.0 110.273 177.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.6 mt -77.62 -61.86 1.85 Allowed 'General case' 0 N--CA 1.535 3.801 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 178.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.3 tt -43.4 -37.85 2.51 Favored 'General case' 1 N--CA 1.545 4.321 0 C-N-CA 125.98 1.712 . . . . 0.0 112.798 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -87.99 -62.64 1.45 Allowed 'General case' 0 N--CA 1.524 3.269 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.17 83.29 1.43 Allowed Glycine 0 N--CA 1.513 3.821 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 179.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -131.21 -58.3 1.0 Allowed 'General case' 0 N--CA 1.521 3.12 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 15.1 ptt? -154.4 82.32 1.12 Allowed 'General case' 0 N--CA 1.522 3.159 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 178.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.4 ' HA ' HD22 ' A' ' 71' ' ' LEU . 3.8 t -130.0 -9.52 4.35 Favored 'General case' 0 N--CA 1.523 3.214 0 CA-C-O 117.993 -1.003 . . . . 0.0 113.464 -176.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -106.75 -65.27 1.1 Allowed 'General case' 0 N--CA 1.533 3.71 0 CA-C-N 120.437 1.472 . . . . 0.0 111.54 -177.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.4 mtt180 -104.71 -45.88 4.48 Favored 'General case' 0 N--CA 1.53 3.533 0 C-N-CA 123.148 0.579 . . . . 0.0 109.843 -178.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -66.82 -10.35 46.96 Favored 'General case' 0 N--CA 1.52 3.062 0 CA-C-O 118.376 -0.821 . . . . 0.0 112.962 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.644 HD23 HG21 ' A' ' 82' ' ' ILE . 28.6 tp -88.73 -55.44 3.71 Favored 'General case' 0 N--CA 1.524 3.234 0 CA-C-N 119.748 1.158 . . . . 0.0 113.186 -177.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -37.99 -37.47 0.26 Allowed 'General case' 1 N--CA 1.552 4.664 0 N-CA-C 114.217 1.192 . . . . 0.0 114.217 -177.118 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -73.72 -44.11 57.3 Favored 'General case' 0 N--CA 1.533 3.687 0 CA-C-N 118.158 0.435 . . . . 0.0 110.411 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -46.57 -49.51 18.69 Favored 'General case' 0 N--CA 1.533 3.692 0 C-N-CA 124.888 1.275 . . . . 0.0 113.49 -179.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.4 pp -132.34 -43.0 0.95 Allowed 'General case' 0 N--CA 1.532 3.656 0 CA-C-O 118.803 -0.618 . . . . 0.0 111.974 -178.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 111.62 74.88 0.74 Allowed Glycine 1 N--CA 1.525 4.61 0 N-CA-C 110.588 -1.005 . . . . 0.0 110.588 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.68 -37.48 5.9 Favored 'General case' 0 N--CA 1.526 3.334 0 C-N-CA 123.409 0.684 . . . . 0.0 110.528 179.047 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 100.16 163.8 28.66 Favored Glycine 1 N--CA 1.523 4.459 0 N-CA-C 109.429 -1.468 . . . . 0.0 109.429 -177.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.0 mt -86.57 -11.49 11.1 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.664 0 CA-C-N 119.403 1.602 . . . . 0.0 109.296 178.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.34 -36.93 68.95 Favored 'General case' 0 N--CA 1.526 3.326 0 CA-C-N 119.93 1.241 . . . . 0.0 110.49 176.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.2 p -83.93 -39.18 20.1 Favored 'General case' 1 N--CA 1.541 4.081 0 CA-C-N 119.517 1.053 . . . . 0.0 112.227 -179.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.644 HG21 HD23 ' A' ' 71' ' ' LEU . 1.8 pt -73.28 -14.79 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.718 0 CA-C-O 117.85 -1.071 . . . . 0.0 112.938 -177.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 50.3 p -112.6 -33.18 6.22 Favored 'General case' 0 N--CA 1.514 2.755 0 CA-C-N 119.951 1.251 . . . . 0.0 110.184 178.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 13.8 ptt180 -72.81 -21.46 60.97 Favored 'General case' 0 N--CA 1.532 3.659 0 CA-C-N 119.464 1.029 . . . . 0.0 108.426 174.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -64.73 -33.49 87.37 Favored Glycine 1 N--CA 1.52 4.249 0 N-CA-C 109.313 -1.515 . . . . 0.0 109.313 175.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.6 t -63.96 -33.18 75.15 Favored 'General case' 1 N--CA 1.539 4.021 0 CA-C-N 118.282 1.041 . . . . 0.0 109.748 176.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -55.65 -33.8 64.39 Favored 'General case' 1 N--CA 1.547 4.376 0 C-N-CA 123.335 0.654 . . . . 0.0 111.285 177.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.7 m -62.15 -34.71 76.91 Favored 'General case' 1 N--CA 1.54 4.043 0 C-N-CA 123.728 0.811 . . . . 0.0 112.114 -179.56 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.3 mt -56.13 -42.32 76.73 Favored 'General case' 0 N--CA 1.536 3.831 0 C-N-CA 123.892 0.877 . . . . 0.0 111.166 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -21.53 61.49 Favored 'General case' 0 N--CA 1.534 3.739 0 CA-C-O 118.244 -0.884 . . . . 0.0 112.116 -179.401 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.76 -41.65 26.17 Favored 'General case' 0 N--CA 1.517 2.892 0 CA-C-N 119.157 0.889 . . . . 0.0 111.669 -179.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.17 159.9 13.56 Favored Pre-proline 1 N--CA 1.543 4.203 0 CA-C-O 118.471 -0.776 . . . . 0.0 113.079 -178.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -85.1 157.22 11.32 Favored 'Trans proline' 0 C--N 1.379 2.183 0 C-N-CA 122.285 1.99 . . . . 0.0 110.261 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 t -78.54 -27.71 14.22 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.114 0 CA-C-O 117.873 -1.061 . . . . 0.0 111.102 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -58.82 -44.21 90.79 Favored 'General case' 0 N--CA 1.518 2.932 0 CA-C-N 120.173 1.351 . . . . 0.0 109.949 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.769 HD21 HD22 ' B' ' 534' ' ' LEU . 7.7 mp -100.18 -7.46 24.73 Favored 'General case' 0 N--CA 1.512 2.667 0 CA-C-O 118.362 -0.827 . . . . 0.0 112.71 177.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -35.86 81.9 Favored 'General case' 0 N--CA 1.539 3.979 0 N-CA-C 102.361 -3.2 . . . . 0.0 102.361 168.048 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.59 -40.39 65.64 Favored 'General case' 0 N--CA 1.515 2.794 0 C-N-CA 124.492 1.117 . . . . 0.0 111.332 174.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.67 ' CH2' ' HB2' ' B' ' 529' ' ' ALA . 51.5 t90 -64.47 -35.59 81.44 Favored 'General case' 1 N--CA 1.541 4.09 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 177.601 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.57 -37.69 63.17 Favored 'General case' 0 N--CA 1.533 3.681 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 176.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -69.0 -37.24 78.6 Favored 'General case' 1 N--CA 1.539 4.016 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 175.5 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.15 -25.31 61.32 Favored 'General case' 1 N--CA 1.542 4.156 0 C-N-CA 123.089 0.556 . . . . 0.0 110.067 175.575 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.524 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.3 OUTLIER -120.37 5.51 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.482 0 C-N-CA 123.592 0.757 . . . . 0.0 112.792 -176.845 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -125.45 -56.85 1.5 Allowed 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 178.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 4.1 tt . . . . . 1 N--CA 1.544 4.273 0 C-N-CA 124.914 1.286 . . . . 0.0 113.524 -179.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 . . . . . 0 N--CA 1.523 3.212 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 519' ' ' TRP . . . . . 0.664 ' CE2' HD22 ' A' ' 39' ' ' LEU . 71.7 t-105 -43.07 -28.66 0.29 Allowed 'General case' 1 N--CA 1.55 4.555 0 C-N-CA 124.279 1.032 . . . . 0.0 113.424 179.855 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 520' ' ' LEU . . . . . 0.587 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.3 mm? -95.76 -31.43 13.2 Favored 'General case' 0 N--CA 1.526 3.373 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.693 -173.262 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.11 -22.92 65.1 Favored 'General case' 0 N--CA 1.539 3.994 0 N-CA-C 106.904 -1.517 . . . . 0.0 106.904 171.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . 0.515 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.6 m-85 -81.82 -40.16 22.94 Favored 'General case' 0 N--CA 1.509 2.494 0 N-CA-C 107.208 -1.404 . . . . 0.0 107.208 174.167 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 20.4 t -58.88 -44.81 91.56 Favored 'Isoleucine or valine' 1 N--CA 1.565 5.313 0 CA-C-O 117.603 -1.189 . . . . 0.0 113.292 -179.059 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -61.05 -46.11 92.01 Favored 'General case' 1 N--CA 1.548 4.462 0 CA-C-N 120.641 1.564 . . . . 0.0 110.038 -178.484 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 1.7 tp -67.38 -26.52 66.5 Favored 'General case' 0 N--CA 1.536 3.829 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 176.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 526' ' ' LEU . . . . . 0.441 HD23 ' O ' ' B' ' 522' ' ' PHE . 1.6 mm? -68.06 -31.78 71.67 Favored 'General case' 0 N--CA 1.522 3.141 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 176.745 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 527' ' ' LYS . . . . . 0.484 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 15.2 tttt -67.79 -23.3 65.19 Favored 'General case' 0 N--CA 1.521 3.118 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.833 177.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -71.99 -41.27 67.83 Favored 'General case' 0 N--CA 1.534 3.744 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 176.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 529' ' ' ALA . . . . . 0.67 ' HB2' ' CH2' ' A' ' 99' ' ' TRP . . . -88.6 -7.34 56.59 Favored 'General case' 0 N--CA 1.503 2.219 0 CA-C-O 118.427 -0.797 . . . . 0.0 110.569 177.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 530' ' ' TYR . . . . . 0.484 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.5 OUTLIER -82.07 -35.68 28.44 Favored 'General case' 0 N--CA 1.532 3.671 0 CA-C-N 120.309 1.413 . . . . 0.0 108.737 179.798 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -60.7 -45.07 95.6 Favored 'General case' 0 N--CA 1.538 3.932 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -90.67 -84.0 0.25 Allowed 'General case' 0 N--CA 1.515 2.805 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 177.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.0 p30 149.31 47.34 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.88 0 C-N-CA 128.105 2.562 . . . . 0.0 108.104 178.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 534' ' ' LEU . . . . . 0.769 HD22 HD21 ' A' ' 96' ' ' LEU . 7.3 mt -102.89 9.13 39.0 Favored 'General case' 0 N--CA 1.529 3.523 0 C-N-CA 124.095 0.958 . . . . 0.0 111.606 -178.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 535' ' ' HIS . . . . . 0.623 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 49.2 p-80 -80.76 0.38 34.95 Favored 'General case' 0 N--CA 1.512 2.657 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 175.006 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 536' ' ' LEU . . . . . 0.441 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 33.8 mt -94.01 -51.43 0.26 Allowed Pre-proline 0 N--CA 1.505 2.303 0 CA-C-O 116.343 -1.789 . . . . 0.0 109.067 -175.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 537' ' ' PRO . . . . . 0.441 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 3.7 Cg_exo -64.57 -37.42 37.71 Favored 'Trans proline' 0 C--N 1.396 3.048 0 N-CA-C 107.071 -1.934 . . . . 0.0 107.071 170.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 538' ' ' LEU . . . . . 0.437 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 1.2 tm? -60.28 -41.53 93.51 Favored 'General case' 0 N--CA 1.527 3.387 0 C-N-CA 124.332 1.053 . . . . 0.0 108.736 175.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 11.0 mt -71.78 -25.04 61.86 Favored 'General case' 0 N--CA 1.536 3.836 0 CA-C-O 118.247 -0.883 . . . . 0.0 111.452 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -77.88 -8.05 57.54 Favored 'General case' 0 N--CA 1.53 3.526 0 CA-C-N 119.31 0.959 . . . . 0.0 110.187 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 541' ' ' LEU . . . . . 0.497 ' O ' HD22 ' B' ' 541' ' ' LEU . 0.0 OUTLIER -103.6 -42.17 5.74 Favored 'General case' 0 N--CA 1.512 2.656 0 C-N-CA 124.033 0.933 . . . . 0.0 109.779 -179.388 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 542' ' ' MET . . . . . 0.48 ' N ' HD13 ' B' ' 541' ' ' LEU . 15.1 ptp -85.2 -28.08 25.69 Favored 'General case' 0 N--CA 1.534 3.764 0 CA-C-O 117.439 -1.267 . . . . 0.0 113.252 -177.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 1.8 tt -131.54 -110.27 0.25 Allowed 'General case' 0 N--CA 1.533 3.691 0 CA-C-O 116.967 -1.492 . . . . 0.0 112.886 -177.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 24.3 p -163.75 162.81 16.57 Favored Pre-proline 1 N--CA 1.542 4.168 0 CA-C-N 120.754 1.615 . . . . 0.0 111.823 -177.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -76.43 -32.09 4.06 Favored 'Trans proline' 0 CA--C 1.578 2.677 0 C-N-CA 122.792 2.328 . . . . 0.0 109.551 174.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -55.63 -36.41 66.97 Favored 'General case' 1 N--CA 1.546 4.338 0 C-N-CA 123.876 0.87 . . . . 0.0 111.523 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -71.66 -32.57 68.03 Favored 'General case' 0 N--CA 1.523 3.191 0 CA-C-O 117.637 -1.173 . . . . 0.0 110.778 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 20.5 ptt180 -74.16 -21.21 59.94 Favored 'General case' 0 N--CA 1.534 3.731 0 CA-C-N 120.027 1.285 . . . . 0.0 109.618 175.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -65.19 -44.43 88.41 Favored 'General case' 0 N--CA 1.536 3.832 0 N-CA-C 106.184 -1.784 . . . . 0.0 106.184 173.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -72.22 -20.29 61.59 Favored 'General case' 0 N--CA 1.517 2.915 0 CA-C-O 117.198 -1.382 . . . . 0.0 110.764 176.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 551' ' ' LEU . . . . . 0.625 HD22 ' CZ3' ' A' ' 19' ' ' TRP . 12.3 tp -80.42 -20.26 44.32 Favored 'General case' 0 N--CA 1.524 3.238 0 CA-C-N 120.582 1.537 . . . . 0.0 109.168 175.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -77.35 -52.18 5.73 Favored Glycine 0 N--CA 1.507 3.401 0 N-CA-C 108.333 -1.907 . . . . 0.0 108.333 177.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.5 m -70.32 -32.54 70.33 Favored 'General case' 0 N--CA 1.535 3.825 0 CA-C-O 118.703 -0.665 . . . . 0.0 110.842 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -63.9 -54.64 31.56 Favored 'General case' 1 N--CA 1.539 4.007 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 176.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 38.9 t -66.28 -14.9 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.531 0 CA-C-O 117.759 -1.115 . . . . 0.0 110.995 177.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.77 -44.39 20.77 Favored 'General case' 0 N--CA 1.526 3.374 0 CA-C-N 120.168 1.349 . . . . 0.0 111.539 178.359 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 557' ' ' ILE . . . . . 0.451 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -71.94 -22.49 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.278 0 CA-C-N 120.724 1.602 . . . . 0.0 110.213 -179.669 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 558' ' ' VAL . . . . . 0.451 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -88.44 -52.49 11.09 Favored 'Isoleucine or valine' 1 N--CA 1.543 4.181 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 -179.789 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -57.72 -24.28 56.12 Favored 'General case' 0 N--CA 1.536 3.826 0 CA-C-O 118.895 -0.574 . . . . 0.0 110.487 177.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -98.07 -22.81 16.04 Favored 'General case' 0 N--CA 1.527 3.377 0 CA-C-O 118.059 -0.972 . . . . 0.0 111.363 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 16.6 tp -78.72 -63.17 1.47 Allowed 'General case' 0 N--CA 1.537 3.878 0 CA-C-N 119.637 1.108 . . . . 0.0 108.473 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 25.9 mt -41.82 -31.38 0.31 Allowed 'General case' 1 N--CA 1.547 4.422 0 C-N-CA 125.303 1.441 . . . . 0.0 113.513 -178.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 11.4 mmm180 -75.75 -51.01 13.61 Favored 'General case' 0 N--CA 1.527 3.398 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 80.67 93.47 0.44 Allowed Glycine 1 N--CA 1.516 4.02 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 177.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -161.54 -53.34 0.05 OUTLIER 'General case' 0 N--CA 1.529 3.508 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 48.1 mtt -153.31 77.8 1.14 Allowed 'General case' 0 N--CA 1.522 3.151 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 95.1 p -136.34 4.59 2.92 Favored 'General case' 0 N--CA 1.519 2.979 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -175.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -110.99 -69.69 0.85 Allowed 'General case' 0 N--CA 1.529 3.491 0 CA-C-N 120.153 1.342 . . . . 0.0 111.592 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.98 -45.4 6.94 Favored 'General case' 0 N--CA 1.53 3.559 0 CA-C-N 118.538 0.608 . . . . 0.0 111.806 -176.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -80.05 -5.13 55.28 Favored 'General case' 0 N--CA 1.522 3.172 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 -177.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 571' ' ' LEU . . . . . 0.815 HD23 HD11 ' B' ' 582' ' ' ILE . 27.9 tp -83.42 -48.49 10.3 Favored 'General case' 0 N--CA 1.531 3.594 0 CA-C-N 120.165 1.348 . . . . 0.0 112.555 -177.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -47.06 -30.61 2.81 Favored 'General case' 1 N--CA 1.552 4.628 0 CA-C-N 119.855 1.207 . . . . 0.0 113.82 -178.682 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -68.84 -38.08 79.56 Favored 'General case' 0 N--CA 1.537 3.92 0 CA-C-N 118.724 0.693 . . . . 0.0 110.881 -178.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -49.96 -61.25 2.25 Favored 'General case' 0 N--CA 1.53 3.549 0 C-N-CA 124.769 1.228 . . . . 0.0 113.0 -179.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.0 -36.56 3.25 Favored 'General case' 0 N--CA 1.534 3.747 0 CA-C-O 118.511 -0.756 . . . . 0.0 111.905 -178.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 115.25 57.71 0.35 Allowed Glycine 1 N--CA 1.525 4.57 0 CA-C-N 119.144 0.883 . . . . 0.0 111.039 179.577 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -114.54 103.16 10.75 Favored 'General case' 0 N--CA 1.52 3.069 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 177.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -39.0 164.28 0.01 OUTLIER Glycine 1 N--CA 1.544 5.834 0 C-N-CA 125.441 1.496 . . . . 0.0 115.311 -176.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 579' ' ' ILE . . . . . 0.443 ' HA ' HG22 ' B' ' 582' ' ' ILE 0.262 10.9 mt -81.89 -12.24 12.4 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.333 0 CA-C-N 118.888 1.344 . . . . 0.0 109.341 178.383 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -70.05 -41.64 73.94 Favored 'General case' 0 N--CA 1.531 3.577 0 CA-C-N 120.363 1.438 . . . . 0.0 109.285 175.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -77.4 -37.71 51.37 Favored 'General case' 1 N--CA 1.54 4.03 0 CA-C-N 118.909 0.777 . . . . 0.0 111.877 179.144 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 582' ' ' ILE . . . . . 0.815 HD11 HD23 ' B' ' 571' ' ' LEU . 1.0 OUTLIER -66.57 -40.04 85.35 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.375 0 C-N-CA 123.421 0.688 . . . . 0.0 111.722 -176.101 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 583' ' ' THR . . . . . 0.537 HG23 ' CG2' ' B' ' 582' ' ' ILE . 44.2 p -99.89 -18.36 17.15 Favored 'General case' 0 N--CA 1.506 2.368 0 CA-C-O 117.744 -1.122 . . . . 0.0 112.057 -178.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -81.64 -20.95 38.58 Favored 'General case' 0 N--CA 1.528 3.475 0 CA-C-N 120.265 1.393 . . . . 0.0 107.909 173.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -66.33 -35.49 90.32 Favored Glycine 1 N--CA 1.518 4.116 0 N-CA-C 108.785 -1.726 . . . . 0.0 108.785 176.084 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 88.8 p -66.55 -32.6 74.04 Favored 'General case' 0 N--CA 1.534 3.769 0 CA-C-N 117.803 0.802 . . . . 0.0 111.188 177.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -64.14 -31.32 72.47 Favored 'General case' 0 N--CA 1.53 3.544 0 C-N-CA 123.566 0.747 . . . . 0.0 110.778 178.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 52.9 m -62.95 -41.07 99.39 Favored 'General case' 1 N--CA 1.54 4.047 0 C-N-CA 123.5 0.72 . . . . 0.0 110.77 178.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 57.2 mt -52.78 -48.49 66.79 Favored 'General case' 0 N--CA 1.531 3.578 0 C-N-CA 124.46 1.104 . . . . 0.0 111.956 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -61.03 -29.81 69.94 Favored 'General case' 1 N--CA 1.54 4.049 0 CA-C-O 118.691 -0.671 . . . . 0.0 112.349 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -71.39 -41.61 69.43 Favored 'General case' 0 N--CA 1.52 3.03 0 CA-C-N 118.391 0.541 . . . . 0.0 110.806 179.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -57.72 162.52 4.91 Favored Pre-proline 1 N--CA 1.542 4.15 0 CA-C-O 118.194 -0.908 . . . . 0.0 112.132 179.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -78.97 -177.98 4.31 Favored 'Trans proline' 0 C--N 1.379 2.134 0 C-N-CA 121.439 1.426 . . . . 0.0 110.514 178.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.1 t -99.36 -29.2 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.098 0 CA-C-O 117.757 -1.116 . . . . 0.0 111.286 -179.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -63.4 -41.32 98.75 Favored 'General case' 0 N--CA 1.517 2.882 0 CA-C-N 119.761 1.164 . . . . 0.0 110.535 -178.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 596' ' ' LEU . . . . . 0.51 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.7 mp -99.52 -15.88 18.5 Favored 'General case' 0 N--CA 1.511 2.582 0 C-N-CA 123.331 0.653 . . . . 0.0 111.762 179.099 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . 0.408 ' HA ' HD13 ' B' ' 600' ' ' LEU . 0.1 OUTLIER -67.48 -29.68 69.19 Favored 'General case' 0 N--CA 1.531 3.617 0 N-CA-C 103.119 -2.919 . . . . 0.0 103.119 167.851 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -56.36 -36.91 69.33 Favored 'General case' 0 N--CA 1.521 3.094 0 C-N-CA 124.302 1.041 . . . . 0.0 110.388 173.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 599' ' ' TRP . . . . . 0.65 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 50.4 t90 -63.59 -35.61 81.07 Favored 'General case' 0 N--CA 1.53 3.558 0 CA-C-O 117.657 -1.164 . . . . 0.0 108.112 178.288 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 600' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' B' ' 597' ' ' ARG . 6.2 mp -54.93 -37.03 65.9 Favored 'General case' 1 N--CA 1.544 4.245 0 CA-C-N 119.37 0.986 . . . . 0.0 108.429 176.501 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -70.81 -34.18 71.47 Favored 'General case' 0 N--CA 1.532 3.634 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 176.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 602' ' ' GLU . . . . . 0.406 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.5 OUTLIER -62.2 -24.4 67.2 Favored 'General case' 1 N--CA 1.546 4.363 0 C-N-CA 123.491 0.716 . . . . 0.0 109.88 174.868 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' B' B ' 603' ' ' VAL . . . . . 0.564 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.5 OUTLIER -121.46 13.73 6.06 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.448 0 C-N-CA 123.851 0.861 . . . . 0.0 111.888 -177.565 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 45.0 mt -126.6 -61.95 1.16 Allowed 'General case' 0 N--CA 1.528 3.426 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 176.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.539 3.989 0 C-N-CA 124.573 1.149 . . . . 0.0 111.295 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 . . . . . 0 N--CA 1.534 3.737 0 N-CA-C 105.777 -1.935 . . . . 0.0 105.777 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.423 ' CE3' HD23 ' B' ' 551' ' ' LEU . 59.1 t-105 -51.03 -37.18 43.7 Favored 'General case' 1 N--CA 1.543 4.192 0 C-N-CA 124.253 1.021 . . . . 0.0 109.182 174.125 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.507 HD22 ' N ' ' A' ' 20' ' ' LEU . 2.9 mm? -90.34 -25.95 20.2 Favored 'General case' 0 N--CA 1.526 3.345 0 CA-C-O 117.852 -1.07 . . . . 0.0 111.089 -178.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.2 mtt-85 -53.69 -28.34 33.16 Favored 'General case' 1 N--CA 1.539 4.002 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 173.223 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.614 ' HB2' HG21 ' B' ' 555' ' ' VAL . 47.7 t80 -87.11 -39.04 15.92 Favored 'General case' 0 N--CA 1.501 2.125 0 CA-C-O 115.907 -1.997 . . . . 0.0 109.276 172.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 91.1 t -66.15 -58.26 7.36 Favored 'Isoleucine or valine' 1 N--CA 1.577 5.905 0 CA-C-N 122.462 2.392 . . . . 0.0 112.704 -177.182 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -55.7 -45.84 77.79 Favored 'General case' 1 N--CA 1.548 4.451 0 CA-C-N 119.957 1.253 . . . . 0.0 110.914 -177.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.7 mp -71.71 -24.34 61.79 Favored 'General case' 0 N--CA 1.531 3.603 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.23 177.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.501 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -66.85 -33.5 75.75 Favored 'General case' 0 N--CA 1.519 3.016 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 176.172 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -65.33 -26.91 68.25 Favored 'General case' 0 N--CA 1.518 2.956 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.679 177.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -69.7 -39.71 76.74 Favored 'General case' 0 N--CA 1.53 3.54 0 CA-C-N 119.167 0.894 . . . . 0.0 109.031 177.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.582 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -84.41 -8.9 58.83 Favored 'General case' 0 N--CA 1.504 2.232 0 CA-C-O 118.489 -0.767 . . . . 0.0 110.633 177.485 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -80.63 -32.79 36.17 Favored 'General case' 0 N--CA 1.529 3.522 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 176.293 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -56.02 -46.49 78.78 Favored 'General case' 0 N--CA 1.533 3.679 0 C-N-CA 124.2 1.0 . . . . 0.0 108.591 176.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -96.26 -83.48 0.37 Allowed 'General case' 0 N--CA 1.517 2.922 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 178.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p30 150.32 49.7 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.888 0 C-N-CA 127.875 2.47 . . . . 0.0 108.045 177.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.581 HD22 ' CD2' ' B' ' 596' ' ' LEU . 11.5 mt -103.16 9.49 38.28 Favored 'General case' 0 N--CA 1.526 3.326 0 C-N-CA 124.099 0.96 . . . . 0.0 111.156 -178.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.483 ' HA ' ' HB2' ' A' ' 38' ' ' LEU . 48.5 p-80 -81.17 3.86 22.18 Favored 'General case' 0 N--CA 1.513 2.711 0 C-N-CA 123.224 0.61 . . . . 0.0 109.558 174.547 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.513 HD23 HD12 ' A' ' 39' ' ' LEU . 17.7 mt -95.84 -49.94 0.24 Allowed Pre-proline 0 N--CA 1.512 2.649 0 C-N-CA 125.374 1.47 . . . . 0.0 109.373 -175.327 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.433 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 7.0 Cg_exo -62.87 -37.97 51.14 Favored 'Trans proline' 0 N--CA 1.513 2.638 0 N-CA-C 105.703 -2.46 . . . . 0.0 105.703 169.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.483 ' HB2' ' HA ' ' A' ' 35' ' ' HIS . 0.9 OUTLIER -54.44 -44.36 72.41 Favored 'General case' 0 N--CA 1.536 3.874 0 C-N-CA 124.442 1.097 . . . . 0.0 109.38 174.151 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.739 HD11 ' CE2' ' B' ' 519' ' ' TRP . 0.4 OUTLIER -54.79 -52.77 61.61 Favored 'General case' 1 N--CA 1.561 5.087 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.626 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -58.48 -17.1 18.38 Favored 'General case' 1 N--CA 1.543 4.194 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -179.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.639 HD22 ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -107.27 -35.23 6.87 Favored 'General case' 0 N--CA 1.529 3.496 0 CA-C-O 117.738 -1.125 . . . . 0.0 112.971 -176.611 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.423 ' N ' HD13 ' A' ' 41' ' ' LEU . 18.0 ptp -125.48 21.87 7.77 Favored 'General case' 1 N--CA 1.549 4.485 0 CA-C-N 120.505 1.502 . . . . 0.0 112.641 -177.958 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -137.76 -68.75 0.46 Allowed 'General case' 0 N--CA 1.515 2.804 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.295 177.174 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.4 p 122.82 157.25 0.0 OUTLIER Pre-proline 1 N--CA 1.568 5.439 0 C-N-CA 128.528 2.731 . . . . 0.0 109.534 -179.526 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -67.28 -30.49 37.14 Favored 'Trans proline' 0 C--N 1.393 2.875 0 C-N-CA 122.316 2.011 . . . . 0.0 109.429 175.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -68.35 -27.07 65.93 Favored 'General case' 0 N--CA 1.531 3.575 0 CA-C-O 118.208 -0.901 . . . . 0.0 109.55 176.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -70.65 -30.47 67.1 Favored 'General case' 0 N--CA 1.52 3.069 0 CA-C-O 117.588 -1.196 . . . . 0.0 109.935 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 -85.76 -18.0 34.25 Favored 'General case' 0 N--CA 1.537 3.88 0 CA-C-N 119.617 1.098 . . . . 0.0 108.394 174.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -75.86 -22.91 55.72 Favored 'General case' 0 N--CA 1.523 3.179 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 172.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.79 -35.24 15.81 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 117.729 -1.129 . . . . 0.0 109.252 179.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.481 ' O ' HG23 ' A' ' 55' ' ' VAL . 31.2 tp -74.16 -20.0 60.37 Favored 'General case' 0 N--CA 1.534 3.741 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 172.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.405 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -67.95 -70.51 1.12 Allowed Glycine 0 N--CA 1.496 2.687 0 C-N-CA 125.161 1.363 . . . . 0.0 110.627 177.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.6 m -73.54 -25.43 60.39 Favored 'General case' 0 N--CA 1.531 3.607 0 CA-C-O 117.759 -1.115 . . . . 0.0 112.46 -178.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -69.62 -51.4 35.37 Favored 'General case' 0 N--CA 1.536 3.866 0 CA-C-N 120.269 1.395 . . . . 0.0 107.914 177.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.551 HG22 ' HE2' ' B' ' 542' ' ' MET . 21.5 t -61.82 -20.22 23.08 Favored 'Isoleucine or valine' 1 N--CA 1.543 4.199 0 O-C-N 120.977 -1.077 . . . . 0.0 109.402 175.13 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.5 mmm180 -74.55 -44.08 52.76 Favored 'General case' 0 N--CA 1.522 3.147 0 CA-C-O 117.098 -1.429 . . . . 0.0 112.082 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.417 HD13 ' N ' ' A' ' 58' ' ' VAL . 0.0 OUTLIER -74.15 -23.87 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.507 0 CA-C-N 121.942 2.155 . . . . 0.0 111.161 -179.866 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.417 ' N ' HD13 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -88.36 -50.56 13.4 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.107 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 -178.153 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -62.26 -25.46 67.85 Favored 'General case' 0 N--CA 1.532 3.653 0 CA-C-O 118.818 -0.611 . . . . 0.0 109.976 178.296 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -95.05 -21.39 18.6 Favored 'General case' 0 N--CA 1.524 3.258 0 CA-C-O 117.828 -1.082 . . . . 0.0 111.113 178.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -78.08 -46.14 21.61 Favored 'General case' 0 N--CA 1.533 3.678 0 CA-C-N 120.011 1.278 . . . . 0.0 108.026 178.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 30.9 mt -51.84 -26.32 9.7 Favored 'General case' 0 N--CA 1.539 3.987 0 C-N-CA 124.546 1.139 . . . . 0.0 112.203 178.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -90.23 -52.08 5.12 Favored 'General case' 0 N--CA 1.521 3.075 0 N-CA-C 107.397 -1.335 . . . . 0.0 107.397 178.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.1 94.41 0.26 Allowed Glycine 0 N--CA 1.514 3.854 0 CA-C-O 119.442 -0.643 . . . . 0.0 112.424 177.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -160.23 -59.05 0.06 Allowed 'General case' 0 N--CA 1.529 3.504 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 177.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 59.0 mtt -140.19 74.1 1.45 Allowed 'General case' 0 N--CA 1.526 3.351 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 178.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 8.4 t -136.08 -14.59 1.79 Allowed 'General case' 0 N--CA 1.525 3.296 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -176.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -106.7 -56.49 2.18 Favored 'General case' 0 N--CA 1.529 3.492 0 CA-C-N 120.284 1.402 . . . . 0.0 112.122 -176.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 1.9 ttm180 -102.57 -54.03 2.75 Favored 'General case' 0 N--CA 1.53 3.535 0 C-N-CA 123.294 0.638 . . . . 0.0 111.469 -176.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.39 -8.54 56.29 Favored 'General case' 0 N--CA 1.518 2.947 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -176.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.56 HD23 HG21 ' A' ' 82' ' ' ILE . 37.0 tp -80.91 -51.33 8.68 Favored 'General case' 0 N--CA 1.528 3.45 0 CA-C-O 117.6 -1.19 . . . . 0.0 113.061 -178.017 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.06 -31.85 0.14 Allowed 'General case' 1 N--CA 1.552 4.669 0 N-CA-C 115.038 1.496 . . . . 0.0 115.038 -176.937 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -72.78 -44.24 61.81 Favored 'General case' 0 N--CA 1.536 3.847 0 CA-C-N 119.18 0.9 . . . . 0.0 110.048 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -53.26 -50.14 65.44 Favored 'General case' 0 N--CA 1.529 3.504 0 C-N-CA 124.631 1.172 . . . . 0.0 112.903 -179.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 56.7 mt -110.54 -51.33 2.88 Favored 'General case' 0 N--CA 1.526 3.365 0 C-N-CA 122.973 0.509 . . . . 0.0 111.646 -177.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 117.59 17.94 5.44 Favored Glycine 1 N--CA 1.527 4.724 0 CA-C-O 118.095 -1.392 . . . . 0.0 111.867 -178.089 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -89.21 112.74 23.84 Favored 'General case' 0 N--CA 1.512 2.643 0 CA-C-N 119.594 1.697 . . . . 0.0 106.508 178.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -42.67 173.95 0.01 OUTLIER Glycine 1 N--CA 1.535 5.299 0 C-N-CA 125.25 1.405 . . . . 0.0 115.253 -177.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.8 mt -80.06 -17.29 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.707 0 CA-C-N 118.5 1.15 . . . . 0.0 107.984 177.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.86 -6.63 43.12 Favored 'General case' 0 N--CA 1.521 3.121 0 CA-C-O 117.403 -1.284 . . . . 0.0 111.223 174.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -104.17 -44.28 5.02 Favored 'General case' 0 N--CA 1.53 3.539 0 CA-C-N 120.77 1.623 . . . . 0.0 110.26 177.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.56 HG21 HD23 ' A' ' 71' ' ' LEU . 0.1 OUTLIER -72.23 -38.71 62.92 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.652 0 CA-C-N 119.307 0.958 . . . . 0.0 111.202 -177.771 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 44.3 p -82.15 -25.65 34.17 Favored 'General case' 0 N--CA 1.521 3.104 0 CA-C-O 118.865 -0.588 . . . . 0.0 109.917 178.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.9 ttp180 -67.71 -35.54 78.97 Favored 'General case' 1 N--CA 1.54 4.044 0 N-CA-C 107.319 -1.363 . . . . 0.0 107.319 173.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -69.94 -26.24 74.59 Favored Glycine 1 N--CA 1.516 4.025 0 CA-C-O 118.094 -1.392 . . . . 0.0 111.916 178.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 89.7 p -66.14 -25.5 67.0 Favored 'General case' 1 N--CA 1.543 4.222 0 CA-C-N 119.537 1.669 . . . . 0.0 110.754 178.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -54.81 -25.28 27.3 Favored 'General case' 1 N--CA 1.545 4.287 0 C-N-CA 123.281 0.632 . . . . 0.0 110.752 176.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.9 m -49.88 -42.85 48.74 Favored 'General case' 1 N--CA 1.547 4.382 0 C-N-CA 124.837 1.255 . . . . 0.0 111.467 178.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 37.8 mt -65.02 -41.98 94.8 Favored 'General case' 0 N--CA 1.519 2.99 0 C-N-CA 123.324 0.65 . . . . 0.0 110.259 178.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.11 0.06 55.88 Favored 'General case' 0 N--CA 1.532 3.643 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -179.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -113.18 -64.0 1.37 Allowed 'General case' 0 N--CA 1.518 2.958 0 CA-C-N 120.047 1.294 . . . . 0.0 111.741 -179.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -49.73 159.31 0.74 Allowed Pre-proline 1 N--CA 1.548 4.461 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -178.528 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.407 ' O ' ' HB2' ' A' ' 97' ' ' ARG . 39.8 Cg_endo -78.01 -179.31 5.33 Favored 'Trans proline' 0 C--N 1.384 2.427 0 C-N-CA 121.735 1.623 . . . . 0.0 110.248 177.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.1 t -98.75 -27.15 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.117 0 CA-C-O 117.545 -1.217 . . . . 0.0 111.69 -178.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -61.9 -43.51 98.69 Favored 'General case' 0 N--CA 1.518 2.936 0 CA-C-N 120.189 1.359 . . . . 0.0 110.459 -178.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.423 ' CD2' HD22 ' B' ' 534' ' ' LEU . 6.9 mp -98.57 -16.07 19.26 Favored 'General case' 0 N--CA 1.509 2.52 0 CA-C-O 118.676 -0.678 . . . . 0.0 112.149 179.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -67.76 -29.65 68.91 Favored 'General case' 0 N--CA 1.538 3.948 0 N-CA-C 103.591 -2.744 . . . . 0.0 103.591 168.51 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -55.24 -39.1 69.34 Favored 'General case' 0 N--CA 1.518 2.971 0 C-N-CA 123.892 0.877 . . . . 0.0 110.259 174.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.632 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 54.9 t90 -66.22 -34.67 78.53 Favored 'General case' 0 N--CA 1.528 3.462 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 177.246 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.1 -35.29 59.46 Favored 'General case' 0 N--CA 1.537 3.916 0 CA-C-N 118.923 0.783 . . . . 0.0 108.905 175.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -71.76 -37.12 70.56 Favored 'General case' 1 N--CA 1.539 4.002 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 175.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.451 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 3.0 mt-10 -60.51 -22.27 63.38 Favored 'General case' 1 N--CA 1.544 4.251 0 C-N-CA 123.607 0.763 . . . . 0.0 110.636 175.047 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.517 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -118.05 6.46 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.514 0 CA-C-O 118.744 -0.646 . . . . 0.0 112.215 -177.017 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.2 mt -111.67 -62.05 1.61 Allowed 'General case' 0 N--CA 1.525 3.281 0 N-CA-C 105.793 -1.929 . . . . 0.0 105.793 175.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.0 tt . . . . . 1 N--CA 1.54 4.049 0 C-N-CA 125.572 1.549 . . . . 0.0 112.287 -179.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 . . . . . 0 N--CA 1.521 3.091 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 519' ' ' TRP . . . . . 0.739 ' CE2' HD11 ' A' ' 39' ' ' LEU . 64.2 t-105 -42.43 -29.54 0.28 Allowed 'General case' 1 N--CA 1.549 4.482 0 C-N-CA 123.954 0.901 . . . . 0.0 113.335 179.166 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 520' ' ' LEU . . . . . 0.55 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.2 mm? -93.98 -31.64 14.18 Favored 'General case' 0 N--CA 1.524 3.274 0 CA-C-O 117.696 -1.145 . . . . 0.0 113.879 -172.197 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 54.3 mtt-85 -61.7 -25.76 67.62 Favored 'General case' 1 N--CA 1.546 4.361 0 N-CA-C 105.729 -1.952 . . . . 0.0 105.729 171.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . 0.53 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 2.0 m-85 -76.24 -43.24 42.97 Favored 'General case' 0 N--CA 1.511 2.602 0 CA-C-O 117.287 -1.34 . . . . 0.0 107.401 173.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 523' ' ' VAL . . . . . 0.451 HG23 ' O ' ' B' ' 519' ' ' TRP . 54.1 t -65.82 -17.29 21.95 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.24 0 CA-C-O 117.717 -1.135 . . . . 0.0 112.246 179.549 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -77.62 -52.59 8.77 Favored 'General case' 0 N--CA 1.527 3.419 0 CA-C-N 120.396 1.453 . . . . 0.0 107.885 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . 0.509 HD23 ' HB ' ' A' ' 103' ' ' VAL . 5.1 mp -75.35 -14.6 60.49 Favored 'General case' 0 N--CA 1.53 3.547 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 175.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.23 -35.92 68.97 Favored 'General case' 0 N--CA 1.521 3.102 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 174.153 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 30.7 ttmt -68.73 -21.96 64.36 Favored 'General case' 0 N--CA 1.512 2.644 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.633 176.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -67.55 -40.17 84.96 Favored 'General case' 0 N--CA 1.535 3.82 0 CA-C-N 119.365 0.984 . . . . 0.0 108.465 176.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 529' ' ' ALA . . . . . 0.632 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -90.22 -13.46 35.41 Favored 'General case' 0 N--CA 1.504 2.24 0 CA-C-O 117.968 -1.015 . . . . 0.0 111.637 178.71 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.29 -28.64 42.25 Favored 'General case' 0 N--CA 1.537 3.908 0 CA-C-N 120.787 1.63 . . . . 0.0 107.461 177.478 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -61.7 -47.77 83.81 Favored 'General case' 0 N--CA 1.527 3.415 0 C-N-CA 124.421 1.089 . . . . 0.0 108.425 176.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -91.4 -85.33 0.24 Allowed 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 177.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.8 p30 152.58 51.76 0.0 OUTLIER 'General case' 1 N--CA 1.555 4.825 0 C-N-CA 127.339 2.256 . . . . 0.0 108.263 176.456 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 534' ' ' LEU . . . . . 0.423 HD22 ' CD2' ' A' ' 96' ' ' LEU . 7.0 mt -109.89 12.16 23.95 Favored 'General case' 0 N--CA 1.519 2.997 0 C-N-CA 125.249 1.42 . . . . 0.0 109.924 -179.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 535' ' ' HIS . . . . . 0.493 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 24.6 p-80 -86.38 9.09 19.08 Favored 'General case' 0 N--CA 1.516 2.871 0 C-N-CA 124.146 0.979 . . . . 0.0 108.873 175.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 536' ' ' LEU . . . . . 0.526 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 20.3 mt -97.05 -52.04 0.22 Allowed Pre-proline 0 N--CA 1.502 2.173 0 CA-C-O 116.589 -1.672 . . . . 0.0 107.794 -176.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 537' ' ' PRO . . . . . 0.526 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 2.7 Cg_exo -65.8 -34.1 41.22 Favored 'Trans proline' 0 C--N 1.401 3.308 0 N-CA-C 106.693 -2.08 . . . . 0.0 106.693 170.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.47 -51.68 68.83 Favored 'General case' 0 N--CA 1.523 3.211 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 174.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 40.1 mt -77.45 -6.81 54.79 Favored 'General case' 0 N--CA 1.535 3.811 0 CA-C-O 118.441 -0.79 . . . . 0.0 112.599 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -75.36 -22.67 57.36 Favored 'General case' 0 N--CA 1.518 2.963 0 CA-C-O 117.601 -1.19 . . . . 0.0 111.576 179.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 541' ' ' LEU . . . . . 0.408 HD13 ' O ' ' B' ' 541' ' ' LEU . 0.2 OUTLIER -127.58 -27.47 2.86 Favored 'General case' 0 N--CA 1.524 3.256 0 CA-C-O 117.214 -1.374 . . . . 0.0 113.648 -179.839 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 542' ' ' MET . . . . . 0.551 ' HE2' HG22 ' A' ' 55' ' ' VAL . 2.2 ptp -79.77 9.68 4.92 Favored 'General case' 1 N--CA 1.543 4.221 0 CA-C-N 121.663 2.028 . . . . 0.0 110.583 177.42 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 1.6 tp -132.78 -89.36 0.42 Allowed 'General case' 0 N--CA 1.519 2.985 0 CA-C-N 120.183 1.356 . . . . 0.0 111.823 178.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 162.56 175.45 0.04 OUTLIER Pre-proline 1 N--CA 1.578 5.967 0 C-N-CA 125.12 1.368 . . . . 0.0 109.971 -177.682 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -64.73 -21.45 64.93 Favored 'Trans proline' 0 N--CA 1.527 3.475 0 C-N-CA 122.25 1.967 . . . . 0.0 109.834 173.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -72.29 8.87 1.17 Allowed 'General case' 0 N--CA 1.517 2.908 0 C-N-CA 123.38 0.672 . . . . 0.0 110.728 175.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.6 -57.91 3.96 Favored 'General case' 0 N--CA 1.51 2.568 0 CA-C-O 117.493 -1.241 . . . . 0.0 108.326 178.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 -93.65 -5.98 47.42 Favored 'General case' 0 N--CA 1.527 3.422 0 CA-C-N 120.303 1.41 . . . . 0.0 111.507 175.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -74.35 -45.89 44.2 Favored 'General case' 0 N--CA 1.535 3.777 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 173.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -90.34 -23.33 21.16 Favored 'General case' 0 N--CA 1.521 3.108 0 CA-C-O 117.652 -1.166 . . . . 0.0 112.363 179.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 551' ' ' LEU . . . . . 0.423 HD23 ' CE3' ' A' ' 19' ' ' TRP . 17.4 tp -80.86 -33.28 34.6 Favored 'General case' 1 N--CA 1.54 4.071 0 CA-C-N 120.657 1.571 . . . . 0.0 107.707 176.539 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -73.49 -52.76 8.11 Favored Glycine 0 N--CA 1.496 2.676 0 N-CA-C 109.905 -1.278 . . . . 0.0 109.905 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 1.8 m -71.97 -33.8 68.45 Favored 'General case' 0 N--CA 1.536 3.873 0 CA-C-N 118.415 1.108 . . . . 0.0 112.574 -177.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -67.23 -52.64 38.54 Favored 'General case' 1 N--CA 1.54 4.052 0 N-CA-C 106.916 -1.512 . . . . 0.0 106.916 176.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 555' ' ' VAL . . . . . 0.614 HG21 ' HB2' ' A' ' 22' ' ' PHE . 42.8 t -61.25 -18.43 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.66 0 CA-C-O 117.938 -1.03 . . . . 0.0 110.485 177.406 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 -79.25 -42.21 26.41 Favored 'General case' 0 N--CA 1.525 3.291 0 CA-C-O 116.869 -1.539 . . . . 0.0 111.152 177.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 557' ' ' ILE . . . . . 0.537 ' HB ' HG22 ' B' ' 582' ' ' ILE . 0.0 OUTLIER -71.83 -22.04 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.946 0 CA-C-N 122.178 2.263 . . . . 0.0 110.742 179.911 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 558' ' ' VAL . . . . . 0.542 ' CG1' HD21 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -87.14 -52.1 12.06 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.746 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 -178.784 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -67.1 -17.0 64.68 Favored 'General case' 0 N--CA 1.523 3.188 0 CA-C-O 118.599 -0.715 . . . . 0.0 110.975 178.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -96.97 -23.9 16.07 Favored 'General case' 0 N--CA 1.528 3.445 0 CA-C-O 118.277 -0.868 . . . . 0.0 109.946 176.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 21.2 tp -78.47 -56.66 4.27 Favored 'General case' 0 N--CA 1.534 3.742 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 178.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 6.7 tp -45.18 -30.11 1.1 Allowed 'General case' 0 N--CA 1.537 3.914 0 C-N-CA 125.196 1.398 . . . . 0.0 112.82 -179.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.14 -50.22 7.59 Favored 'General case' 0 N--CA 1.527 3.392 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 177.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 77.7 94.55 0.24 Allowed Glycine 0 N--CA 1.514 3.862 0 CA-C-O 119.616 -0.547 . . . . 0.0 113.51 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -165.86 -57.95 0.03 OUTLIER 'General case' 0 N--CA 1.531 3.608 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 177.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 47.4 mtt -131.18 69.9 1.47 Allowed 'General case' 0 N--CA 1.519 3.0 0 N-CA-C 106.564 -1.643 . . . . 0.0 106.564 178.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 567' ' ' SER . . . . . 0.43 ' HA ' HD22 ' B' ' 571' ' ' LEU . 6.1 t -126.25 -8.52 6.44 Favored 'General case' 0 N--CA 1.523 3.209 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -177.071 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -113.47 -70.67 0.79 Allowed 'General case' 0 N--CA 1.526 3.366 0 CA-C-N 120.042 1.292 . . . . 0.0 111.843 -178.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 24.0 mtt180 -91.43 -52.37 4.82 Favored 'General case' 0 N--CA 1.53 3.532 0 CA-C-N 118.853 0.751 . . . . 0.0 110.38 -178.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -68.68 -12.16 61.05 Favored 'General case' 0 N--CA 1.519 3.0 0 CA-C-O 118.183 -0.913 . . . . 0.0 112.613 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 571' ' ' LEU . . . . . 0.598 HD23 HG21 ' B' ' 582' ' ' ILE . 24.2 tp -80.72 -54.72 5.38 Favored 'General case' 0 N--CA 1.517 2.912 0 CA-C-N 119.554 1.07 . . . . 0.0 109.798 179.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -45.88 -32.35 2.6 Favored 'General case' 1 N--CA 1.545 4.281 0 CA-C-N 119.229 0.922 . . . . 0.0 112.507 -179.716 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -72.65 -42.12 64.72 Favored 'General case' 0 N--CA 1.534 3.757 0 C-N-CA 122.988 0.515 . . . . 0.0 110.61 -179.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -43.97 -56.57 3.86 Favored 'General case' 1 N--CA 1.539 4.002 0 C-N-CA 125.137 1.375 . . . . 0.0 113.568 -179.165 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -137.43 -41.74 0.56 Allowed 'General case' 0 N--CA 1.528 3.447 0 CA-C-O 118.814 -0.612 . . . . 0.0 111.579 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 125.66 98.78 1.15 Allowed Glycine 1 N--CA 1.517 4.047 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -126.72 -47.34 1.54 Allowed 'General case' 0 N--CA 1.525 3.311 0 C-N-CA 123.529 0.732 . . . . 0.0 109.44 178.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 108.14 161.05 20.65 Favored Glycine 1 N--CA 1.519 4.22 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -178.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.01 -18.0 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.861 0 CA-C-N 119.219 1.51 . . . . 0.0 108.062 177.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -71.01 -38.33 72.63 Favored 'General case' 0 N--CA 1.522 3.149 0 CA-C-N 119.843 1.201 . . . . 0.0 110.301 177.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 4.2 p -78.07 -46.86 19.7 Favored 'General case' 0 N--CA 1.536 3.855 0 CA-C-N 119.689 1.131 . . . . 0.0 111.659 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 582' ' ' ILE . . . . . 0.598 HG21 HD23 ' B' ' 571' ' ' LEU . 1.4 pt -68.49 -22.36 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.932 0 CA-C-O 117.854 -1.07 . . . . 0.0 113.289 -177.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 31.0 p -108.74 -21.55 12.63 Favored 'General case' 0 N--CA 1.521 3.095 0 CA-C-N 119.728 1.149 . . . . 0.0 111.95 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 11.3 ptt180 -82.75 -21.55 34.65 Favored 'General case' 0 N--CA 1.531 3.592 0 CA-C-N 119.98 1.264 . . . . 0.0 107.875 173.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -67.66 -31.87 77.09 Favored Glycine 0 N--CA 1.514 3.853 0 N-CA-C 109.703 -1.359 . . . . 0.0 109.703 176.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 88.2 p -65.92 -34.83 79.01 Favored 'General case' 1 N--CA 1.54 4.044 0 CA-C-N 118.537 1.168 . . . . 0.0 110.053 177.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -58.06 -29.04 65.08 Favored 'General case' 1 N--CA 1.539 4.01 0 C-N-CA 123.888 0.875 . . . . 0.0 111.306 178.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.31 -35.43 80.99 Favored 'General case' 0 N--CA 1.537 3.917 0 C-N-CA 123.26 0.624 . . . . 0.0 110.507 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 23.6 mt -73.14 -45.76 54.86 Favored 'General case' 0 N--CA 1.518 2.954 0 C-N-CA 123.651 0.78 . . . . 0.0 110.699 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.46 -30.71 31.19 Favored 'General case' 1 N--CA 1.552 4.631 0 C-N-CA 123.672 0.789 . . . . 0.0 112.351 -179.608 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -96.61 -35.22 11.13 Favored 'General case' 0 N--CA 1.519 3.013 0 C-N-CA 123.301 0.64 . . . . 0.0 111.259 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . 0.403 ' HB1' ' HD2' ' B' ' 593' ' ' PRO . . . -51.72 164.32 0.55 Allowed Pre-proline 1 N--CA 1.543 4.191 0 CA-C-O 118.197 -0.906 . . . . 0.0 112.941 -179.818 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 593' ' ' PRO . . . . . 0.403 ' HD2' ' HB1' ' B' ' 592' ' ' ALA . 38.4 Cg_endo -76.09 147.64 30.27 Favored 'Trans proline' 0 C--N 1.38 2.212 0 C-N-CA 121.873 1.715 . . . . 0.0 110.028 178.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.7 t -84.6 -26.24 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.745 0 CA-C-O 117.442 -1.266 . . . . 0.0 112.016 -178.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -65.17 -35.6 81.6 Favored 'General case' 0 N--CA 1.518 2.925 0 CA-C-N 120.282 1.401 . . . . 0.0 110.596 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 596' ' ' LEU . . . . . 0.581 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.8 mp -97.75 -21.23 17.09 Favored 'General case' 0 N--CA 1.517 2.879 0 C-N-CA 123.929 0.892 . . . . 0.0 110.423 178.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.51 -35.36 77.49 Favored 'General case' 1 N--CA 1.55 4.527 0 N-CA-C 103.764 -2.68 . . . . 0.0 103.764 168.503 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -57.36 -40.46 78.13 Favored 'General case' 0 N--CA 1.52 3.046 0 C-N-CA 125.358 1.463 . . . . 0.0 111.278 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 599' ' ' TRP . . . . . 0.582 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 57.5 t90 -57.97 -34.44 69.94 Favored 'General case' 1 N--CA 1.54 4.064 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 179.387 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 54.1 mt -53.68 -42.38 67.88 Favored 'General case' 0 N--CA 1.538 3.962 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 176.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -68.07 -33.76 75.16 Favored 'General case' 0 N--CA 1.53 3.545 0 O-C-N 123.802 0.689 . . . . 0.0 109.42 176.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 602' ' ' GLU . . . . . 0.418 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.6 OUTLIER -61.29 -25.02 66.83 Favored 'General case' 1 N--CA 1.542 4.149 0 C-N-CA 123.362 0.665 . . . . 0.0 110.148 175.27 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' B' B ' 603' ' ' VAL . . . . . 0.546 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.2 OUTLIER -120.59 7.61 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.463 0 C-N-CA 123.747 0.819 . . . . 0.0 112.772 -177.003 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.73 -57.06 1.92 Allowed 'General case' 0 N--CA 1.512 2.643 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 178.075 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.533 3.677 0 C-N-CA 124.869 1.268 . . . . 0.0 113.51 -177.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 . . . . . 0 N--CA 1.526 3.375 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.683 ' CZ3' HD22 ' B' ' 551' ' ' LEU . 76.7 t-105 -51.35 -39.96 58.14 Favored 'General case' 1 N--CA 1.541 4.085 0 C-N-CA 123.034 0.534 . . . . 0.0 109.664 176.376 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.482 HD22 ' N ' ' A' ' 20' ' ' LEU . 2.6 mm? -81.5 -26.91 34.77 Favored 'General case' 0 N--CA 1.519 2.987 0 O-C-N 124.699 1.249 . . . . 0.0 111.633 -176.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.0 ttm180 -56.27 -29.17 60.75 Favored 'General case' 0 N--CA 1.539 3.982 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 173.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.561 ' CG ' HD21 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -86.03 -36.47 19.71 Favored 'General case' 0 N--CA 1.508 2.441 0 CA-C-O 116.218 -1.849 . . . . 0.0 108.784 173.6 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.5 t -68.73 -26.0 31.89 Favored 'Isoleucine or valine' 1 N--CA 1.571 5.606 0 CA-C-N 121.364 1.893 . . . . 0.0 112.645 -176.332 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -76.1 -50.32 15.0 Favored 'General case' 0 N--CA 1.534 3.737 0 CA-C-N 120.017 1.281 . . . . 0.0 107.588 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.7 mp -70.79 -16.46 62.74 Favored 'General case' 0 N--CA 1.527 3.386 0 O-C-N 123.428 0.455 . . . . 0.0 110.013 175.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -72.16 -36.7 69.37 Favored 'General case' 0 N--CA 1.519 2.997 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 175.762 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.451 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 22.1 tttt -66.02 -20.87 66.33 Favored 'General case' 0 N--CA 1.518 2.939 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.658 176.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -71.75 -40.97 68.99 Favored 'General case' 0 N--CA 1.529 3.485 0 CA-C-N 119.275 0.943 . . . . 0.0 108.722 176.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.604 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -87.89 -8.75 55.36 Favored 'General case' 0 N--CA 1.507 2.382 0 CA-C-O 118.566 -0.73 . . . . 0.0 110.699 177.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.451 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -83.02 -28.51 29.59 Favored 'General case' 0 N--CA 1.532 3.64 0 CA-C-N 120.017 1.28 . . . . 0.0 107.768 177.994 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -64.13 -45.59 87.88 Favored 'General case' 0 N--CA 1.525 3.298 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 176.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -93.31 -89.64 0.2 Allowed 'General case' 0 N--CA 1.513 2.677 0 N-CA-C 106.434 -1.691 . . . . 0.0 106.434 176.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 p30 156.36 51.27 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.918 0 C-N-CA 126.825 2.05 . . . . 0.0 107.877 177.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.574 HD22 ' CD2' ' B' ' 596' ' ' LEU . 8.8 mt -109.88 12.44 23.87 Favored 'General case' 0 N--CA 1.525 3.289 0 C-N-CA 124.388 1.075 . . . . 0.0 110.669 -178.501 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.52 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 39.2 p-80 -81.86 2.59 29.65 Favored 'General case' 0 N--CA 1.516 2.841 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 174.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.479 HD23 HD12 ' A' ' 39' ' ' LEU . 22.6 mt -95.84 -51.11 0.24 Allowed Pre-proline 0 N--CA 1.508 2.43 0 CA-C-O 117.212 -1.375 . . . . 0.0 109.638 -175.538 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.445 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 4.8 Cg_exo -65.82 -35.23 36.87 Favored 'Trans proline' 0 CA--C 1.574 2.485 0 N-CA-C 105.975 -2.356 . . . . 0.0 105.975 170.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.52 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 1.9 tm? -59.64 -38.34 81.14 Favored 'General case' 0 N--CA 1.521 3.109 0 C-N-CA 124.149 0.98 . . . . 0.0 108.946 175.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.698 HD21 ' CZ2' ' B' ' 519' ' ' TRP . 2.1 mt -59.95 -44.67 94.26 Favored 'General case' 1 N--CA 1.559 5.005 0 CA-C-N 119.236 0.926 . . . . 0.0 108.903 177.108 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -61.71 -17.75 56.95 Favored 'General case' 1 N--CA 1.542 4.148 0 CA-C-O 118.642 -0.694 . . . . 0.0 112.834 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.496 HD11 HG11 ' B' ' 558' ' ' VAL . 0.7 OUTLIER -97.61 -50.52 4.46 Favored 'General case' 0 N--CA 1.525 3.289 0 CA-C-O 118.067 -0.968 . . . . 0.0 113.115 -177.335 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.415 ' N ' HD13 ' A' ' 41' ' ' LEU . 2.9 ptt? -115.36 18.68 15.95 Favored 'General case' 1 N--CA 1.556 4.851 0 CA-C-N 119.829 1.195 . . . . 0.0 113.792 -175.935 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.495 ' O ' HG23 ' A' ' 44' ' ' THR . 4.8 tp -130.44 -80.78 0.54 Allowed 'General case' 0 N--CA 1.52 3.071 0 CA-C-O 117.481 -1.247 . . . . 0.0 110.233 176.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.495 HG23 ' O ' ' A' ' 43' ' ' LEU . 4.6 p 140.73 156.47 0.0 OUTLIER Pre-proline 1 N--CA 1.57 5.538 0 C-N-CA 127.178 2.191 . . . . 0.0 109.271 179.583 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -67.13 -37.84 17.54 Favored 'Trans proline' 0 N--CA 1.517 2.893 0 C-N-CA 123.167 2.578 . . . . 0.0 110.627 177.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -64.02 -21.98 66.73 Favored 'General case' 0 N--CA 1.532 3.651 0 CA-C-O 118.666 -0.683 . . . . 0.0 110.755 178.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -73.39 -28.97 62.3 Favored 'General case' 0 N--CA 1.52 3.045 0 CA-C-O 117.368 -1.301 . . . . 0.0 110.513 179.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 24.1 ptt180 -83.34 -24.55 32.05 Favored 'General case' 0 N--CA 1.537 3.907 0 CA-C-N 120.175 1.352 . . . . 0.0 107.703 174.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -67.58 -26.41 66.27 Favored 'General case' 1 N--CA 1.542 4.17 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 172.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -92.53 -28.74 16.59 Favored 'General case' 0 N--CA 1.511 2.592 0 C-N-CA 124.809 1.244 . . . . 0.0 111.316 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.457 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 34.8 tp -78.08 -20.05 53.03 Favored 'General case' 0 N--CA 1.537 3.894 0 N-CA-C 105.501 -2.037 . . . . 0.0 105.501 172.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.431 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -69.97 -70.96 1.07 Allowed Glycine 0 C--N 1.374 2.686 0 C-N-CA 125.311 1.434 . . . . 0.0 109.557 177.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.6 m -66.18 -25.35 66.9 Favored 'General case' 0 N--CA 1.531 3.607 0 CA-C-O 117.744 -1.122 . . . . 0.0 112.85 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -70.77 -52.07 23.02 Favored 'General case' 0 N--CA 1.534 3.754 0 CA-C-N 120.063 1.302 . . . . 0.0 108.417 177.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 23.0 t -64.42 -16.19 18.85 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.171 0 O-C-N 120.871 -1.143 . . . . 0.0 109.61 175.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -76.75 -46.46 25.17 Favored 'General case' 0 N--CA 1.523 3.199 0 CA-C-N 120.001 1.273 . . . . 0.0 111.793 178.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.451 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -72.58 -23.26 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.41 0 CA-C-N 120.843 1.656 . . . . 0.0 111.297 -179.216 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -88.69 -52.53 10.94 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.846 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -58.02 -24.67 59.22 Favored 'General case' 1 N--CA 1.54 4.034 0 CA-C-O 118.871 -0.585 . . . . 0.0 110.138 178.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -88.35 -32.25 18.5 Favored 'General case' 0 N--CA 1.519 3.009 0 CA-C-O 118.345 -0.836 . . . . 0.0 109.555 177.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 16.8 tp -64.09 -58.24 7.24 Favored 'General case' 0 N--CA 1.539 4.0 0 CA-C-N 119.3 0.955 . . . . 0.0 110.463 -179.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 33.1 mt -49.17 -26.7 3.0 Favored 'General case' 1 N--CA 1.542 4.132 0 C-N-CA 123.72 0.808 . . . . 0.0 112.891 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 26.9 mmm180 -88.01 -42.32 12.52 Favored 'General case' 0 N--CA 1.527 3.421 0 CA-C-N 118.474 0.579 . . . . 0.0 110.216 -179.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 67.17 88.09 0.07 OUTLIER Glycine 1 N--CA 1.525 4.602 0 CA-C-O 119.134 -0.814 . . . . 0.0 111.703 178.687 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -160.45 -54.24 0.05 Allowed 'General case' 0 N--CA 1.53 3.563 0 CA-C-N 117.714 0.757 . . . . 0.0 110.468 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 9.0 ptt? -142.32 73.76 1.42 Allowed 'General case' 0 N--CA 1.531 3.622 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.434 ' HA ' HD22 ' A' ' 71' ' ' LEU . 18.1 m -133.38 -13.94 2.62 Favored 'General case' 0 N--CA 1.522 3.126 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 -173.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -111.98 -67.82 0.97 Allowed 'General case' 0 N--CA 1.529 3.482 0 CA-C-N 120.179 1.354 . . . . 0.0 112.776 -177.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 11.0 mtt180 -94.94 -47.1 6.57 Favored 'General case' 0 N--CA 1.532 3.642 0 CA-C-N 118.83 0.741 . . . . 0.0 111.097 -177.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -72.95 -12.17 60.85 Favored 'General case' 0 N--CA 1.517 2.906 0 CA-C-O 118.438 -0.792 . . . . 0.0 112.759 -179.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.608 HD23 HG21 ' A' ' 82' ' ' ILE . 26.0 tp -80.21 -54.54 5.65 Favored 'General case' 0 N--CA 1.527 3.401 0 CA-C-O 117.735 -1.126 . . . . 0.0 113.429 -177.287 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -40.11 -48.7 2.53 Favored 'General case' 1 N--CA 1.558 4.94 0 CA-C-N 119.943 1.247 . . . . 0.0 114.162 -177.39 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -68.88 -34.88 76.16 Favored 'General case' 0 N--CA 1.535 3.782 0 CA-C-O 118.967 -0.54 . . . . 0.0 112.154 -177.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -53.12 -52.67 57.94 Favored 'General case' 0 N--CA 1.534 3.753 0 C-N-CA 124.196 0.998 . . . . 0.0 113.023 -178.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.9 pp -121.6 -41.45 2.48 Favored 'General case' 0 N--CA 1.534 3.733 0 CA-C-O 118.895 -0.574 . . . . 0.0 111.326 -178.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 122.25 64.55 0.22 Allowed Glycine 1 N--CA 1.523 4.463 0 N-CA-C 110.81 -0.916 . . . . 0.0 110.81 179.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -133.3 109.6 9.49 Favored 'General case' 0 N--CA 1.518 2.957 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 178.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -45.14 171.61 0.01 OUTLIER Glycine 1 N--CA 1.546 5.983 0 C-N-CA 124.448 1.023 . . . . 0.0 114.388 -177.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.6 mt -82.13 -14.35 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.666 0 CA-C-N 118.69 1.245 . . . . 0.0 108.9 178.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.03 -31.72 69.49 Favored 'General case' 0 N--CA 1.523 3.188 0 CA-C-N 119.821 1.191 . . . . 0.0 110.675 176.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.3 p -83.51 -42.61 16.67 Favored 'General case' 1 N--CA 1.541 4.115 0 CA-C-N 119.926 1.239 . . . . 0.0 111.636 -179.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.608 HG21 HD23 ' A' ' 71' ' ' LEU . 0.7 OUTLIER -70.61 -23.42 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.873 0 CA-C-O 118.043 -0.98 . . . . 0.0 112.587 -178.18 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 70.8 p -105.5 -25.32 12.37 Favored 'General case' 0 N--CA 1.517 2.901 0 CA-C-N 119.605 1.093 . . . . 0.0 111.321 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.9 ptt180 -79.11 -22.51 45.1 Favored 'General case' 0 N--CA 1.535 3.811 0 CA-C-N 120.105 1.321 . . . . 0.0 108.116 174.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.49 -32.29 82.91 Favored Glycine 1 N--CA 1.516 4.005 0 N-CA-C 110.009 -1.237 . . . . 0.0 110.009 176.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 60.2 p -68.07 -32.3 72.54 Favored 'General case' 0 N--CA 1.537 3.91 0 CA-C-N 118.577 1.189 . . . . 0.0 110.031 177.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -60.15 -30.66 69.45 Favored 'General case' 1 N--CA 1.541 4.093 0 C-N-CA 123.726 0.81 . . . . 0.0 111.132 178.224 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.432 ' HB3' ' HA ' ' B' ' 541' ' ' LEU . 18.4 m -61.04 -42.0 97.65 Favored 'General case' 0 N--CA 1.537 3.909 0 C-N-CA 123.813 0.845 . . . . 0.0 111.578 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 22.1 mt -57.54 -39.72 77.24 Favored 'General case' 0 N--CA 1.531 3.585 0 C-N-CA 124.064 0.946 . . . . 0.0 111.42 -179.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 12.1 mmpt? -59.3 -20.82 57.58 Favored 'General case' 1 N--CA 1.542 4.131 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -178.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -95.88 -48.15 5.85 Favored 'General case' 0 N--CA 1.52 3.044 0 CA-C-N 119.083 0.856 . . . . 0.0 111.864 -178.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.35 160.7 0.35 Allowed Pre-proline 1 N--CA 1.553 4.716 0 CA-C-O 118.14 -0.933 . . . . 0.0 113.486 -178.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -79.68 174.62 11.52 Favored 'Trans proline' 0 C--N 1.381 2.286 0 C-N-CA 121.661 1.574 . . . . 0.0 110.444 179.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -98.82 -28.65 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.972 0 CA-C-O 117.484 -1.246 . . . . 0.0 111.779 -178.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -63.64 -40.61 97.31 Favored 'General case' 0 N--CA 1.515 2.804 0 CA-C-N 119.966 1.257 . . . . 0.0 110.468 -178.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.467 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.5 mp -98.13 -18.29 18.58 Favored 'General case' 0 N--CA 1.512 2.641 0 C-N-CA 123.337 0.655 . . . . 0.0 111.517 178.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.53 -29.18 69.21 Favored 'General case' 1 N--CA 1.547 4.397 0 N-CA-C 103.293 -2.854 . . . . 0.0 103.293 169.029 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -57.36 -39.72 76.58 Favored 'General case' 0 N--CA 1.515 2.797 0 C-N-CA 124.29 1.036 . . . . 0.0 110.335 174.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.63 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 53.0 t90 -64.03 -34.98 79.25 Favored 'General case' 0 N--CA 1.533 3.701 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 177.018 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.78 -38.25 60.8 Favored 'General case' 1 N--CA 1.54 4.056 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 176.408 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -68.03 -38.69 82.85 Favored 'General case' 1 N--CA 1.54 4.062 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 175.772 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -61.58 -22.33 65.11 Favored 'General case' 1 N--CA 1.544 4.263 0 C-N-CA 123.45 0.7 . . . . 0.0 110.983 176.6 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.507 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -118.97 6.32 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.543 0 CA-C-N 118.481 0.582 . . . . 0.0 112.192 -177.785 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -108.27 -56.28 2.27 Favored 'General case' 0 N--CA 1.514 2.757 0 N-CA-C 106.028 -1.842 . . . . 0.0 106.028 176.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 35.2 mt . . . . . 1 N--CA 1.544 4.248 0 C-N-CA 125.708 1.603 . . . . 0.0 111.712 179.072 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 . . . . . 0 N--CA 1.525 3.295 0 CA-C-O 118.947 -0.549 . . . . 0.0 109.749 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 519' ' ' TRP . . . . . 0.698 ' CZ2' HD21 ' A' ' 39' ' ' LEU . 64.6 t-105 -40.64 -32.47 0.21 Allowed 'General case' 1 N--CA 1.548 4.449 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -179.297 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 520' ' ' LEU . . . . . 0.534 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.3 mm? -90.12 -31.06 17.26 Favored 'General case' 0 N--CA 1.525 3.298 0 CA-C-O 117.867 -1.063 . . . . 0.0 113.418 -172.601 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 31.6 ttt180 -61.51 -23.09 65.67 Favored 'General case' 1 N--CA 1.544 4.269 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 171.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . 0.546 ' O ' HD23 ' B' ' 526' ' ' LEU . 1.1 m-85 -82.02 -39.36 23.65 Favored 'General case' 0 N--CA 1.513 2.722 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 174.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 41.2 t -64.99 -22.45 31.46 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.228 0 CA-C-O 117.911 -1.042 . . . . 0.0 112.08 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -76.62 -52.8 9.01 Favored 'General case' 0 N--CA 1.534 3.761 0 CA-C-N 120.116 1.326 . . . . 0.0 107.963 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 7.4 mp -66.74 -21.64 66.06 Favored 'General case' 0 N--CA 1.533 3.722 0 CA-C-O 119.401 -0.333 . . . . 0.0 110.273 176.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 526' ' ' LEU . . . . . 0.546 HD23 ' O ' ' B' ' 522' ' ' PHE . 1.8 mm? -70.06 -37.16 75.44 Favored 'General case' 0 N--CA 1.52 3.036 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 176.419 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 10.3 ttmt -66.68 -24.56 66.28 Favored 'General case' 0 N--CA 1.517 2.888 0 CA-C-O 118.153 -0.927 . . . . 0.0 110.695 176.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -69.21 -38.2 78.46 Favored 'General case' 1 N--CA 1.541 4.08 0 CA-C-N 119.544 1.065 . . . . 0.0 109.017 176.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 529' ' ' ALA . . . . . 0.63 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -91.68 -9.02 45.4 Favored 'General case' 0 N--CA 1.499 1.983 0 CA-C-O 118.019 -0.991 . . . . 0.0 111.242 178.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -81.72 -30.79 32.39 Favored 'General case' 0 N--CA 1.53 3.549 0 CA-C-N 120.73 1.605 . . . . 0.0 108.595 179.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -61.53 -42.87 99.45 Favored 'General case' 0 N--CA 1.538 3.928 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 176.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -95.71 -86.72 0.3 Allowed 'General case' 0 N--CA 1.518 2.969 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 177.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.8 p30 151.26 52.87 0.0 OUTLIER 'General case' 1 N--CA 1.558 4.94 0 C-N-CA 127.755 2.422 . . . . 0.0 107.59 177.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 534' ' ' LEU . . . . . 0.467 HD22 ' CD2' ' A' ' 96' ' ' LEU . 6.2 mt -111.11 8.02 21.59 Favored 'General case' 0 N--CA 1.532 3.675 0 C-N-CA 124.161 0.985 . . . . 0.0 111.703 -178.226 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 535' ' ' HIS . . . . . 0.607 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 53.3 p-80 -81.98 -1.82 49.45 Favored 'General case' 0 N--CA 1.513 2.712 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 175.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 536' ' ' LEU . . . . . 0.442 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 46.3 mt -91.87 -50.32 0.31 Allowed Pre-proline 0 N--CA 1.507 2.388 0 CA-C-O 116.346 -1.787 . . . . 0.0 109.092 -176.446 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 537' ' ' PRO . . . . . 0.442 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 3.3 Cg_exo -64.48 -37.13 40.06 Favored 'Trans proline' 0 C--N 1.394 2.959 0 N-CA-C 107.225 -1.875 . . . . 0.0 107.225 171.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 538' ' ' LEU . . . . . 0.4 ' C ' HD13 ' B' ' 538' ' ' LEU . 0.2 OUTLIER -61.94 -41.3 97.8 Favored 'General case' 0 N--CA 1.527 3.394 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 175.39 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 8.1 mt -70.15 -24.11 63.11 Favored 'General case' 0 N--CA 1.536 3.84 0 CA-C-O 118.045 -0.979 . . . . 0.0 111.448 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -78.34 -6.76 56.07 Favored 'General case' 0 N--CA 1.526 3.365 0 CA-C-N 119.405 1.002 . . . . 0.0 110.645 178.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 541' ' ' LEU . . . . . 0.608 HD13 ' N ' ' B' ' 542' ' ' MET . 0.0 OUTLIER -106.67 -43.22 4.77 Favored 'General case' 0 N--CA 1.513 2.718 0 C-N-CA 124.159 0.984 . . . . 0.0 109.212 -179.587 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 542' ' ' MET . . . . . 0.608 ' N ' HD13 ' B' ' 541' ' ' LEU . 7.8 ptt? -94.84 -3.44 48.89 Favored 'General case' 0 N--CA 1.53 3.571 0 CA-C-O 117.78 -1.105 . . . . 0.0 112.728 -179.286 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.67 -108.17 0.3 Allowed 'General case' 0 N--CA 1.526 3.34 0 CA-C-N 120.386 1.448 . . . . 0.0 112.236 -177.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 3.9 t 157.07 140.2 0.0 OUTLIER Pre-proline 1 N--CA 1.567 5.406 0 C-N-CA 126.654 1.982 . . . . 0.0 108.332 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -52.27 -29.57 38.79 Favored 'Trans proline' 0 N--CA 1.524 3.276 0 C-N-CA 123.818 3.012 . . . . 0.0 115.891 -176.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -58.85 -31.48 68.56 Favored 'General case' 1 N--CA 1.545 4.285 0 CA-C-N 118.898 0.772 . . . . 0.0 112.514 -177.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.72 -31.28 63.3 Favored 'General case' 0 N--CA 1.524 3.239 0 CA-C-O 117.947 -1.025 . . . . 0.0 110.782 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -79.57 -20.18 47.62 Favored 'General case' 0 N--CA 1.527 3.41 0 CA-C-N 119.574 1.079 . . . . 0.0 110.633 177.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -70.07 -47.44 61.9 Favored 'General case' 0 N--CA 1.534 3.768 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 174.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -77.5 -11.67 59.88 Favored 'General case' 0 N--CA 1.512 2.664 0 CA-C-O 117.295 -1.335 . . . . 0.0 111.288 176.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 551' ' ' LEU . . . . . 0.683 HD22 ' CZ3' ' A' ' 19' ' ' TRP . 13.3 tp -81.5 -33.95 31.58 Favored 'General case' 0 N--CA 1.527 3.4 0 CA-C-N 120.722 1.601 . . . . 0.0 107.486 175.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -68.47 -52.45 26.1 Favored Glycine 0 N--CA 1.509 3.518 0 N-CA-C 108.732 -1.747 . . . . 0.0 108.732 178.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.9 m -67.34 -30.61 70.48 Favored 'General case' 0 N--CA 1.532 3.628 0 CA-C-O 118.205 -0.902 . . . . 0.0 111.891 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 11.5 mtm180 -67.49 -46.74 72.06 Favored 'General case' 1 N--CA 1.545 4.32 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 176.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 555' ' ' VAL . . . . . 0.411 HG23 ' O ' ' B' ' 551' ' ' LEU . 19.6 t -69.81 -15.64 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.681 0 CA-C-O 118.158 -0.925 . . . . 0.0 109.5 176.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 6.8 mtm-85 -80.04 -40.82 26.94 Favored 'General case' 0 N--CA 1.523 3.217 0 CA-C-O 117.583 -1.199 . . . . 0.0 111.202 178.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 557' ' ' ILE . . . . . 0.459 ' HB ' HG22 ' B' ' 582' ' ' ILE . 0.0 OUTLIER -74.36 -25.1 19.27 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.557 0 CA-C-N 121.115 1.78 . . . . 0.0 110.236 -179.547 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 558' ' ' VAL . . . . . 0.496 HG11 HD11 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -85.56 -50.92 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.928 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 179.74 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -58.8 -26.6 64.24 Favored 'General case' 0 N--CA 1.537 3.879 0 CA-C-O 118.985 -0.531 . . . . 0.0 110.377 178.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -95.03 -21.87 18.29 Favored 'General case' 0 N--CA 1.525 3.31 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.854 178.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 27.7 tp -71.44 -47.36 56.35 Favored 'General case' 0 N--CA 1.537 3.914 0 CA-C-N 119.751 1.16 . . . . 0.0 108.617 178.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 51.7 mt -59.26 -18.5 37.94 Favored 'General case' 0 N--CA 1.536 3.839 0 CA-C-O 118.143 -0.932 . . . . 0.0 113.157 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -94.21 -46.53 7.04 Favored 'General case' 0 N--CA 1.526 3.369 0 CA-C-N 119.359 0.982 . . . . 0.0 108.971 179.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 68.42 66.75 2.19 Favored Glycine 1 N--CA 1.52 4.262 0 CA-C-O 119.374 -0.681 . . . . 0.0 112.364 178.583 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -118.31 -59.56 1.88 Allowed 'General case' 0 N--CA 1.525 3.316 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 178.177 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 75.1 mtm -152.65 80.64 1.22 Allowed 'General case' 0 N--CA 1.522 3.138 0 N-CA-C 105.25 -2.13 . . . . 0.0 105.25 178.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 567' ' ' SER . . . . . 0.425 ' HA ' ' HB2' ' B' ' 571' ' ' LEU . 50.0 m -131.63 -9.0 3.62 Favored 'General case' 0 N--CA 1.524 3.248 0 N-CA-C 114.049 1.129 . . . . 0.0 114.049 -173.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -117.27 -56.15 2.26 Favored 'General case' 0 N--CA 1.526 3.325 0 CA-C-N 119.852 1.205 . . . . 0.0 110.989 -179.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -89.74 -62.8 1.39 Allowed 'General case' 0 N--CA 1.526 3.375 0 C-N-CA 122.661 0.385 . . . . 0.0 111.538 -178.071 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -80.59 -0.45 37.93 Favored 'General case' 0 N--CA 1.521 3.076 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -176.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 571' ' ' LEU . . . . . 0.601 HD23 HG21 ' B' ' 582' ' ' ILE . 21.4 tp -78.84 -45.81 20.01 Favored 'General case' 0 N--CA 1.526 3.337 0 CA-C-N 120.207 1.367 . . . . 0.0 110.398 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -45.81 -28.75 1.14 Allowed 'General case' 0 N--CA 1.534 3.771 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 -177.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -73.25 -41.33 63.82 Favored 'General case' 0 N--CA 1.532 3.666 0 CA-C-N 118.283 0.492 . . . . 0.0 111.358 -178.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -47.29 -51.58 18.73 Favored 'General case' 0 N--CA 1.536 3.836 0 C-N-CA 124.591 1.157 . . . . 0.0 113.672 -178.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -130.07 -39.75 1.36 Allowed 'General case' 0 N--CA 1.535 3.811 0 CA-C-O 118.662 -0.685 . . . . 0.0 111.857 -179.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 107.31 76.02 0.96 Allowed Glycine 1 N--CA 1.52 4.262 0 N-CA-C 110.331 -1.107 . . . . 0.0 110.331 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -114.23 -1.88 13.51 Favored 'General case' 0 N--CA 1.526 3.374 0 C-N-CA 123.463 0.705 . . . . 0.0 111.47 178.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 72.49 169.24 12.95 Favored Glycine 1 N--CA 1.52 4.272 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -178.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -90.4 -13.18 9.31 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.812 0 CA-C-N 118.554 1.177 . . . . 0.0 108.966 177.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -64.98 -37.65 88.35 Favored 'General case' 0 N--CA 1.526 3.346 0 CA-C-N 120.154 1.343 . . . . 0.0 111.583 178.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 2.8 p -82.97 -41.98 18.13 Favored 'General case' 1 N--CA 1.542 4.145 0 CA-C-N 120.1 1.318 . . . . 0.0 111.839 -179.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 582' ' ' ILE . . . . . 0.601 HG21 HD23 ' B' ' 571' ' ' LEU . 17.2 pt -70.25 -18.11 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.959 0 CA-C-O 117.685 -1.15 . . . . 0.0 113.385 -177.371 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 80.0 p -112.76 -27.49 8.13 Favored 'General case' 0 N--CA 1.514 2.774 0 CA-C-N 119.962 1.255 . . . . 0.0 111.038 177.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -75.57 -20.31 58.71 Favored 'General case' 0 N--CA 1.535 3.775 0 CA-C-N 120.049 1.295 . . . . 0.0 108.491 174.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -65.12 -36.59 93.12 Favored Glycine 1 N--CA 1.517 4.037 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 176.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 68.4 p -64.95 -33.85 77.02 Favored 'General case' 1 N--CA 1.541 4.119 0 CA-C-N 118.399 1.099 . . . . 0.0 110.325 177.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -56.52 -35.06 67.62 Favored 'General case' 1 N--CA 1.545 4.289 0 C-N-CA 123.819 0.848 . . . . 0.0 111.134 178.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 28.5 m -57.55 -42.84 83.79 Favored 'General case' 1 N--CA 1.541 4.096 0 C-N-CA 123.651 0.78 . . . . 0.0 111.153 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 19.8 mt -56.46 -44.82 80.9 Favored 'General case' 0 N--CA 1.528 3.447 0 C-N-CA 124.03 0.932 . . . . 0.0 111.63 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 20.9 mmmt -57.46 -26.47 61.27 Favored 'General case' 1 N--CA 1.544 4.229 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -86.86 -39.98 15.33 Favored 'General case' 0 N--CA 1.515 2.801 0 CA-C-N 118.493 0.588 . . . . 0.0 110.728 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.6 162.3 28.42 Favored Pre-proline 1 N--CA 1.542 4.136 0 CA-C-O 118.346 -0.835 . . . . 0.0 111.974 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -84.98 172.07 8.92 Favored 'Trans proline' 0 C--N 1.377 2.068 0 C-N-CA 122.045 1.83 . . . . 0.0 111.309 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.2 t -92.31 -24.64 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.118 0 CA-C-O 117.818 -1.087 . . . . 0.0 111.497 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -62.9 -40.66 98.24 Favored 'General case' 0 N--CA 1.516 2.866 0 CA-C-N 120.004 1.275 . . . . 0.0 110.437 -179.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 596' ' ' LEU . . . . . 0.574 ' CD2' HD22 ' A' ' 34' ' ' LEU . 7.1 mp -102.14 -12.54 17.99 Favored 'General case' 0 N--CA 1.511 2.59 0 C-N-CA 123.388 0.675 . . . . 0.0 112.188 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -31.46 71.46 Favored 'General case' 1 N--CA 1.544 4.241 0 N-CA-C 102.572 -3.122 . . . . 0.0 102.572 167.055 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.47 -38.29 68.91 Favored 'General case' 0 N--CA 1.52 3.054 0 C-N-CA 124.937 1.295 . . . . 0.0 110.289 174.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 599' ' ' TRP . . . . . 0.604 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 53.2 t90 -64.72 -35.84 82.37 Favored 'General case' 0 N--CA 1.538 3.946 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 176.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.37 -37.44 62.41 Favored 'General case' 0 N--CA 1.535 3.822 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 176.282 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -68.91 -37.53 79.02 Favored 'General case' 1 N--CA 1.544 4.248 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 175.273 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 602' ' ' GLU . . . . . 0.409 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 3.1 mm-40 -60.88 -21.75 63.6 Favored 'General case' 1 N--CA 1.543 4.192 0 C-N-CA 123.362 0.665 . . . . 0.0 110.494 175.867 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 603' ' ' VAL . . . . . 0.546 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.2 OUTLIER -123.9 6.99 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.536 0 C-N-CA 123.269 0.628 . . . . 0.0 112.439 -177.618 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -111.11 -59.43 1.97 Allowed 'General case' 0 N--CA 1.514 2.74 0 N-CA-C 105.385 -2.08 . . . . 0.0 105.385 176.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 12.6 tp . . . . . 0 N--CA 1.537 3.917 0 C-N-CA 125.085 1.354 . . . . 0.0 111.546 177.528 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 . . . . . 0 N--CA 1.516 2.832 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.82 ' CE3' HD22 ' B' ' 551' ' ' LEU . 66.6 t-105 -53.42 -39.46 64.36 Favored 'General case' 0 N--CA 1.536 3.85 0 C-N-CA 123.042 0.537 . . . . 0.0 109.64 175.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.45 HD22 ' N ' ' A' ' 20' ' ' LEU . 2.5 mm? -79.93 -27.29 39.86 Favored 'General case' 0 N--CA 1.517 2.898 0 CA-C-O 117.372 -1.299 . . . . 0.0 112.259 -175.557 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.8 mtt-85 -57.6 -31.72 66.49 Favored 'General case' 1 N--CA 1.547 4.406 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 172.126 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.58 ' CG ' HD21 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -80.78 -36.81 31.31 Favored 'General case' 0 N--CA 1.504 2.247 0 CA-C-O 116.22 -1.847 . . . . 0.0 109.668 174.615 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.7 t -69.98 -22.83 24.87 Favored 'Isoleucine or valine' 1 N--CA 1.565 5.289 0 CA-C-N 121.373 1.897 . . . . 0.0 112.498 -176.147 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -78.21 -48.56 15.56 Favored 'General case' 0 N--CA 1.535 3.781 0 CA-C-N 120.418 1.463 . . . . 0.0 107.496 178.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.2 mp -70.38 -17.9 63.04 Favored 'General case' 0 N--CA 1.535 3.818 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 175.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.429 HD23 ' CE2' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -72.53 -38.56 67.99 Favored 'General case' 0 N--CA 1.517 2.907 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 176.793 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.51 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 32.6 tttt -66.61 -16.94 64.55 Favored 'General case' 0 N--CA 1.514 2.727 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.025 176.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -74.14 -40.08 62.86 Favored 'General case' 0 N--CA 1.528 3.457 0 N-CA-C 108.32 -0.992 . . . . 0.0 108.32 175.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.611 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -89.92 -4.5 57.48 Favored 'General case' 0 N--CA 1.505 2.321 0 CA-C-O 118.701 -0.666 . . . . 0.0 110.434 177.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.51 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -87.55 -33.98 18.73 Favored 'General case' 0 N--CA 1.529 3.518 0 CA-C-N 120.364 1.438 . . . . 0.0 108.381 179.34 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -61.64 -41.82 98.03 Favored 'General case' 0 N--CA 1.537 3.907 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -92.55 -85.38 0.26 Allowed 'General case' 0 N--CA 1.511 2.612 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 177.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p30 150.47 46.84 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.071 0 C-N-CA 127.673 2.389 . . . . 0.0 108.56 177.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.474 HD22 ' CD2' ' B' ' 596' ' ' LEU . 7.8 mt -106.02 16.19 25.41 Favored 'General case' 0 N--CA 1.522 3.171 0 C-N-CA 124.557 1.143 . . . . 0.0 110.365 -178.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.562 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 42.7 p-80 -82.65 4.2 25.82 Favored 'General case' 0 N--CA 1.514 2.735 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 175.27 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.446 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 17.5 mt -92.67 -50.45 0.28 Allowed Pre-proline 0 N--CA 1.509 2.49 0 C-N-CA 125.462 1.505 . . . . 0.0 108.665 -176.116 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.446 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 9.5 Cg_exo -62.51 -35.96 68.14 Favored 'Trans proline' 0 C--N 1.391 2.811 0 N-CA-C 105.945 -2.367 . . . . 0.0 105.945 168.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.1 tt -53.7 -44.24 69.63 Favored 'General case' 0 N--CA 1.534 3.725 0 C-N-CA 124.085 0.954 . . . . 0.0 108.998 174.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.748 HD11 ' CE2' ' B' ' 519' ' ' TRP . 0.5 OUTLIER -60.73 -40.91 94.14 Favored 'General case' 1 N--CA 1.557 4.898 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 177.834 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -63.59 -12.97 37.44 Favored 'General case' 0 N--CA 1.535 3.807 0 CA-C-O 118.123 -0.942 . . . . 0.0 113.036 -179.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -110.92 -41.78 4.16 Favored 'General case' 0 N--CA 1.531 3.579 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 -177.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 4.0 ptp -128.72 13.27 6.39 Favored 'General case' 1 N--CA 1.55 4.571 0 CA-C-N 119.848 1.204 . . . . 0.0 113.436 -175.359 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -113.2 -72.65 0.7 Allowed 'General case' 0 N--CA 1.496 1.856 0 CA-C-N 118.99 0.814 . . . . 0.0 108.946 179.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 14.2 p 126.52 156.98 0.0 OUTLIER Pre-proline 1 N--CA 1.549 4.507 0 C-N-CA 128.629 2.772 . . . . 0.0 107.343 -178.02 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -70.03 -35.74 11.32 Favored 'Trans proline' 0 CA--C 1.571 2.366 0 C-N-CA 122.345 2.03 . . . . 0.0 107.572 174.189 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -65.31 -21.11 66.67 Favored 'General case' 0 N--CA 1.529 3.503 0 CA-C-O 118.175 -0.916 . . . . 0.0 110.296 175.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -75.03 -28.76 60.57 Favored 'General case' 0 N--CA 1.52 3.027 0 CA-C-O 117.283 -1.341 . . . . 0.0 110.137 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.8 ptt180 -87.21 -19.84 27.81 Favored 'General case' 0 N--CA 1.539 3.991 0 CA-C-N 120.406 1.457 . . . . 0.0 107.745 172.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -72.96 -24.09 60.74 Favored 'General case' 0 N--CA 1.525 3.302 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 172.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.438 ' O ' ' HB2' ' A' ' 54' ' ' ARG . . . -87.1 -42.95 12.65 Favored 'General case' 0 N--CA 1.501 2.1 0 CA-C-O 117.982 -1.009 . . . . 0.0 108.71 179.527 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.47 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 24.0 tp -68.24 -20.21 64.79 Favored 'General case' 1 N--CA 1.544 4.252 0 CA-C-N 120.753 1.615 . . . . 0.0 107.747 173.855 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.456 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -68.21 -69.27 1.42 Allowed Glycine 0 N--CA 1.5 2.966 0 C-N-CA 125.493 1.52 . . . . 0.0 111.17 177.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.7 m -75.44 -27.53 58.96 Favored 'General case' 0 N--CA 1.53 3.563 0 CA-C-O 117.838 -1.077 . . . . 0.0 112.442 -177.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -68.03 -49.4 61.72 Favored 'General case' 0 N--CA 1.531 3.62 0 CA-C-N 120.185 1.357 . . . . 0.0 107.705 177.514 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.3 t -65.67 -18.59 24.19 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.1 0 CA-C-O 117.929 -1.034 . . . . 0.0 109.776 176.258 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -71.84 -51.58 21.7 Favored 'General case' 0 N--CA 1.527 3.38 0 CA-C-N 120.012 1.278 . . . . 0.0 111.558 178.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -23.66 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.428 0 CA-C-N 120.789 1.631 . . . . 0.0 111.863 -178.049 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.423 ' CG1' HD22 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -86.13 -52.72 11.63 Favored 'Isoleucine or valine' 1 N--CA 1.548 4.454 0 CA-C-N 120.772 1.624 . . . . 0.0 107.308 -179.758 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -59.6 -24.06 63.47 Favored 'General case' 0 N--CA 1.532 3.634 0 CA-C-O 118.579 -0.724 . . . . 0.0 110.453 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -94.36 -24.18 17.49 Favored 'General case' 0 N--CA 1.524 3.23 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.5 177.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.423 HD22 ' OG ' ' A' ' 86' ' ' SER . 7.0 mt -72.2 -59.85 2.53 Favored 'General case' 0 N--CA 1.536 3.848 0 CA-C-N 119.521 1.055 . . . . 0.0 110.041 -179.622 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 46.3 mt -50.56 -29.29 10.39 Favored 'General case' 1 N--CA 1.545 4.308 0 C-N-CA 123.443 0.697 . . . . 0.0 112.732 -179.15 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -79.91 -47.78 14.51 Favored 'General case' 0 N--CA 1.528 3.446 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 71.67 86.99 0.15 Allowed Glycine 1 N--CA 1.519 4.169 0 CA-C-O 119.368 -0.684 . . . . 0.0 112.096 178.156 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -151.39 -54.71 0.14 Allowed 'General case' 0 N--CA 1.53 3.562 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 4.3 ttt -147.2 71.75 1.23 Allowed 'General case' 0 N--CA 1.52 3.045 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 178.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.523 ' HA ' HD22 ' A' ' 71' ' ' LEU . 97.2 p -142.86 7.41 1.64 Allowed 'General case' 0 N--CA 1.52 3.066 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -175.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -122.53 -62.31 1.38 Allowed 'General case' 0 N--CA 1.529 3.488 0 CA-C-N 119.672 1.124 . . . . 0.0 111.992 -178.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -110.28 -48.79 3.13 Favored 'General case' 0 N--CA 1.524 3.236 0 C-N-CA 123.547 0.739 . . . . 0.0 109.908 -177.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -78.47 4.6 12.77 Favored 'General case' 0 N--CA 1.513 2.71 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -177.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.681 HD23 HG21 ' A' ' 82' ' ' ILE . 44.0 tp -89.13 -46.54 8.74 Favored 'General case' 0 N--CA 1.53 3.567 0 CA-C-N 120.285 1.402 . . . . 0.0 113.233 -178.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -41.7 -42.59 2.6 Favored 'General case' 1 N--CA 1.544 4.228 0 N-CA-C 116.169 1.914 . . . . 0.0 116.169 -173.906 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -64.1 -21.52 66.57 Favored 'General case' 1 N--CA 1.545 4.306 0 CA-C-N 119.071 0.85 . . . . 0.0 113.117 -177.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -57.65 -59.77 4.69 Favored 'General case' 0 N--CA 1.529 3.476 0 C-N-CA 124.579 1.152 . . . . 0.0 112.587 -178.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.427 HD23 ' N ' ' A' ' 75' ' ' LEU . 1.3 pt? -130.78 -42.0 1.15 Allowed 'General case' 0 N--CA 1.526 3.369 0 CA-C-O 118.857 -0.592 . . . . 0.0 111.21 -179.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 120.34 78.26 0.53 Allowed Glycine 0 N--CA 1.514 3.897 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 179.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -104.53 -39.76 6.29 Favored 'General case' 0 N--CA 1.524 3.257 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 177.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.34 162.24 23.52 Favored Glycine 1 N--CA 1.524 4.547 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 -179.007 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.5 mt -84.7 -13.82 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.813 0 CA-C-N 119.721 1.761 . . . . 0.0 108.346 178.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.75 -40.31 72.77 Favored 'General case' 0 N--CA 1.517 2.878 0 CA-C-O 117.656 -1.164 . . . . 0.0 110.294 177.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 4.6 p -79.52 -42.37 25.32 Favored 'General case' 0 N--CA 1.538 3.961 0 CA-C-N 119.838 1.199 . . . . 0.0 112.807 -178.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.681 HG21 HD23 ' A' ' 71' ' ' LEU . 20.5 pt -70.88 -16.49 19.62 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.022 0 CA-C-O 117.853 -1.07 . . . . 0.0 113.749 -176.552 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 80.4 p -113.01 -32.75 6.26 Favored 'General case' 0 N--CA 1.514 2.773 0 CA-C-N 119.795 1.18 . . . . 0.0 110.216 178.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.5 ptt180 -71.91 -20.22 61.81 Favored 'General case' 0 N--CA 1.533 3.68 0 CA-C-N 119.56 1.073 . . . . 0.0 109.005 175.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -64.78 -38.18 95.26 Favored Glycine 1 N--CA 1.52 4.263 0 N-CA-C 108.529 -1.829 . . . . 0.0 108.529 175.43 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.423 ' OG ' HD22 ' A' ' 61' ' ' LEU . 50.3 m -65.09 -28.13 69.24 Favored 'General case' 1 N--CA 1.54 4.042 0 CA-C-N 117.747 0.773 . . . . 0.0 110.708 176.678 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -60.64 -31.62 70.82 Favored 'General case' 1 N--CA 1.54 4.046 0 CA-C-N 118.542 0.61 . . . . 0.0 111.228 179.218 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 2.6 m -65.59 -35.29 80.38 Favored 'General case' 0 N--CA 1.537 3.89 0 C-N-CA 123.471 0.708 . . . . 0.0 111.219 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 23.8 mt -56.33 -40.11 73.9 Favored 'General case' 0 N--CA 1.534 3.759 0 C-N-CA 124.165 0.986 . . . . 0.0 111.882 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -20.73 18.95 Favored 'General case' 1 N--CA 1.54 4.042 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 -178.756 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -106.56 -30.76 8.84 Favored 'General case' 0 N--CA 1.517 2.913 0 CA-C-N 119.301 0.955 . . . . 0.0 112.511 -179.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -49.88 160.37 0.64 Allowed Pre-proline 1 N--CA 1.55 4.531 0 CA-C-N 119.285 0.948 . . . . 0.0 113.508 -178.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -85.29 151.12 10.6 Favored 'Trans proline' 0 C--N 1.379 2.166 0 C-N-CA 122.497 2.131 . . . . 0.0 110.511 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.8 t -84.08 -25.83 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.217 0 CA-C-O 117.694 -1.146 . . . . 0.0 111.858 -179.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -63.27 -40.6 97.85 Favored 'General case' 0 N--CA 1.52 3.029 0 CA-C-N 120.346 1.43 . . . . 0.0 109.85 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.486 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.0 mp -97.87 -13.97 20.97 Favored 'General case' 0 N--CA 1.51 2.542 0 C-N-CA 123.818 0.847 . . . . 0.0 111.344 178.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.07 -36.65 84.7 Favored 'General case' 1 N--CA 1.544 4.237 0 N-CA-C 102.809 -3.034 . . . . 0.0 102.809 168.005 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -52.78 -38.27 60.87 Favored 'General case' 0 N--CA 1.517 2.886 0 C-N-CA 124.585 1.154 . . . . 0.0 111.621 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.661 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 50.6 t90 -63.0 -37.1 85.81 Favored 'General case' 0 N--CA 1.532 3.64 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 10.0 mp -55.31 -35.33 65.0 Favored 'General case' 1 N--CA 1.543 4.197 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 176.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -70.5 -35.95 73.51 Favored 'General case' 0 N--CA 1.536 3.853 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 175.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.411 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 3.0 mm-40 -62.2 -23.78 66.84 Favored 'General case' 1 N--CA 1.542 4.164 0 C-N-CA 123.739 0.816 . . . . 0.0 110.087 175.285 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.54 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -120.96 12.82 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.556 0 C-N-CA 123.673 0.789 . . . . 0.0 111.851 -178.052 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 43.4 mt -124.85 -62.32 1.25 Allowed 'General case' 0 N--CA 1.526 3.351 0 N-CA-C 106.573 -1.639 . . . . 0.0 106.573 176.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.411 ' O ' HD23 ' A' ' 105' ' ' LEU . 3.8 tt . . . . . 1 N--CA 1.548 4.448 0 C-N-CA 125.278 1.431 . . . . 0.0 111.899 179.073 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 . . . . . 0 N--CA 1.517 2.894 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 519' ' ' TRP . . . . . 0.748 ' CE2' HD11 ' A' ' 39' ' ' LEU . 68.5 t-105 -43.33 -28.09 0.3 Allowed 'General case' 1 N--CA 1.545 4.324 0 C-N-CA 124.206 1.002 . . . . 0.0 113.679 179.834 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 520' ' ' LEU . . . . . 0.578 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.2 mm? -96.12 -30.38 13.56 Favored 'General case' 0 N--CA 1.528 3.434 0 CA-C-O 117.847 -1.073 . . . . 0.0 113.733 -172.12 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 21.1 tpp180 -64.8 -23.44 67.24 Favored 'General case' 0 N--CA 1.533 3.679 0 N-CA-C 105.882 -1.896 . . . . 0.0 105.882 172.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . 0.543 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 2.1 m-85 -76.42 -41.39 47.85 Favored 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 106.059 -1.83 . . . . 0.0 106.059 172.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 523' ' ' VAL . . . . . 0.465 ' HA ' ' HB2' ' B' ' 526' ' ' LEU . 72.2 t -64.53 -18.32 22.98 Favored 'Isoleucine or valine' 1 N--CA 1.559 4.986 0 CA-C-N 119.52 1.055 . . . . 0.0 111.685 177.711 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -76.53 -56.22 4.82 Favored 'General case' 0 N--CA 1.532 3.669 0 CA-C-N 120.276 1.398 . . . . 0.0 107.842 -179.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 5.6 mp -67.61 -18.98 65.17 Favored 'General case' 0 N--CA 1.533 3.678 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 175.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 526' ' ' LEU . . . . . 0.465 ' HB2' ' HA ' ' B' ' 523' ' ' VAL . 0.4 OUTLIER -70.36 -39.78 74.44 Favored 'General case' 0 N--CA 1.513 2.716 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 177.688 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 527' ' ' LYS . . . . . 0.415 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 10.2 tttt -67.07 -18.65 65.43 Favored 'General case' 0 N--CA 1.524 3.24 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.884 177.229 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -72.97 -39.88 65.77 Favored 'General case' 0 N--CA 1.529 3.517 0 CA-C-N 119.46 1.027 . . . . 0.0 108.665 176.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 529' ' ' ALA . . . . . 0.661 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -92.83 -7.6 45.9 Favored 'General case' 0 N--CA 1.507 2.399 0 CA-C-O 118.629 -0.7 . . . . 0.0 111.166 178.221 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 530' ' ' TYR . . . . . 0.415 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.2 OUTLIER -83.73 -34.51 24.86 Favored 'General case' 0 N--CA 1.535 3.803 0 CA-C-N 120.35 1.432 . . . . 0.0 108.515 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -62.68 -41.35 99.05 Favored 'General case' 0 N--CA 1.534 3.728 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 177.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -91.85 -87.62 0.21 Allowed 'General case' 0 N--CA 1.514 2.732 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 176.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.9 p30 150.33 51.27 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.07 0 C-N-CA 127.755 2.422 . . . . 0.0 108.415 177.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 534' ' ' LEU . . . . . 0.486 HD22 ' CD2' ' A' ' 96' ' ' LEU . 4.8 mt -110.75 9.15 22.71 Favored 'General case' 0 N--CA 1.529 3.486 0 C-N-CA 124.624 1.17 . . . . 0.0 111.024 -178.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 535' ' ' HIS . . . . . 0.569 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 57.2 p-80 -82.53 -0.9 48.81 Favored 'General case' 0 N--CA 1.515 2.793 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 174.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 536' ' ' LEU . . . . . 0.43 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 39.2 mt -91.29 -49.82 0.33 Allowed Pre-proline 0 N--CA 1.505 2.277 0 CA-C-O 116.317 -1.802 . . . . 0.0 109.212 -176.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 537' ' ' PRO . . . . . 0.43 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 4.1 Cg_exo -66.26 -35.19 33.15 Favored 'Trans proline' 0 C--N 1.395 2.996 0 N-CA-C 107.345 -1.829 . . . . 0.0 107.345 171.252 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 538' ' ' LEU . . . . . 0.415 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 0.3 OUTLIER -62.17 -39.6 93.19 Favored 'General case' 0 N--CA 1.533 3.682 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 175.111 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 9.8 mt -73.32 -23.08 60.21 Favored 'General case' 0 N--CA 1.535 3.817 0 CA-C-O 118.583 -0.722 . . . . 0.0 111.125 177.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -71.53 -17.14 62.34 Favored 'General case' 0 N--CA 1.531 3.596 0 CA-C-N 118.853 0.751 . . . . 0.0 110.802 178.212 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 541' ' ' LEU . . . . . 0.433 ' O ' HD23 ' B' ' 541' ' ' LEU . 1.9 tt -101.01 -52.86 3.18 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 123.495 0.718 . . . . 0.0 110.916 -178.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 12.2 ptm -54.55 -41.52 69.87 Favored 'General case' 0 N--CA 1.531 3.611 0 CA-C-O 117.754 -1.117 . . . . 0.0 113.301 -174.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 1.3 tt -134.37 -104.3 0.23 Allowed 'General case' 0 N--CA 1.533 3.722 0 CA-C-O 117.307 -1.33 . . . . 0.0 113.545 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 31.0 p -156.27 163.47 24.77 Favored Pre-proline 1 N--CA 1.545 4.278 0 CA-C-N 121.322 1.874 . . . . 0.0 112.389 -177.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -67.54 -27.48 39.19 Favored 'Trans proline' 0 C--N 1.392 2.85 0 C-N-CA 122.849 2.366 . . . . 0.0 111.287 176.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -61.36 -21.57 64.16 Favored 'General case' 1 N--CA 1.54 4.03 0 CA-C-O 118.327 -0.844 . . . . 0.0 111.122 178.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -71.27 -38.48 71.85 Favored 'General case' 0 N--CA 1.528 3.446 0 CA-C-N 119.061 0.846 . . . . 0.0 108.923 177.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -79.78 -19.71 47.98 Favored 'General case' 0 N--CA 1.525 3.285 0 CA-C-O 117.792 -1.099 . . . . 0.0 111.126 177.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -68.65 -45.89 70.58 Favored 'General case' 0 N--CA 1.539 3.998 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 175.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -79.53 -16.41 56.02 Favored 'General case' 0 N--CA 1.509 2.508 0 CA-C-O 117.376 -1.297 . . . . 0.0 110.726 176.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 551' ' ' LEU . . . . . 0.82 HD22 ' CE3' ' A' ' 19' ' ' TRP . 5.7 tp -74.89 -31.54 61.6 Favored 'General case' 0 N--CA 1.528 3.451 0 CA-C-N 120.758 1.617 . . . . 0.0 107.765 174.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -70.74 -62.06 3.79 Favored Glycine 0 N--CA 1.5 2.918 0 N-CA-C 109.051 -1.62 . . . . 0.0 109.051 178.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 3.1 m -61.05 -27.37 68.29 Favored 'General case' 1 N--CA 1.54 4.058 0 CA-C-O 118.393 -0.813 . . . . 0.0 112.119 -179.34 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 7.5 mtm180 -69.5 -49.33 55.61 Favored 'General case' 0 N--CA 1.539 3.997 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 176.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 555' ' ' VAL . . . . . 0.556 HG23 ' O ' ' B' ' 551' ' ' LEU . 21.8 t -66.23 -15.51 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.865 0 CA-C-O 118.144 -0.931 . . . . 0.0 109.809 175.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 26.3 mtp180 -77.75 -46.71 20.94 Favored 'General case' 0 N--CA 1.52 3.067 0 CA-C-N 119.568 1.076 . . . . 0.0 110.807 178.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 557' ' ' ILE . . . . . 0.589 ' HB ' HG22 ' B' ' 582' ' ' ILE . 0.0 OUTLIER -71.56 -24.71 23.76 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.502 0 CA-C-N 120.282 1.401 . . . . 0.0 111.084 -179.054 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 558' ' ' VAL . . . . . 0.44 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -87.83 -52.64 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.76 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 -179.07 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -59.88 -22.95 63.02 Favored 'General case' 0 N--CA 1.534 3.741 0 CA-C-O 118.81 -0.614 . . . . 0.0 110.701 178.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -91.51 -28.34 17.65 Favored 'General case' 0 N--CA 1.524 3.249 0 CA-C-O 118.546 -0.74 . . . . 0.0 109.935 177.257 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -68.04 -46.17 71.92 Favored 'General case' 1 N--CA 1.539 4.015 0 CA-C-N 119.224 0.92 . . . . 0.0 109.249 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 33.3 mt -55.88 -25.71 43.78 Favored 'General case' 0 N--CA 1.535 3.781 0 C-N-CA 124.533 1.133 . . . . 0.0 112.234 178.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -82.99 -52.59 6.53 Favored 'General case' 0 N--CA 1.515 2.799 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 179.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 80.21 77.34 0.96 Allowed Glycine 0 N--CA 1.512 3.729 0 N-CA-C 110.018 -1.233 . . . . 0.0 110.018 179.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -144.61 -60.7 0.37 Allowed 'General case' 0 N--CA 1.523 3.208 0 CA-C-N 117.294 0.547 . . . . 0.0 109.615 -179.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 43.6 mtt -148.86 79.73 1.42 Allowed 'General case' 0 N--CA 1.524 3.251 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 567' ' ' SER . . . . . 0.402 ' HA ' HD22 ' B' ' 571' ' ' LEU . 17.4 m -140.46 -16.13 0.93 Allowed 'General case' 0 N--CA 1.522 3.169 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 -174.191 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -110.75 -53.43 2.7 Favored 'General case' 0 N--CA 1.531 3.6 0 CA-C-N 120.626 1.557 . . . . 0.0 112.159 -177.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -106.68 -53.37 2.63 Favored 'General case' 0 N--CA 1.528 3.458 0 C-N-CA 123.116 0.566 . . . . 0.0 110.475 -177.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -74.79 -0.13 17.27 Favored 'General case' 0 N--CA 1.515 2.812 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -177.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 571' ' ' LEU . . . . . 0.656 HD23 HG21 ' B' ' 582' ' ' ILE . 42.5 tp -88.64 -49.19 7.02 Favored 'General case' 0 N--CA 1.528 3.469 0 CA-C-N 120.142 1.337 . . . . 0.0 113.682 -177.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -44.39 -46.5 9.49 Favored 'General case' 1 N--CA 1.544 4.252 0 N-CA-C 114.935 1.457 . . . . 0.0 114.935 -175.11 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -62.47 -29.97 70.92 Favored 'General case' 1 N--CA 1.54 4.032 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -177.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -54.83 -57.36 11.87 Favored 'General case' 0 N--CA 1.528 3.437 0 C-N-CA 124.056 0.942 . . . . 0.0 112.636 -179.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -126.12 -38.99 2.11 Favored 'General case' 0 N--CA 1.533 3.709 0 CA-C-O 118.623 -0.703 . . . . 0.0 111.616 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 123.33 65.66 0.21 Allowed Glycine 1 N--CA 1.519 4.225 0 CA-C-N 118.971 0.805 . . . . 0.0 111.122 179.281 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -120.89 102.76 8.57 Favored 'General case' 0 N--CA 1.518 2.957 0 N-CA-C 105.506 -2.035 . . . . 0.0 105.506 177.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -40.4 162.82 0.01 OUTLIER Glycine 1 N--CA 1.539 5.513 0 C-N-CA 124.758 1.17 . . . . 0.0 114.653 -177.402 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 1.1 mt -79.43 -20.59 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.627 0 CA-C-N 119.028 1.414 . . . . 0.0 108.944 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -63.41 -33.53 75.75 Favored 'General case' 0 N--CA 1.53 3.545 0 CA-C-N 120.294 1.406 . . . . 0.0 109.853 175.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.8 p -80.24 -52.47 7.7 Favored 'General case' 0 N--CA 1.532 3.638 0 CA-C-N 118.997 0.817 . . . . 0.0 111.578 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 582' ' ' ILE . . . . . 0.656 HG21 HD23 ' B' ' 571' ' ' LEU . 24.2 pt -67.33 -18.7 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.83 0 CA-C-O 117.701 -1.143 . . . . 0.0 113.482 -176.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 61.0 p -107.57 -25.61 11.28 Favored 'General case' 0 N--CA 1.516 2.844 0 CA-C-N 119.814 1.188 . . . . 0.0 110.781 178.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 13.8 ptt180 -75.64 -22.27 56.95 Favored 'General case' 0 N--CA 1.532 3.653 0 CA-C-N 120.232 1.378 . . . . 0.0 108.087 174.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -69.59 -34.64 73.45 Favored Glycine 0 N--CA 1.513 3.826 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 175.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 60.2 p -72.32 -39.59 68.09 Favored 'General case' 0 N--CA 1.536 3.831 0 CA-C-N 118.362 1.081 . . . . 0.0 110.052 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -60.58 -32.59 71.69 Favored 'General case' 1 N--CA 1.541 4.09 0 C-N-CA 123.126 0.571 . . . . 0.0 110.523 179.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 1.4 m -58.87 -38.88 79.8 Favored 'General case' 1 N--CA 1.541 4.114 0 C-N-CA 123.436 0.695 . . . . 0.0 110.381 178.488 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 42.1 mt -61.47 -44.91 96.26 Favored 'General case' 0 N--CA 1.525 3.286 0 C-N-CA 123.955 0.902 . . . . 0.0 110.725 179.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.92 -26.21 64.14 Favored 'General case' 1 N--CA 1.543 4.202 0 C-N-CA 123.678 0.791 . . . . 0.0 112.158 179.53 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -84.05 -39.99 18.91 Favored 'General case' 0 N--CA 1.517 2.911 0 CA-C-N 118.627 0.649 . . . . 0.0 111.917 -178.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -55.63 161.58 3.07 Favored Pre-proline 1 N--CA 1.546 4.373 0 CA-C-O 118.258 -0.877 . . . . 0.0 113.098 -179.591 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -80.05 -179.89 5.65 Favored 'Trans proline' 0 C--N 1.379 2.171 0 C-N-CA 121.777 1.651 . . . . 0.0 110.355 178.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -97.83 -28.34 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.036 0 CA-C-O 117.865 -1.064 . . . . 0.0 111.489 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -61.1 -44.04 97.97 Favored 'General case' 0 N--CA 1.517 2.903 0 CA-C-N 119.808 1.185 . . . . 0.0 110.373 -178.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 596' ' ' LEU . . . . . 0.474 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.9 mp -99.47 -14.39 19.11 Favored 'General case' 0 N--CA 1.509 2.503 0 CA-C-O 118.653 -0.689 . . . . 0.0 112.023 179.299 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.85 -27.84 66.18 Favored 'General case' 1 N--CA 1.54 4.052 0 N-CA-C 103.35 -2.833 . . . . 0.0 103.35 168.75 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -56.87 -38.76 73.18 Favored 'General case' 0 N--CA 1.519 3.01 0 C-N-CA 123.889 0.876 . . . . 0.0 109.641 173.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 599' ' ' TRP . . . . . 0.611 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 44.0 t90 -63.75 -36.09 82.75 Favored 'General case' 0 N--CA 1.529 3.482 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 177.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.28 -37.08 54.51 Favored 'General case' 0 N--CA 1.535 3.803 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 177.073 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -69.9 -38.93 76.44 Favored 'General case' 0 N--CA 1.539 3.983 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 175.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.97 -23.8 48.42 Favored 'General case' 1 N--CA 1.546 4.367 0 C-N-CA 123.199 0.6 . . . . 0.0 110.598 175.295 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 603' ' ' VAL . . . . . 0.553 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.3 OUTLIER -120.57 0.85 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.321 0 CA-C-O 118.351 -0.833 . . . . 0.0 113.159 -176.475 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -112.87 -59.73 1.98 Allowed 'General case' 0 N--CA 1.509 2.522 0 N-CA-C 105.964 -1.865 . . . . 0.0 105.964 176.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 1 N--CA 1.542 4.138 0 C-N-CA 123.948 0.899 . . . . 0.0 110.552 178.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 . . . . . 0 N--CA 1.521 3.112 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.761 ' CE3' HD22 ' B' ' 551' ' ' LEU . 76.4 t-105 -51.37 -44.42 62.1 Favored 'General case' 1 N--CA 1.541 4.093 0 C-N-CA 123.471 0.708 . . . . 0.0 109.736 177.29 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.401 HD22 ' N ' ' A' ' 20' ' ' LEU . 2.3 mm? -77.41 -25.61 50.93 Favored 'General case' 0 N--CA 1.524 3.271 0 CA-C-O 117.557 -1.211 . . . . 0.0 111.745 -177.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.0 tpm_? -55.64 -30.54 61.17 Favored 'General case' 1 N--CA 1.544 4.266 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 173.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.55 ' HB2' HG21 ' B' ' 555' ' ' VAL . 0.0 OUTLIER -84.89 -37.57 20.46 Favored 'General case' 0 N--CA 1.507 2.411 0 CA-C-O 116.125 -1.893 . . . . 0.0 109.482 173.496 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 22.0 t -70.67 -29.9 40.03 Favored 'Isoleucine or valine' 1 N--CA 1.574 5.769 0 CA-C-N 121.382 1.901 . . . . 0.0 113.475 -174.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -73.05 -50.64 21.83 Favored 'General case' 0 N--CA 1.533 3.719 0 CA-C-N 120.298 1.408 . . . . 0.0 108.3 -179.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.7 mp -72.8 -15.69 61.63 Favored 'General case' 0 N--CA 1.525 3.314 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 175.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.537 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -69.79 -37.0 76.16 Favored 'General case' 0 N--CA 1.517 2.896 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 175.294 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.487 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 35.4 tttt -63.42 -21.68 66.44 Favored 'General case' 0 N--CA 1.522 3.169 0 CA-C-O 118.437 -0.792 . . . . 0.0 111.247 176.633 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -70.6 -41.47 72.27 Favored 'General case' 0 N--CA 1.534 3.768 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 175.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.633 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -88.72 -6.19 57.6 Favored 'General case' 0 N--CA 1.507 2.398 0 CA-C-O 118.676 -0.678 . . . . 0.0 110.908 178.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.487 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -83.94 -36.06 23.54 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-N 120.218 1.372 . . . . 0.0 108.52 179.486 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -61.08 -39.06 88.46 Favored 'General case' 0 N--CA 1.532 3.658 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 177.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -97.32 -85.45 0.36 Allowed 'General case' 0 N--CA 1.516 2.872 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 177.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p30 149.78 51.97 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.044 0 C-N-CA 127.515 2.326 . . . . 0.0 107.982 178.312 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.488 HD22 ' CD2' ' B' ' 596' ' ' LEU . 7.3 mt -112.32 11.56 20.1 Favored 'General case' 0 N--CA 1.532 3.652 0 C-N-CA 123.74 0.816 . . . . 0.0 111.354 -178.161 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.56 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 52.8 p-80 -81.4 0.29 38.12 Favored 'General case' 0 N--CA 1.518 2.966 0 C-N-CA 123.381 0.672 . . . . 0.0 109.473 174.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.463 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 22.8 mt -91.3 -50.98 0.31 Allowed Pre-proline 0 N--CA 1.51 2.555 0 C-N-CA 125.266 1.426 . . . . 0.0 109.148 -176.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.463 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 9.1 Cg_exo -62.11 -39.9 45.97 Favored 'Trans proline' 0 C--N 1.386 2.523 0 N-CA-C 106.428 -2.182 . . . . 0.0 106.428 170.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.458 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.3 OUTLIER -56.59 -38.64 72.29 Favored 'General case' 0 N--CA 1.531 3.606 0 C-N-CA 123.928 0.891 . . . . 0.0 109.736 176.11 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.648 HD11 ' CE2' ' B' ' 519' ' ' TRP . 3.0 mt -60.08 -42.25 94.2 Favored 'General case' 1 N--CA 1.561 5.093 0 CA-C-N 119.478 1.035 . . . . 0.0 109.237 175.979 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -63.27 -25.62 68.4 Favored 'General case' 1 N--CA 1.544 4.244 0 CA-C-O 118.614 -0.707 . . . . 0.0 112.732 -179.646 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.803 HD11 ' HB2' ' B' ' 592' ' ' ALA . 7.8 mp -81.19 -41.14 22.79 Favored 'General case' 0 N--CA 1.534 3.771 0 CA-C-N 118.827 0.74 . . . . 0.0 109.112 -179.357 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 11.9 ptt? -97.82 44.29 1.05 Allowed 'General case' 0 N--CA 1.53 3.537 0 N-CA-C 104.05 -2.574 . . . . 0.0 104.05 173.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.9 tp -30.73 -103.64 0.0 OUTLIER 'General case' 0 N--CA 1.531 3.611 0 C-N-CA 127.338 2.255 . . . . 0.0 115.41 -173.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 54.0 p 52.5 126.94 0.0 OUTLIER Pre-proline 0 N--CA 1.535 3.795 0 CA-C-N 120.624 1.557 . . . . 0.0 111.69 -178.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -62.09 -32.06 83.46 Favored 'Trans proline' 0 C--N 1.382 2.316 0 C-N-CA 121.27 1.313 . . . . 0.0 110.335 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -48.85 -21.78 0.7 Allowed 'General case' 1 N--CA 1.551 4.585 0 C-N-CA 124.394 1.078 . . . . 0.0 113.71 178.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -62.45 -73.81 0.1 Allowed 'General case' 0 N--CA 1.538 3.936 0 CA-C-N 119.671 1.123 . . . . 0.0 110.522 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -89.64 6.18 42.45 Favored 'General case' 0 N--CA 1.535 3.806 0 CA-C-N 119.806 1.184 . . . . 0.0 111.837 177.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -86.67 -30.77 21.48 Favored 'General case' 0 N--CA 1.518 2.975 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 172.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.88 -48.71 6.85 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.472 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 13.1 tp -65.06 -28.77 69.7 Favored 'General case' 1 N--CA 1.54 4.071 0 CA-C-N 119.98 1.263 . . . . 0.0 107.853 175.304 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.441 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -68.46 -73.72 0.67 Allowed Glycine 0 N--CA 1.505 3.262 0 C-N-CA 124.474 1.035 . . . . 0.0 112.64 177.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.5 m -69.78 -29.0 66.21 Favored 'General case' 0 N--CA 1.537 3.915 0 CA-C-O 117.989 -1.005 . . . . 0.0 113.418 -175.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.413 ' O ' HD13 ' A' ' 57' ' ' ILE . 6.6 mtt180 -73.39 -46.89 46.19 Favored 'General case' 0 N--CA 1.53 3.532 0 CA-C-N 120.179 1.354 . . . . 0.0 107.644 178.079 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.5 t -66.18 -16.96 21.57 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.9 0 O-C-N 120.648 -1.282 . . . . 0.0 109.41 174.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.32 -51.48 20.5 Favored 'General case' 0 N--CA 1.529 3.51 0 CA-C-N 120.022 1.283 . . . . 0.0 111.499 177.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.462 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -71.84 -23.57 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.51 0 CA-C-N 120.336 1.426 . . . . 0.0 112.123 -177.916 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.7 HG11 HD11 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -86.11 -51.51 13.15 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.088 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 -179.697 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -58.57 -25.0 62.07 Favored 'General case' 0 N--CA 1.538 3.931 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.505 178.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -94.45 -24.3 17.37 Favored 'General case' 0 N--CA 1.526 3.341 0 CA-C-O 118.303 -0.856 . . . . 0.0 110.859 177.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 20.7 tp -79.14 -70.2 0.52 Allowed 'General case' 0 N--CA 1.529 3.506 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.8 mt -42.84 -31.93 0.55 Allowed 'General case' 1 N--CA 1.544 4.232 0 C-N-CA 125.163 1.385 . . . . 0.0 113.683 -178.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.7 mmm180 -87.99 -43.33 11.82 Favored 'General case' 0 N--CA 1.526 3.345 0 CA-C-O 119.149 -0.453 . . . . 0.0 110.115 -179.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.37 87.12 0.59 Allowed Glycine 1 N--CA 1.517 4.097 0 N-CA-C 110.678 -0.969 . . . . 0.0 110.678 178.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -148.68 -54.53 0.19 Allowed 'General case' 0 N--CA 1.522 3.146 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 76.3 mtm -148.42 83.12 1.48 Allowed 'General case' 0 N--CA 1.516 2.83 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.8 t -146.95 14.9 1.18 Allowed 'General case' 0 N--CA 1.528 3.436 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -178.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 8.4 mp0 -116.29 -72.18 0.7 Allowed 'General case' 0 N--CA 1.526 3.341 0 CA-C-N 119.154 0.888 . . . . 0.0 111.097 179.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -110.86 -46.29 3.37 Favored 'General case' 0 N--CA 1.522 3.149 0 C-N-CA 123.278 0.631 . . . . 0.0 110.135 -178.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -68.17 -14.62 63.12 Favored 'General case' 0 N--CA 1.517 2.892 0 CA-C-O 117.866 -1.064 . . . . 0.0 113.441 -178.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.73 HD23 HG21 ' A' ' 82' ' ' ILE . 13.6 tp -76.89 -60.34 2.4 Favored 'General case' 0 N--CA 1.529 3.485 0 CA-C-N 120.117 1.326 . . . . 0.0 112.701 -177.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -39.03 -32.63 0.09 Allowed 'General case' 1 N--CA 1.552 4.67 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -177.783 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -72.78 -44.64 61.31 Favored 'General case' 0 N--CA 1.532 3.642 0 CA-C-N 118.361 0.528 . . . . 0.0 110.46 -178.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -41.34 -51.65 3.63 Favored 'General case' 1 N--CA 1.541 4.094 0 C-N-CA 125.548 1.539 . . . . 0.0 113.39 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.99 -77.2 0.59 Allowed 'General case' 0 N--CA 1.532 3.674 0 CA-C-O 118.739 -0.648 . . . . 0.0 109.374 -179.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 157.63 45.89 0.01 OUTLIER Glycine 1 N--CA 1.522 4.38 0 CA-C-O 119.177 -0.79 . . . . 0.0 111.522 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -113.3 113.48 25.34 Favored 'General case' 0 N--CA 1.514 2.755 0 N-CA-C 107.4 -1.334 . . . . 0.0 107.4 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -44.67 176.24 0.01 OUTLIER Glycine 1 N--CA 1.541 5.652 0 C-N-CA 124.966 1.27 . . . . 0.0 115.184 -177.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.4 mt -81.55 -18.81 11.36 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.913 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 177.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.43 -0.19 19.2 Favored 'General case' 0 N--CA 1.513 2.694 0 CA-C-O 117.86 -1.067 . . . . 0.0 111.084 174.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.74 -47.94 3.91 Favored 'General case' 0 N--CA 1.536 3.864 0 CA-C-N 120.758 1.617 . . . . 0.0 109.283 176.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.73 HG21 HD23 ' A' ' 71' ' ' LEU . 0.1 OUTLIER -66.16 -41.01 88.56 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.912 0 CA-C-O 118.938 -0.553 . . . . 0.0 111.373 -178.192 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 50.3 p -82.64 -26.28 32.33 Favored 'General case' 0 N--CA 1.519 2.991 0 CA-C-O 118.743 -0.646 . . . . 0.0 109.991 178.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.6 ttp180 -65.15 -35.16 80.22 Favored 'General case' 1 N--CA 1.544 4.264 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 175.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -56.56 -36.61 71.66 Favored Glycine 1 N--CA 1.529 4.849 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 176.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 14.7 m -62.25 -41.43 98.43 Favored 'General case' 1 N--CA 1.542 4.158 0 CA-C-N 117.552 0.676 . . . . 0.0 110.181 177.526 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -61.67 -32.72 72.92 Favored 'General case' 1 N--CA 1.541 4.084 0 C-N-CA 123.893 0.877 . . . . 0.0 112.219 -179.677 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 2.5 m -68.32 -39.43 81.96 Favored 'General case' 1 N--CA 1.54 4.026 0 CA-C-N 118.311 0.505 . . . . 0.0 111.07 -178.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.4 mt -59.35 -40.46 86.47 Favored 'General case' 0 N--CA 1.528 3.471 0 C-N-CA 123.764 0.826 . . . . 0.0 111.588 -179.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -56.82 -28.69 61.87 Favored 'General case' 1 N--CA 1.543 4.219 0 CA-C-O 118.771 -0.633 . . . . 0.0 112.064 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.96 -38.0 21.55 Favored 'General case' 0 N--CA 1.516 2.874 0 CA-C-N 118.323 0.51 . . . . 0.0 111.216 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.11 161.86 0.68 Allowed Pre-proline 1 N--CA 1.548 4.434 0 CA-C-O 118.206 -0.902 . . . . 0.0 112.897 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -81.64 170.73 14.03 Favored 'Trans proline' 0 C--N 1.379 2.155 0 C-N-CA 121.687 1.591 . . . . 0.0 110.72 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.44 ' HA ' ' HB3' ' A' ' 97' ' ' ARG . 2.8 t -95.34 -29.08 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.029 0 CA-C-O 117.92 -1.038 . . . . 0.0 111.076 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -62.3 -42.61 99.5 Favored 'General case' 0 N--CA 1.513 2.685 0 CA-C-N 119.764 1.166 . . . . 0.0 109.962 -179.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.528 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.2 mp -98.84 -14.04 19.82 Favored 'General case' 0 N--CA 1.508 2.47 0 CA-C-O 118.302 -0.856 . . . . 0.0 112.221 179.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.44 ' HB3' ' HA ' ' A' ' 94' ' ' VAL . 0.1 OUTLIER -67.42 -30.57 70.35 Favored 'General case' 1 N--CA 1.549 4.522 0 N-CA-C 102.728 -3.064 . . . . 0.0 102.728 168.254 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -57.04 -39.59 75.14 Favored 'General case' 0 N--CA 1.517 2.914 0 C-N-CA 123.871 0.868 . . . . 0.0 110.201 174.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.658 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 47.8 t90 -65.1 -33.96 77.27 Favored 'General case' 0 N--CA 1.527 3.407 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 177.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.23 -36.68 61.3 Favored 'General case' 0 N--CA 1.538 3.928 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 176.429 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -69.51 -38.7 77.69 Favored 'General case' 1 N--CA 1.54 4.052 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 175.213 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.42 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 1.2 mm-40 -59.17 -23.99 62.69 Favored 'General case' 1 N--CA 1.546 4.341 0 C-N-CA 123.4 0.68 . . . . 0.0 110.63 175.865 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.508 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -113.37 -2.9 10.66 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.348 0 CA-C-O 118.11 -0.947 . . . . 0.0 112.399 -176.947 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 54.5 mt -102.99 -62.24 1.3 Allowed 'General case' 0 N--CA 1.527 3.378 0 N-CA-C 105.088 -2.19 . . . . 0.0 105.088 174.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.6 tp . . . . . 0 N--CA 1.53 3.538 0 C-N-CA 125.077 1.351 . . . . 0.0 111.384 177.912 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 . . . . . 0 N--CA 1.522 3.137 0 CA-C-O 118.66 -0.686 . . . . 0.0 110.924 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 519' ' ' TRP . . . . . 0.648 ' CE2' HD11 ' A' ' 39' ' ' LEU . 70.8 t-105 -43.7 -28.68 0.43 Allowed 'General case' 1 N--CA 1.55 4.559 0 N-CA-C 113.658 0.985 . . . . 0.0 113.658 -178.542 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 520' ' ' LEU . . . . . 0.605 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.1 mm? -97.76 -28.34 13.92 Favored 'General case' 0 N--CA 1.529 3.485 0 CA-C-O 117.637 -1.173 . . . . 0.0 113.715 -172.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -63.05 -24.84 68.1 Favored 'General case' 1 N--CA 1.54 4.039 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 171.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . 0.558 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.5 m-85 -76.73 -41.54 44.7 Favored 'General case' 0 N--CA 1.513 2.724 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 173.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 43.4 t -67.12 -22.51 29.38 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.25 0 CA-C-O 117.645 -1.169 . . . . 0.0 112.631 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -78.03 -51.45 10.31 Favored 'General case' 0 N--CA 1.528 3.44 0 CA-C-N 120.202 1.364 . . . . 0.0 109.153 -177.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . 0.454 HD23 ' HB ' ' A' ' 103' ' ' VAL . 5.0 mp -75.71 -18.84 59.46 Favored 'General case' 0 N--CA 1.524 3.249 0 O-C-N 123.395 0.434 . . . . 0.0 109.979 176.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 526' ' ' LEU . . . . . 0.444 HD23 ' O ' ' B' ' 522' ' ' PHE . 0.4 OUTLIER -71.89 -32.84 67.83 Favored 'General case' 0 N--CA 1.524 3.228 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 173.873 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -65.02 -26.35 68.23 Favored 'General case' 0 N--CA 1.518 2.966 0 CA-C-O 118.398 -0.81 . . . . 0.0 110.386 176.173 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -66.6 -41.93 87.67 Favored 'General case' 1 N--CA 1.54 4.071 0 CA-C-N 119.088 0.858 . . . . 0.0 108.861 176.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 529' ' ' ALA . . . . . 0.658 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -88.11 -10.47 49.96 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 118.035 -0.983 . . . . 0.0 111.548 178.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -81.31 -34.3 31.99 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-N 120.925 1.693 . . . . 0.0 108.864 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -60.31 -43.02 96.71 Favored 'General case' 0 N--CA 1.538 3.972 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 177.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 61.5 m-80 -92.96 -85.81 0.26 Allowed 'General case' 0 N--CA 1.516 2.864 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 177.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.9 p30 150.14 48.98 0.0 OUTLIER 'General case' 1 N--CA 1.559 5.017 0 C-N-CA 127.89 2.476 . . . . 0.0 108.245 177.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 534' ' ' LEU . . . . . 0.528 HD22 ' CD2' ' A' ' 96' ' ' LEU . 6.0 mt -105.45 7.7 33.21 Favored 'General case' 0 N--CA 1.53 3.564 0 C-N-CA 124.3 1.04 . . . . 0.0 111.012 -179.339 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 535' ' ' HIS . . . . . 0.615 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 46.6 p-80 -82.52 0.47 42.39 Favored 'General case' 0 N--CA 1.508 2.469 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 175.103 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 536' ' ' LEU . . . . . . . . . . . . . 42.5 mt -92.93 -49.16 0.29 Allowed Pre-proline 0 N--CA 1.508 2.458 0 CA-C-O 116.391 -1.766 . . . . 0.0 109.282 -176.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 537' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -67.11 -37.01 19.9 Favored 'Trans proline' 0 C--N 1.394 2.921 0 N-CA-C 107.179 -1.893 . . . . 0.0 107.179 171.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.85 -43.69 98.0 Favored 'General case' 0 N--CA 1.529 3.507 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 176.455 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 11.6 mt -66.36 -31.04 71.57 Favored 'General case' 0 N--CA 1.537 3.893 0 CA-C-O 118.865 -0.588 . . . . 0.0 110.781 179.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -54.63 -23.48 17.28 Favored 'General case' 1 N--CA 1.542 4.158 0 CA-C-N 118.952 0.796 . . . . 0.0 111.996 178.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 541' ' ' LEU . . . . . 0.7 HD11 HG11 ' A' ' 58' ' ' VAL . 0.0 OUTLIER -102.18 -41.34 6.43 Favored 'General case' 0 N--CA 1.519 2.98 0 C-N-CA 123.734 0.814 . . . . 0.0 109.297 -179.553 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 542' ' ' MET . . . . . 0.665 ' N ' HD13 ' B' ' 541' ' ' LEU . 4.3 ptt? -101.46 25.11 8.74 Favored 'General case' 1 N--CA 1.541 4.108 0 CA-C-N 119.061 0.846 . . . . 0.0 112.789 -178.427 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 543' ' ' LEU . . . . . 0.409 ' O ' HG23 ' B' ' 544' ' ' THR . 18.7 tp -131.64 -96.43 0.34 Allowed 'General case' 0 N--CA 1.536 3.84 0 CA-C-O 117.559 -1.21 . . . . 0.0 112.67 178.465 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 544' ' ' THR . . . . . 0.409 HG23 ' O ' ' B' ' 543' ' ' LEU . 18.1 p 129.14 140.23 0.0 OUTLIER Pre-proline 1 N--CA 1.558 4.952 0 C-N-CA 128.727 2.811 . . . . 0.0 106.94 -177.145 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -57.49 -32.56 94.5 Favored 'Trans proline' 0 N--CA 1.521 3.098 0 C-N-CA 122.84 2.36 . . . . 0.0 113.368 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -63.17 -34.76 78.32 Favored 'General case' 1 N--CA 1.539 4.024 0 CA-C-O 118.886 -0.578 . . . . 0.0 111.02 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -68.67 -40.97 79.91 Favored 'General case' 0 N--CA 1.53 3.534 0 CA-C-O 118.469 -0.777 . . . . 0.0 110.759 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 19.8 ptt180 -76.21 -20.5 57.41 Favored 'General case' 0 N--CA 1.529 3.519 0 CA-C-O 118.045 -0.979 . . . . 0.0 111.592 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -69.17 -44.26 72.57 Favored 'General case' 0 N--CA 1.536 3.842 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 174.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -80.18 -11.12 59.77 Favored 'General case' 0 N--CA 1.512 2.66 0 CA-C-O 117.736 -1.126 . . . . 0.0 111.538 177.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 551' ' ' LEU . . . . . 0.761 HD22 ' CE3' ' A' ' 19' ' ' TRP . 10.2 tp -77.23 -44.04 31.41 Favored 'General case' 0 N--CA 1.528 3.43 0 CA-C-N 120.779 1.627 . . . . 0.0 107.827 176.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -69.78 -49.23 37.22 Favored Glycine 0 N--CA 1.506 3.309 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 553' ' ' THR . . . . . 0.458 HG21 ' HB2' ' B' ' 577' ' ' ALA . 2.6 m -65.21 -33.81 76.88 Favored 'General case' 0 N--CA 1.532 3.667 0 CA-C-O 118.535 -0.745 . . . . 0.0 112.037 -178.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 22.6 mtt180 -65.31 -52.34 54.71 Favored 'General case' 1 N--CA 1.541 4.082 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 176.294 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 555' ' ' VAL . . . . . 0.55 HG21 ' HB2' ' A' ' 22' ' ' PHE . 17.5 t -64.86 -16.81 20.51 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.806 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.559 177.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 11.4 mmt180 -79.11 -43.49 23.98 Favored 'General case' 0 N--CA 1.52 3.03 0 CA-C-N 119.884 1.22 . . . . 0.0 110.5 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 557' ' ' ILE . . . . . 0.537 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -75.94 -25.68 17.23 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.93 0 CA-C-N 120.124 1.329 . . . . 0.0 111.421 -178.89 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 558' ' ' VAL . . . . . 0.537 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -86.43 -51.42 13.16 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.902 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 -178.708 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -61.08 -28.28 68.97 Favored 'General case' 0 N--CA 1.527 3.381 0 CA-C-O 118.6 -0.714 . . . . 0.0 110.326 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -89.49 -22.64 22.36 Favored 'General case' 0 N--CA 1.522 3.156 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.326 177.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.14 -46.62 70.31 Favored 'General case' 1 N--CA 1.543 4.185 0 CA-C-N 119.749 1.159 . . . . 0.0 108.379 177.503 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 15.2 mt -50.25 -28.61 7.97 Favored 'General case' 0 N--CA 1.537 3.911 0 C-N-CA 124.048 0.939 . . . . 0.0 111.978 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 24.8 mmm180 -82.61 -52.73 6.54 Favored 'General case' 0 N--CA 1.526 3.369 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 66.02 83.71 0.1 OUTLIER Glycine 1 N--CA 1.524 4.559 0 CA-C-O 119.308 -0.718 . . . . 0.0 112.949 177.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -161.8 -52.26 0.04 OUTLIER 'General case' 0 N--CA 1.528 3.46 0 CA-C-N 117.581 0.69 . . . . 0.0 109.729 178.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 86.9 mtp -145.02 54.53 1.22 Allowed 'General case' 0 N--CA 1.525 3.299 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 75.7 p -130.75 -4.88 4.09 Favored 'General case' 0 N--CA 1.522 3.16 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -176.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -107.29 -57.81 2.03 Favored 'General case' 0 N--CA 1.527 3.387 0 CA-C-N 119.938 1.244 . . . . 0.0 111.238 -178.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 3.5 ttm180 -99.53 -51.4 3.78 Favored 'General case' 0 N--CA 1.529 3.512 0 C-N-CA 123.234 0.613 . . . . 0.0 110.617 -177.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -73.73 3.77 6.03 Favored 'General case' 0 N--CA 1.515 2.797 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -176.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 571' ' ' LEU . . . . . 0.556 HD23 HD11 ' B' ' 582' ' ' ILE . 45.8 tp -91.12 -56.01 3.32 Favored 'General case' 0 N--CA 1.526 3.349 0 CA-C-N 120.219 1.372 . . . . 0.0 113.299 -178.585 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -30.12 -34.19 0.01 OUTLIER 'General case' 1 N--CA 1.551 4.615 0 N-CA-C 117.662 2.468 . . . . 0.0 117.662 -174.67 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -55.23 -20.36 10.63 Favored 'General case' 1 N--CA 1.545 4.276 0 CA-C-N 119.155 0.889 . . . . 0.0 112.779 -179.331 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -101.95 -83.1 0.47 Allowed 'General case' 0 N--CA 1.509 2.485 0 C-N-CA 124.287 1.035 . . . . 0.0 109.143 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 55.4 mt -139.17 17.85 2.6 Favored 'General case' 0 N--CA 1.53 3.529 0 CA-C-N 119.14 0.882 . . . . 0.0 111.51 -179.086 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . -47.68 -28.75 5.39 Favored Glycine 1 N--CA 1.548 6.138 0 O-C-N 120.866 -1.146 . . . . 0.0 113.851 -179.164 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 577' ' ' ALA . . . . . 0.458 ' HB2' HG21 ' B' ' 553' ' ' THR . . . 67.5 39.99 2.72 Favored 'General case' 1 N--CA 1.545 4.288 0 CA-C-N 118.539 1.17 . . . . 0.0 112.071 178.523 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 86.21 167.4 43.51 Favored Glycine 1 N--CA 1.519 4.195 0 CA-C-O 119.449 -0.639 . . . . 0.0 112.317 178.182 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 36.2 mm -84.63 -17.79 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.709 0 CA-C-N 118.621 1.21 . . . . 0.0 108.466 176.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 580' ' ' ALA . . . . . . . . . . . . . . . -63.82 -39.39 94.12 Favored 'General case' 0 N--CA 1.523 3.218 0 CA-C-N 120.17 1.35 . . . . 0.0 110.097 177.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 15.2 p -77.44 -40.69 42.48 Favored 'General case' 1 N--CA 1.542 4.134 0 CA-C-N 119.208 0.913 . . . . 0.0 111.64 178.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 582' ' ' ILE . . . . . 0.556 HD11 HD23 ' B' ' 571' ' ' LEU . 1.1 tt -63.31 -36.8 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.258 0 C-N-CA 123.563 0.745 . . . . 0.0 112.682 -175.082 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 41.3 p -99.24 -30.15 12.42 Favored 'General case' 0 N--CA 1.513 2.722 0 CA-C-O 118.053 -0.975 . . . . 0.0 111.428 -178.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 21.3 ptt180 -71.91 -22.66 61.45 Favored 'General case' 0 N--CA 1.533 3.676 0 CA-C-N 119.891 1.223 . . . . 0.0 109.411 175.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -77.99 -28.06 57.17 Favored Glycine 0 N--CA 1.511 3.662 0 N-CA-C 109.428 -1.469 . . . . 0.0 109.428 176.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 10.9 m -63.16 -40.35 97.31 Favored 'General case' 0 N--CA 1.537 3.9 0 CA-C-N 118.239 1.019 . . . . 0.0 111.074 179.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -61.24 -24.93 66.72 Favored 'General case' 1 N--CA 1.54 4.03 0 CA-C-O 118.783 -0.627 . . . . 0.0 112.318 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 7.8 m -64.12 -41.88 97.07 Favored 'General case' 1 N--CA 1.541 4.093 0 CA-C-N 118.726 0.694 . . . . 0.0 110.663 179.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 42.1 mt -54.7 -43.3 72.41 Favored 'General case' 0 N--CA 1.531 3.588 0 C-N-CA 124.406 1.082 . . . . 0.0 111.944 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.86 -31.98 73.12 Favored 'General case' 1 N--CA 1.541 4.117 0 C-N-CA 123.339 0.656 . . . . 0.0 112.382 -178.83 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -74.35 -35.1 63.55 Favored 'General case' 0 N--CA 1.525 3.281 0 CA-C-N 118.352 0.524 . . . . 0.0 111.983 -179.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . 0.803 ' HB2' HD11 ' A' ' 41' ' ' LEU . . . -45.07 163.61 0.2 Allowed Pre-proline 1 N--CA 1.548 4.452 0 N-CA-C 115.207 1.558 . . . . 0.0 115.207 -178.837 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 593' ' ' PRO . . . . . 0.44 ' O ' ' HB2' ' B' ' 597' ' ' ARG . 60.1 Cg_endo -86.81 173.82 5.89 Favored 'Trans proline' 0 C--N 1.38 2.229 0 C-N-CA 122.125 1.884 . . . . 0.0 107.407 174.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.9 t -98.92 -27.62 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.311 0 CA-C-N 120.188 1.358 . . . . 0.0 111.662 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -62.55 -43.4 98.91 Favored 'General case' 0 N--CA 1.517 2.905 0 CA-C-N 120.079 1.309 . . . . 0.0 110.792 -178.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 596' ' ' LEU . . . . . 0.488 ' CD2' HD22 ' A' ' 34' ' ' LEU . 7.2 mp -99.97 -14.35 18.72 Favored 'General case' 0 N--CA 1.511 2.61 0 CA-C-O 118.723 -0.656 . . . . 0.0 112.26 179.382 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' B' ' 593' ' ' PRO . 0.0 OUTLIER -68.07 -30.17 69.3 Favored 'General case' 0 N--CA 1.538 3.927 0 N-CA-C 103.245 -2.872 . . . . 0.0 103.245 168.412 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -54.73 -37.97 66.55 Favored 'General case' 0 N--CA 1.521 3.115 0 C-N-CA 123.868 0.867 . . . . 0.0 110.094 173.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 599' ' ' TRP . . . . . 0.633 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 43.3 t90 -63.06 -38.41 91.07 Favored 'General case' 0 N--CA 1.536 3.828 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 177.262 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.85 -36.86 59.49 Favored 'General case' 0 N--CA 1.535 3.796 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 177.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -70.12 -36.24 74.67 Favored 'General case' 1 N--CA 1.541 4.117 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 175.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -62.27 -23.82 66.92 Favored 'General case' 1 N--CA 1.543 4.199 0 C-N-CA 123.619 0.768 . . . . 0.0 110.402 176.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 603' ' ' VAL . . . . . 0.51 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.1 OUTLIER -115.73 9.79 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.497 0 C-N-CA 123.163 0.585 . . . . 0.0 111.832 -177.501 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 26.7 mt -110.03 -63.1 1.42 Allowed 'General case' 0 N--CA 1.519 2.977 0 N-CA-C 105.281 -2.118 . . . . 0.0 105.281 175.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.525 3.285 0 C-N-CA 124.484 1.114 . . . . 0.0 109.932 179.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.412 -10.642 2 O4'-C1'-N19 118.852 13.814 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.343 4 O4'-C1'-N19 119.704 14.88 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.452 4 C4'-C3'-C2' 116.902 13.702 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . 0.407 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 6 O3'--C3' 1.565 10.289 4 O4'-C1'-N19 118.995 13.994 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' E' E ' 5' ' ' ' DC' . . . . . 0.66 ' H41' ' HA ' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.4 -11.793 5 O4'-C1'-N19 120.347 15.683 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.348 4 O4'-C1'-N19 120.115 15.394 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' E' E ' 7' ' ' ' DA' . . . . . 0.557 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.413 -10.509 5 N19-C1'-C2' 133.022 11.764 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' E' E ' 8' ' ' ' DG' . . . . . 0.557 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 5 C3'--C2' 1.421 -9.688 4 O4'-C1'-N19 119.673 14.842 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.409 -10.901 3 C4'-C3'-C2' 117.289 14.089 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.409 -10.919 3 O4'-C1'-N19 119.083 14.104 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.417 -10.078 4 O4'-C1'-N19 121.038 16.547 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.4 -11.753 2 O4'-C1'-N19 119.961 15.201 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.553 9.388 5 O4'-C1'-N19 123.301 19.376 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' E' E ' 14' ' ' ' DT' . . . . . 0.727 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 5 C3'--C2' 1.407 -11.136 5 O4'-C1'-N19 119.87 15.087 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' E' E ' 15' ' ' ' DA' . . . . . 0.769 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.419 -9.937 5 O4'-C1'-N19 120.292 15.615 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.413 -10.51 4 O4'-C1'-N19 120.331 15.663 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.576 11.189 5 O4'-C1'-N19 119.761 14.951 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.401 4 O4'-C1'-N19 120.783 16.229 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.607 3 O4'-C1'-N19 119.738 14.922 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.507 6.679 4 O4'-C1'-N19 119.506 14.632 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.361 3 O4'-C1'-N19 119.528 14.66 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.406 -11.241 5 O4'-C1'-N19 119.433 14.541 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.874 3 O4'-C1'-N19 119.866 15.083 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' F' F ' 4' ' ' ' DA' . . . . . 0.548 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 5 C3'--C2' 1.42 -9.83 4 O4'-C1'-N19 119.757 14.946 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' F' F ' 5' ' ' ' DC' . . . . . 0.46 ' H41' ' HA ' ' A' ' 80' ' ' ALA . . . . . . . . 6 O3'--C3' 1.575 11.048 4 O4'-C1'-N19 118.312 13.14 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.406 -11.174 3 O4'-C1'-N19 119.243 14.304 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.412 -11.625 4 N19-C1'-C2' 131.312 10.695 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.351 4 O4'-C1'-N19 119.423 14.529 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.503 4 O4'-C1'-N19 120.356 15.695 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.409 -10.899 4 O4'-C1'-N19 118.821 13.776 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.331 4 O4'-C1'-N19 120.417 15.771 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.228 5 C4'-C3'-C2' 117.227 14.027 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 4 O3'--C3' 1.551 9.195 4 O4'-C1'-N19 119.845 15.057 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' F' F ' 14' ' ' ' DT' . . . . . 0.56 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.41 -10.765 5 O4'-C1'-N19 118.762 13.703 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' F' F ' 15' ' ' ' DA' . . . . . 0.969 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 5 C3'--C2' 1.426 -9.212 3 O4'-C1'-N19 119.624 14.78 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.866 4 O4'-C1'-N19 119.401 14.502 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.647 3 O4'-C1'-N19 118.716 13.645 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.463 4 O4'-C1'-N19 120.21 15.513 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.564 10.253 3 O4'-C1'-N19 120.01 15.263 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C4'--C3' 1.598 6.954 5 O4'-C1'-N19 118.173 12.967 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 . . . . . 0 N--CA 1.499 1.977 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.6 t -144.21 129.82 9.73 Favored Pre-proline 0 N--CA 1.524 3.256 0 CA-C-O 117.298 -1.334 . . . . 0.0 110.134 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -72.4 -50.07 0.25 Allowed 'Trans proline' 0 C--N 1.392 2.822 0 C-N-CA 122.542 2.161 . . . . 0.0 110.213 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -120.85 140.92 51.1 Favored 'General case' 0 N--CA 1.528 3.463 0 C-N-CA 123.18 0.592 . . . . 0.0 110.218 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 46.8 m 66.56 125.79 0.02 OUTLIER 'General case' 0 N--CA 1.537 3.885 0 C-N-CA 124.584 1.154 . . . . 0.0 110.519 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -128.12 120.63 27.76 Favored 'General case' 0 N--CA 1.521 3.076 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 63.18 122.49 0.02 OUTLIER 'General case' 0 N--CA 1.534 3.748 0 C-N-CA 124.662 1.185 . . . . 0.0 111.323 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 36.6 ttp -103.15 124.8 49.27 Favored 'General case' 0 N--CA 1.518 2.931 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -145.05 -50.77 0.26 Allowed 'General case' 0 N--CA 1.521 3.088 0 C-N-CA 122.687 0.395 . . . . 0.0 110.203 -179.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 65.57 124.8 0.02 OUTLIER 'General case' 0 N--CA 1.536 3.86 0 C-N-CA 124.519 1.128 . . . . 0.0 110.484 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -158.36 134.38 9.17 Favored 'General case' 0 N--CA 1.53 3.534 0 C-N-CA 122.703 0.401 . . . . 0.0 110.793 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 -144.45 136.07 25.75 Favored 'General case' 0 N--CA 1.526 3.345 0 C-N-CA 122.605 0.362 . . . . 0.0 111.32 -179.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.451 ' O ' HD23 ' A' ' 20' ' ' LEU . 3.6 t60 -98.08 118.45 34.73 Favored 'General case' 0 N--CA 1.523 3.188 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 179.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -113.58 77.72 1.08 Allowed 'General case' 0 N--CA 1.526 3.37 0 CA-C-O 121.978 0.895 . . . . 0.0 110.739 -178.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.47 ' O ' HD21 ' B' ' 551' ' ' LEU . 44.2 mt-10 -149.9 -68.74 0.2 Allowed 'General case' 0 N--CA 1.531 3.594 0 N-CA-C 106.908 -1.516 . . . . 0.0 106.908 178.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.711 ' N ' HD11 ' B' ' 551' ' ' LEU . 68.5 t-105 -57.23 -21.09 31.44 Favored 'General case' 0 N--CA 1.534 3.771 0 CA-C-O 118.073 -0.965 . . . . 0.0 111.76 175.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.563 HD22 ' N ' ' A' ' 20' ' ' LEU . 2.3 mm? -91.29 -30.6 16.5 Favored 'General case' 0 N--CA 1.529 3.476 0 CA-C-O 118.182 -0.913 . . . . 0.0 111.861 -177.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.9 mtt180 -64.12 -26.82 68.71 Favored 'General case' 0 N--CA 1.535 3.796 0 N-CA-C 106.122 -1.807 . . . . 0.0 106.122 172.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.465 ' O ' HD23 ' A' ' 26' ' ' LEU . 9.4 t80 -83.21 -32.74 26.36 Favored 'General case' 0 N--CA 1.506 2.361 0 CA-C-O 116.739 -1.6 . . . . 0.0 108.564 174.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.687 HG23 ' O ' ' A' ' 19' ' ' TRP . 61.3 t -76.25 -25.25 16.55 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.227 0 CA-C-N 121.682 2.037 . . . . 0.0 112.885 -177.933 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -77.97 -43.79 28.64 Favored 'General case' 0 N--CA 1.532 3.648 0 CA-C-N 120.454 1.479 . . . . 0.0 108.83 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.4 mp -71.43 -27.2 63.12 Favored 'General case' 0 N--CA 1.53 3.557 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 176.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.465 HD23 ' O ' ' A' ' 22' ' ' PHE . 1.2 mm? -67.57 -35.82 79.76 Favored 'General case' 0 N--CA 1.53 3.55 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 176.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.9 ttmt -68.66 -25.68 64.94 Favored 'General case' 0 N--CA 1.515 2.781 0 CA-C-O 118.074 -0.965 . . . . 0.0 110.931 177.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -70.39 -38.51 74.71 Favored 'General case' 0 N--CA 1.533 3.676 0 CA-C-N 119.435 1.016 . . . . 0.0 109.434 178.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.555 ' HB1' ' N ' ' A' ' 35' ' ' HIS . . . -89.59 -8.85 51.71 Favored 'General case' 0 N--CA 1.499 2.02 0 CA-C-O 118.371 -0.823 . . . . 0.0 110.762 178.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -79.01 -33.82 44.55 Favored 'General case' 0 N--CA 1.53 3.526 0 CA-C-N 120.136 1.335 . . . . 0.0 108.994 179.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -65.61 -43.74 88.69 Favored 'General case' 0 N--CA 1.535 3.818 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 66.9 m-80 -88.28 -88.7 0.14 Allowed 'General case' 0 N--CA 1.513 2.704 0 N-CA-C 106.341 -1.726 . . . . 0.0 106.341 176.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.8 p30 152.9 48.46 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.039 0 C-N-CA 127.318 2.247 . . . . 0.0 108.418 177.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.439 HD22 ' CD2' ' B' ' 596' ' ' LEU . 6.6 mt -109.99 14.06 23.15 Favored 'General case' 0 N--CA 1.528 3.435 0 C-N-CA 124.493 1.117 . . . . 0.0 110.456 -178.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.555 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 30.2 p-80 -81.43 3.65 23.81 Favored 'General case' 0 N--CA 1.518 2.939 0 C-N-CA 123.381 0.672 . . . . 0.0 109.352 175.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.766 ' HA ' HD23 ' A' ' 39' ' ' LEU . 22.9 mt -94.03 -51.46 0.26 Allowed Pre-proline 0 N--CA 1.507 2.382 0 CA-C-O 116.857 -1.544 . . . . 0.0 108.565 -175.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.457 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 8.2 Cg_exo -61.63 -32.61 87.36 Favored 'Trans proline' 0 C--N 1.397 3.101 0 N-CA-C 106.257 -2.247 . . . . 0.0 106.257 169.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.7 tt -60.25 -46.34 90.14 Favored 'General case' 0 N--CA 1.529 3.518 0 C-N-CA 124.598 1.159 . . . . 0.0 109.05 174.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.766 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.0 OUTLIER -74.35 -12.26 60.48 Favored 'General case' 0 N--CA 1.533 3.7 0 CA-C-O 118.526 -0.749 . . . . 0.0 111.199 179.664 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -87.84 -19.18 27.79 Favored 'General case' 0 N--CA 1.514 2.75 0 CA-C-O 117.282 -1.342 . . . . 0.0 111.273 178.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -113.93 -23.7 9.46 Favored 'General case' 0 N--CA 1.534 3.729 0 CA-C-N 120.591 1.541 . . . . 0.0 114.038 -178.301 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 23.6 ptp -129.23 27.76 5.32 Favored 'General case' 1 N--CA 1.546 4.33 0 CA-C-N 120.6 1.545 . . . . 0.0 111.46 178.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.461 HD22 ' HB2' ' A' ' 39' ' ' LEU . 0.7 OUTLIER -135.16 -68.25 0.53 Allowed 'General case' 0 N--CA 1.515 2.795 0 CA-C-O 117.922 -1.037 . . . . 0.0 109.233 177.923 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 25.5 p 121.47 160.59 0.0 OUTLIER Pre-proline 1 N--CA 1.571 5.624 0 C-N-CA 128.003 2.521 . . . . 0.0 109.8 -179.232 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -68.14 -28.62 34.21 Favored 'Trans proline' 0 C--N 1.394 2.942 0 C-N-CA 122.3 2.0 . . . . 0.0 109.297 175.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -66.95 -19.05 65.65 Favored 'General case' 0 N--CA 1.532 3.636 0 CA-C-O 118.407 -0.806 . . . . 0.0 110.462 176.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.448 ' HB3' HD23 ' A' ' 43' ' ' LEU . 7.7 mm-40 -75.7 -29.67 59.05 Favored 'General case' 0 N--CA 1.525 3.281 0 CA-C-O 117.853 -1.07 . . . . 0.0 109.656 178.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 12.7 ptt180 -91.35 -14.32 30.93 Favored 'General case' 0 N--CA 1.535 3.806 0 CA-C-N 119.39 0.996 . . . . 0.0 108.535 173.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -79.8 -22.81 42.64 Favored 'General case' 0 N--CA 1.518 2.953 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 173.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -93.96 -36.04 12.36 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 123.854 0.862 . . . . 0.0 109.156 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.495 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 18.1 tp -75.05 -25.5 58.71 Favored 'General case' 0 N--CA 1.533 3.699 0 N-CA-C 106.684 -1.598 . . . . 0.0 106.684 174.181 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.452 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -69.8 -70.91 1.08 Allowed Glycine 0 N--CA 1.503 3.164 0 C-N-CA 125.39 1.471 . . . . 0.0 111.492 177.615 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.5 m -71.83 -27.13 62.7 Favored 'General case' 0 N--CA 1.532 3.635 0 CA-C-O 118.008 -0.996 . . . . 0.0 113.009 -176.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 39.6 mtt180 -74.31 -45.46 47.27 Favored 'General case' 0 N--CA 1.524 3.251 0 CA-C-N 120.12 1.327 . . . . 0.0 108.195 178.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 30.9 t -64.89 -18.12 23.03 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.002 0 O-C-N 120.636 -1.29 . . . . 0.0 109.164 174.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.31 -50.73 20.55 Favored 'General case' 0 N--CA 1.531 3.602 0 CA-C-N 119.734 1.152 . . . . 0.0 111.571 177.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.462 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -70.75 -22.57 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.823 0 CA-C-N 120.779 1.627 . . . . 0.0 111.826 -178.55 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -87.54 -51.49 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.986 0 CA-C-N 120.257 1.389 . . . . 0.0 107.688 -179.014 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -61.13 -22.03 64.3 Favored 'General case' 0 N--CA 1.531 3.594 0 CA-C-O 118.782 -0.627 . . . . 0.0 110.576 177.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -95.27 -24.05 16.95 Favored 'General case' 0 N--CA 1.52 3.046 0 CA-C-O 118.089 -0.958 . . . . 0.0 110.8 178.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.3 tp -77.01 -57.29 3.93 Favored 'General case' 0 N--CA 1.535 3.787 0 CA-C-N 119.662 1.119 . . . . 0.0 108.484 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 42.5 mt -45.97 -29.82 1.58 Allowed 'General case' 1 N--CA 1.544 4.262 0 C-N-CA 124.775 1.23 . . . . 0.0 112.858 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.89 -53.23 5.23 Favored 'General case' 0 N--CA 1.519 3.02 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.11 80.29 0.82 Allowed Glycine 0 N--CA 1.512 3.704 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 179.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -138.41 -59.4 0.63 Allowed 'General case' 0 N--CA 1.526 3.327 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 87.7 mtp -149.51 76.13 1.3 Allowed 'General case' 0 N--CA 1.525 3.304 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.491 ' HA ' HD22 ' A' ' 71' ' ' LEU . 5.6 t -142.02 3.64 1.61 Allowed 'General case' 0 N--CA 1.524 3.271 0 N-CA-C 114.245 1.202 . . . . 0.0 114.245 -176.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -116.21 -55.29 2.41 Favored 'General case' 0 N--CA 1.526 3.333 0 CA-C-N 120.018 1.281 . . . . 0.0 112.124 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -110.63 -57.23 2.25 Favored 'General case' 0 N--CA 1.527 3.424 0 C-N-CA 123.198 0.599 . . . . 0.0 111.233 -176.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -74.11 -4.85 38.16 Favored 'General case' 0 N--CA 1.518 2.968 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.638 HD23 HG21 ' A' ' 82' ' ' ILE . 60.8 tp -76.71 -48.32 19.19 Favored 'General case' 0 N--CA 1.525 3.293 0 CA-C-N 119.91 1.232 . . . . 0.0 111.446 -178.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -35.65 -40.48 0.17 Allowed 'General case' 1 N--CA 1.541 4.102 0 N-CA-C 115.514 1.672 . . . . 0.0 115.514 -175.903 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -78.03 -40.31 39.24 Favored 'General case' 0 N--CA 1.529 3.524 0 CA-C-N 118.126 0.421 . . . . 0.0 110.811 -178.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -51.97 -35.19 45.44 Favored 'General case' 0 N--CA 1.531 3.576 0 C-N-CA 124.174 0.99 . . . . 0.0 113.149 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.3 pp -132.98 -44.94 0.86 Allowed 'General case' 0 N--CA 1.533 3.712 0 CA-C-N 118.76 0.709 . . . . 0.0 111.588 -179.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 104.93 73.96 0.93 Allowed Glycine 1 N--CA 1.528 4.803 0 CA-C-N 118.975 0.807 . . . . 0.0 112.099 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.08 -12.01 6.41 Favored 'General case' 0 N--CA 1.531 3.621 0 CA-C-N 117.886 0.843 . . . . 0.0 112.831 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 86.59 167.12 43.29 Favored Glycine 1 N--CA 1.532 5.09 0 CA-C-N 119.634 1.106 . . . . 0.0 111.128 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.548 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.5 OUTLIER -87.05 -20.81 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.337 0 CA-C-N 119.483 1.641 . . . . 0.0 109.107 179.069 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.769 ' HB2' ' H62' ' E' ' 15' ' ' ' DA' . . . -67.05 -30.87 71.06 Favored 'General case' 0 N--CA 1.525 3.317 0 CA-C-N 120.145 1.338 . . . . 0.0 111.995 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.5 p -83.53 -43.17 16.03 Favored 'General case' 1 N--CA 1.55 4.534 0 CA-C-N 120.249 1.386 . . . . 0.0 111.16 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.638 HG21 HD23 ' A' ' 71' ' ' LEU . 14.9 pt -70.8 -18.56 20.99 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.031 0 CA-C-O 117.958 -1.02 . . . . 0.0 112.98 -177.655 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 59.1 p -109.68 -31.91 7.29 Favored 'General case' 0 N--CA 1.516 2.871 0 CA-C-N 119.656 1.116 . . . . 0.0 110.688 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.2 ptt180 -73.22 -25.55 60.79 Favored 'General case' 0 N--CA 1.535 3.821 0 CA-C-N 119.475 1.034 . . . . 0.0 108.435 175.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -62.79 -31.35 79.97 Favored Glycine 1 N--CA 1.522 4.413 0 N-CA-C 108.991 -1.644 . . . . 0.0 108.991 175.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 18.3 m -63.1 -41.54 99.4 Favored 'General case' 0 N--CA 1.538 3.943 0 CA-C-N 118.004 0.902 . . . . 0.0 109.335 176.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -55.25 -28.01 50.41 Favored 'General case' 1 N--CA 1.547 4.423 0 C-N-CA 123.941 0.896 . . . . 0.0 111.942 178.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.434 ' HB3' ' HA ' ' B' ' 541' ' ' LEU . 39.4 m -65.81 -40.42 91.86 Favored 'General case' 0 N--CA 1.534 3.739 0 C-N-CA 123.193 0.597 . . . . 0.0 111.049 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.7 mt -58.92 -41.48 87.39 Favored 'General case' 0 N--CA 1.534 3.74 0 C-N-CA 124.291 1.036 . . . . 0.0 111.021 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.49 -21.02 65.18 Favored 'General case' 1 N--CA 1.54 4.025 0 CA-C-O 118.458 -0.782 . . . . 0.0 112.61 -179.636 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.59 -42.41 11.42 Favored 'General case' 0 N--CA 1.517 2.896 0 CA-C-N 118.915 0.78 . . . . 0.0 111.367 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.54 158.19 8.58 Favored Pre-proline 1 N--CA 1.542 4.165 0 CA-C-O 118.308 -0.853 . . . . 0.0 112.857 -179.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -84.66 170.2 10.33 Favored 'Trans proline' 0 C--N 1.377 2.048 0 C-N-CA 122.215 1.944 . . . . 0.0 110.401 178.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.462 ' HA ' ' HB3' ' A' ' 97' ' ' ARG . 2.9 t -90.83 -25.36 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.074 0 CA-C-O 117.912 -1.042 . . . . 0.0 111.543 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -61.91 -43.85 98.0 Favored 'General case' 0 N--CA 1.516 2.851 0 CA-C-N 119.966 1.257 . . . . 0.0 110.135 -179.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.5 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.3 mp -99.07 -16.09 18.78 Favored 'General case' 0 N--CA 1.511 2.588 0 C-N-CA 123.344 0.658 . . . . 0.0 111.704 178.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.462 ' HB3' ' HA ' ' A' ' 94' ' ' VAL . 0.2 OUTLIER -68.12 -26.25 65.71 Favored 'General case' 1 N--CA 1.541 4.084 0 N-CA-C 103.809 -2.663 . . . . 0.0 103.809 169.174 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -57.5 -40.1 77.92 Favored 'General case' 0 N--CA 1.516 2.874 0 C-N-CA 123.688 0.795 . . . . 0.0 109.519 174.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.635 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 57.2 t90 -63.93 -34.98 79.2 Favored 'General case' 0 N--CA 1.527 3.419 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 177.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.57 -38.73 60.52 Favored 'General case' 0 N--CA 1.536 3.835 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 176.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -67.61 -38.61 84.19 Favored 'General case' 1 N--CA 1.545 4.286 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 175.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 1.0 OUTLIER -59.31 -22.7 61.63 Favored 'General case' 1 N--CA 1.549 4.475 0 C-N-CA 123.633 0.773 . . . . 0.0 110.391 175.732 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.538 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.3 OUTLIER -122.58 5.25 5.64 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.259 0 C-N-CA 123.468 0.707 . . . . 0.0 112.682 -177.336 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.85 -55.89 2.34 Favored 'General case' 0 N--CA 1.516 2.863 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 175.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 5.4 tt -57.45 -47.99 80.35 Favored 'General case' 0 N--CA 1.534 3.762 0 C-N-CA 125.181 1.392 . . . . 0.0 110.802 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 41.6 tttm -91.71 -64.55 1.1 Allowed 'General case' 0 N--CA 1.524 3.27 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 51.0 m . . . . . 1 N--CA 1.54 4.058 0 C-N-CA 124.568 1.147 . . . . 0.0 111.461 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 . . . . . 0 N--CA 1.505 2.279 0 CA-C-O 119.509 -0.282 . . . . 0.0 110.285 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 53.3 p -156.17 123.35 2.71 Favored Pre-proline 0 N--CA 1.522 3.152 0 CA-C-O 117.05 -1.452 . . . . 0.0 110.364 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_endo -69.12 146.28 63.64 Favored 'Trans proline' 0 C--N 1.394 2.935 0 C-N-CA 122.513 2.142 . . . . 0.0 110.945 179.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -74.23 -64.57 0.99 Allowed 'General case' 0 N--CA 1.534 3.737 0 CA-C-O 119.091 -0.48 . . . . 0.0 110.496 -178.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 66.9 m -133.22 125.65 29.86 Favored 'General case' 0 N--CA 1.523 3.189 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -159.05 -48.43 0.06 Allowed 'General case' 0 N--CA 1.525 3.291 0 C-N-CA 122.444 0.298 . . . . 0.0 110.917 -178.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -75.21 142.62 43.42 Favored 'General case' 0 N--CA 1.526 3.358 0 O-C-N 123.296 0.373 . . . . 0.0 111.434 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 48.6 mmm 79.23 -71.64 0.09 Allowed 'General case' 0 N--CA 1.538 3.967 0 C-N-CA 125.563 1.545 . . . . 0.0 111.341 179.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -124.48 138.9 54.31 Favored 'General case' 0 N--CA 1.525 3.307 0 CA-C-N 118.882 0.765 . . . . 0.0 111.699 -178.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -104.32 -49.14 3.65 Favored 'General case' 0 N--CA 1.524 3.266 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -99.6 134.81 41.94 Favored 'General case' 0 N--CA 1.525 3.325 0 C-N-CA 123.286 0.635 . . . . 0.0 109.36 179.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 40.0 ttt180 -95.78 128.28 42.52 Favored 'General case' 0 N--CA 1.523 3.183 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 82.9 m-70 -97.95 120.98 39.31 Favored 'General case' 0 N--CA 1.523 3.205 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -115.12 -40.64 3.44 Favored 'General case' 0 N--CA 1.52 3.026 0 CA-C-O 118.353 -0.832 . . . . 0.0 112.66 -177.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -119.38 -82.37 0.64 Allowed 'General case' 0 N--CA 1.532 3.633 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -175.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 519' ' ' TRP . . . . . 0.678 ' CE2' HD22 ' A' ' 39' ' ' LEU . 76.2 t-105 -36.74 -29.32 0.02 OUTLIER 'General case' 1 N--CA 1.548 4.468 0 N-CA-C 116.131 1.9 . . . . 0.0 116.131 -174.72 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 520' ' ' LEU . . . . . 0.596 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.1 mm? -98.6 -31.0 12.17 Favored 'General case' 0 N--CA 1.537 3.915 0 CA-C-O 117.98 -1.009 . . . . 0.0 113.497 -172.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 -62.72 -25.59 68.26 Favored 'General case' 1 N--CA 1.544 4.231 0 N-CA-C 105.639 -1.986 . . . . 0.0 105.639 171.429 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . 0.537 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.9 m-85 -75.29 -43.19 52.49 Favored 'General case' 0 N--CA 1.511 2.618 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 173.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 523' ' ' VAL . . . . . 0.436 HG23 ' O ' ' B' ' 519' ' ' TRP . 74.4 t -63.6 -18.56 22.37 Favored 'Isoleucine or valine' 1 N--CA 1.563 5.224 0 CA-C-O 117.999 -1.0 . . . . 0.0 111.334 177.518 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -74.66 -52.7 10.96 Favored 'General case' 0 N--CA 1.531 3.621 0 CA-C-N 119.996 1.271 . . . . 0.0 107.82 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 4.8 mp -63.33 -26.18 68.64 Favored 'General case' 0 N--CA 1.537 3.893 0 CA-C-O 119.134 -0.46 . . . . 0.0 110.165 175.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 526' ' ' LEU . . . . . 0.51 HD23 ' O ' ' B' ' 522' ' ' PHE . 3.1 mm? -67.52 -39.34 85.11 Favored 'General case' 0 N--CA 1.519 2.991 0 CA-C-O 118.206 -0.902 . . . . 0.0 108.602 178.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 527' ' ' LYS . . . . . 0.436 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 13.7 mttt -69.17 -19.8 64.0 Favored 'General case' 0 N--CA 1.525 3.31 0 CA-C-O 118.078 -0.963 . . . . 0.0 111.262 177.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -75.25 -37.35 61.06 Favored 'General case' 0 N--CA 1.529 3.524 0 CA-C-N 119.629 1.104 . . . . 0.0 109.056 176.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 529' ' ' ALA . . . . . 0.635 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -92.81 -8.63 43.06 Favored 'General case' 0 N--CA 1.504 2.238 0 CA-C-O 118.537 -0.744 . . . . 0.0 110.475 178.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 530' ' ' TYR . . . . . 0.436 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.5 OUTLIER -81.53 -29.1 33.64 Favored 'General case' 0 N--CA 1.532 3.673 0 CA-C-N 119.953 1.252 . . . . 0.0 109.272 179.841 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -68.69 -43.35 76.26 Favored 'General case' 0 N--CA 1.531 3.613 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 176.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 41.5 m-80 -90.54 -91.85 0.14 Allowed 'General case' 0 N--CA 1.516 2.853 0 N-CA-C 106.625 -1.62 . . . . 0.0 106.625 176.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 3.0 p30 155.1 54.47 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.868 0 C-N-CA 127.474 2.31 . . . . 0.0 107.397 177.25 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 534' ' ' LEU . . . . . 0.5 HD22 ' CD2' ' A' ' 96' ' ' LEU . 7.4 mt -114.64 11.6 16.99 Favored 'General case' 0 N--CA 1.53 3.531 0 C-N-CA 124.029 0.932 . . . . 0.0 111.197 -177.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 535' ' ' HIS . . . . . 0.585 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 42.2 p-80 -81.15 0.27 37.07 Favored 'General case' 0 N--CA 1.515 2.805 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 175.142 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 536' ' ' LEU . . . . . 0.443 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 35.4 mt -93.92 -51.52 0.26 Allowed Pre-proline 0 N--CA 1.506 2.37 0 CA-C-O 116.381 -1.771 . . . . 0.0 109.175 -176.166 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 537' ' ' PRO . . . . . 0.443 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 2.7 Cg_exo -64.28 -33.93 57.59 Favored 'Trans proline' 0 C--N 1.395 3.009 0 N-CA-C 107.104 -1.922 . . . . 0.0 107.104 171.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 538' ' ' LEU . . . . . 0.411 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 1.2 tm? -61.94 -41.99 98.59 Favored 'General case' 0 N--CA 1.529 3.487 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 175.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 13.7 mt -70.86 -22.43 62.3 Favored 'General case' 0 N--CA 1.537 3.909 0 CA-C-O 118.419 -0.8 . . . . 0.0 111.084 177.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -76.29 -8.52 57.26 Favored 'General case' 0 N--CA 1.526 3.375 0 CA-C-N 118.934 0.788 . . . . 0.0 110.228 176.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 541' ' ' LEU . . . . . 0.612 HD13 ' N ' ' B' ' 542' ' ' MET . 0.0 OUTLIER -106.12 -46.85 3.97 Favored 'General case' 0 N--CA 1.511 2.595 0 C-N-CA 124.247 1.019 . . . . 0.0 110.238 -178.512 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 542' ' ' MET . . . . . 0.612 ' N ' HD13 ' B' ' 541' ' ' LEU . 8.2 ptt? -94.41 -21.7 18.77 Favored 'General case' 0 N--CA 1.536 3.854 0 CA-C-O 116.85 -1.548 . . . . 0.0 114.966 -175.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 543' ' ' LEU . . . . . 0.644 ' O ' HG23 ' B' ' 544' ' ' THR . 3.1 mp -119.09 -106.97 0.38 Allowed 'General case' 0 N--CA 1.534 3.752 0 CA-C-N 121.464 1.938 . . . . 0.0 113.539 -176.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 544' ' ' THR . . . . . 0.644 HG23 ' O ' ' B' ' 543' ' ' LEU . 7.6 p 179.13 165.78 0.69 Allowed Pre-proline 1 N--CA 1.56 5.05 0 CA-C-N 121.381 1.901 . . . . 0.0 110.788 -176.838 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -69.37 -33.98 16.88 Favored 'Trans proline' 0 CA--C 1.574 2.512 0 C-N-CA 122.427 2.085 . . . . 0.0 109.031 172.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -59.94 -18.86 48.36 Favored 'General case' 0 N--CA 1.533 3.718 0 CA-C-O 118.078 -0.963 . . . . 0.0 111.633 177.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -76.74 -44.86 31.47 Favored 'General case' 0 N--CA 1.525 3.315 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 177.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 548' ' ' ARG . . . . . 0.523 ' HA ' HD12 ' B' ' 551' ' ' LEU . 31.0 ptt180 -81.4 -1.85 47.19 Favored 'General case' 0 N--CA 1.533 3.707 0 CA-C-N 118.627 0.649 . . . . 0.0 110.95 176.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -84.53 -47.53 10.5 Favored 'General case' 0 N--CA 1.524 3.275 0 N-CA-C 105.07 -2.196 . . . . 0.0 105.07 174.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -75.63 -17.14 60.1 Favored 'General case' 0 N--CA 1.509 2.499 0 CA-C-O 117.414 -1.279 . . . . 0.0 111.448 177.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 551' ' ' LEU . . . . . 0.711 HD11 ' N ' ' A' ' 19' ' ' TRP . 0.0 OUTLIER -74.91 -39.71 61.28 Favored 'General case' 0 N--CA 1.53 3.557 0 N-CA-C 106.35 -1.722 . . . . 0.0 106.35 175.139 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 552' ' ' GLY . . . . . 0.683 ' N ' HD13 ' B' ' 551' ' ' LEU . . . -62.79 -58.71 10.99 Favored Glycine 0 N--CA 1.495 2.577 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 -177.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 553' ' ' THR . . . . . 0.537 ' O ' HG23 ' B' ' 557' ' ' ILE . 2.8 m -71.73 -34.59 69.69 Favored 'General case' 0 N--CA 1.537 3.904 0 CA-C-O 118.168 -0.92 . . . . 0.0 112.604 -178.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -68.25 -58.15 4.87 Favored 'General case' 1 N--CA 1.541 4.082 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 178.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 47.8 t -58.09 -18.9 11.77 Favored 'Isoleucine or valine' 1 N--CA 1.549 4.48 0 CA-C-O 117.621 -1.18 . . . . 0.0 110.264 175.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 13.6 mtt-85 -84.88 -32.74 23.02 Favored 'General case' 0 N--CA 1.52 3.062 0 CA-C-O 117.077 -1.439 . . . . 0.0 111.729 178.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 557' ' ' ILE . . . . . 0.537 HG23 ' O ' ' B' ' 553' ' ' THR . 0.0 OUTLIER -77.2 -20.92 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.182 0 CA-C-N 122.049 2.204 . . . . 0.0 109.728 177.722 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 558' ' ' VAL . . . . . 0.476 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.0 OUTLIER -89.44 -50.33 13.26 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.911 0 N-CA-C 106.954 -1.499 . . . . 0.0 106.954 -179.205 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -60.69 -24.78 65.89 Favored 'General case' 0 N--CA 1.531 3.607 0 CA-C-O 119.004 -0.522 . . . . 0.0 109.822 177.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -96.97 -23.74 16.15 Favored 'General case' 0 N--CA 1.522 3.13 0 CA-C-O 117.831 -1.08 . . . . 0.0 111.306 178.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 27.6 tp -75.75 -51.92 11.6 Favored 'General case' 1 N--CA 1.542 4.129 0 CA-C-N 120.108 1.322 . . . . 0.0 108.306 179.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 40.5 mt -48.24 -27.55 2.53 Favored 'General case' 1 N--CA 1.543 4.195 0 C-N-CA 124.375 1.07 . . . . 0.0 112.3 179.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.69 -51.03 13.65 Favored 'General case' 0 N--CA 1.53 3.54 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 178.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 62.78 54.91 30.15 Favored Glycine 1 N--CA 1.521 4.324 0 C-N-CA 123.975 0.797 . . . . 0.0 114.228 175.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -115.73 -56.15 2.36 Favored 'General case' 0 N--CA 1.517 2.877 0 N-CA-C 106.657 -1.608 . . . . 0.0 106.657 177.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 52.1 ttp -139.64 76.06 1.54 Allowed 'General case' 0 N--CA 1.524 3.225 0 N-CA-C 104.271 -2.492 . . . . 0.0 104.271 177.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 567' ' ' SER . . . . . 0.446 ' HA ' ' HB2' ' B' ' 571' ' ' LEU . 29.6 m -135.53 -3.28 2.38 Favored 'General case' 0 N--CA 1.522 3.173 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -173.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -98.03 -84.66 0.38 Allowed 'General case' 0 N--CA 1.52 3.029 0 CA-C-N 119.809 1.186 . . . . 0.0 110.654 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 3.9 mtt-85 -75.67 -55.91 5.2 Favored 'General case' 0 N--CA 1.527 3.386 0 CA-C-N 119.857 1.208 . . . . 0.0 111.851 -178.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -70.98 -2.4 15.17 Favored 'General case' 0 N--CA 1.523 3.21 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -174.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 571' ' ' LEU . . . . . 0.814 HD23 HD11 ' B' ' 582' ' ' ILE . 34.0 tp -85.41 -47.23 10.17 Favored 'General case' 0 N--CA 1.533 3.699 0 CA-C-N 120.664 1.575 . . . . 0.0 111.773 -178.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.79 -35.88 0.55 Allowed 'General case' 1 N--CA 1.557 4.888 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -179.444 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -71.49 -39.16 71.03 Favored 'General case' 0 N--CA 1.536 3.874 0 CA-C-N 118.806 0.73 . . . . 0.0 111.02 -178.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -53.91 -59.99 3.91 Favored 'General case' 0 N--CA 1.53 3.531 0 C-N-CA 123.976 0.911 . . . . 0.0 111.743 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 5.5 mp -93.81 -64.64 1.06 Allowed 'General case' 0 N--CA 1.519 3.018 0 C-N-CA 123.224 0.61 . . . . 0.0 110.012 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 124.78 46.54 0.24 Allowed Glycine 1 N--CA 1.518 4.158 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -178.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -119.32 115.73 24.76 Favored 'General case' 0 N--CA 1.517 2.876 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -39.45 171.48 0.01 OUTLIER Glycine 1 N--CA 1.541 5.674 0 C-N-CA 125.493 1.52 . . . . 0.0 116.168 -177.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 579' ' ' ILE . . . . . 0.665 HD13 ' CG2' ' B' ' 582' ' ' ILE . 0.6 OUTLIER -80.24 -16.37 12.8 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.386 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.504 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 580' ' ' ALA . . . . . 0.969 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -68.85 -39.45 79.9 Favored 'General case' 0 N--CA 1.527 3.379 0 CA-C-N 119.502 1.046 . . . . 0.0 109.967 176.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.5 p -77.76 -38.79 46.11 Favored 'General case' 0 N--CA 1.535 3.776 0 CA-C-N 118.888 0.767 . . . . 0.0 111.502 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 582' ' ' ILE . . . . . 0.814 HD11 HD23 ' B' ' 571' ' ' LEU . 2.1 tt -67.27 -35.34 73.63 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.185 0 CA-C-O 118.849 -0.596 . . . . 0.0 112.411 -175.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 82.0 p -102.27 -25.1 13.8 Favored 'General case' 0 N--CA 1.515 2.78 0 CA-C-O 117.904 -1.046 . . . . 0.0 111.573 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -73.12 -24.86 60.66 Favored 'General case' 0 N--CA 1.538 3.953 0 CA-C-N 119.981 1.264 . . . . 0.0 108.544 174.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -62.71 -36.1 92.82 Favored Glycine 1 N--CA 1.521 4.35 0 N-CA-C 107.325 -2.31 . . . . 0.0 107.325 173.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 1.7 m -60.65 -39.74 89.41 Favored 'General case' 1 N--CA 1.541 4.106 0 C-N-CA 123.94 0.896 . . . . 0.0 110.32 176.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -59.7 -32.65 70.71 Favored 'General case' 1 N--CA 1.548 4.445 0 C-N-CA 123.539 0.736 . . . . 0.0 111.683 -179.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 4.8 m -65.29 -37.62 87.73 Favored 'General case' 0 N--CA 1.535 3.817 0 C-N-CA 123.039 0.536 . . . . 0.0 110.867 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 29.8 mt -58.31 -45.23 88.4 Favored 'General case' 0 N--CA 1.529 3.52 0 C-N-CA 124.094 0.958 . . . . 0.0 111.519 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -14.82 63.27 Favored 'General case' 0 N--CA 1.538 3.934 0 CA-C-O 118.04 -0.981 . . . . 0.0 112.926 -178.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -88.52 -43.55 11.33 Favored 'General case' 0 N--CA 1.521 3.11 0 CA-C-N 119.534 1.061 . . . . 0.0 110.849 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -57.12 163.83 2.85 Favored Pre-proline 1 N--CA 1.542 4.161 0 C-N-CA 123.647 0.779 . . . . 0.0 112.934 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 593' ' ' PRO . . . . . 0.43 ' O ' ' HB2' ' B' ' 597' ' ' ARG . 45.5 Cg_endo -80.51 173.32 12.45 Favored 'Trans proline' 0 C--N 1.381 2.26 0 C-N-CA 121.777 1.651 . . . . 0.0 110.54 178.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -94.73 -25.89 4.53 Favored 'Isoleucine or valine' 0 N--CA 1.522 3.173 0 CA-C-O 117.875 -1.059 . . . . 0.0 111.579 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -62.83 -41.16 99.22 Favored 'General case' 0 N--CA 1.517 2.893 0 CA-C-N 120.02 1.282 . . . . 0.0 110.246 -179.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 596' ' ' LEU . . . . . 0.439 ' CD2' HD22 ' A' ' 34' ' ' LEU . 7.0 mp -98.45 -15.37 19.65 Favored 'General case' 0 N--CA 1.512 2.639 0 CA-C-O 118.687 -0.673 . . . . 0.0 111.878 178.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' B' ' 593' ' ' PRO . 0.0 OUTLIER -65.18 -34.37 78.22 Favored 'General case' 1 N--CA 1.544 4.231 0 N-CA-C 103.338 -2.838 . . . . 0.0 103.338 168.632 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -52.76 -40.47 63.16 Favored 'General case' 0 N--CA 1.516 2.872 0 C-N-CA 124.328 1.051 . . . . 0.0 111.001 174.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 599' ' ' TRP . . . . . 0.504 ' O ' HG22 ' B' ' 603' ' ' VAL . 52.3 t90 -64.68 -37.38 87.38 Favored 'General case' 0 N--CA 1.532 3.64 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 177.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -51.71 -36.86 48.45 Favored 'General case' 1 N--CA 1.541 4.106 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 176.554 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -70.51 -39.55 74.03 Favored 'General case' 0 N--CA 1.537 3.88 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 175.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 602' ' ' GLU . . . . . 0.426 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.9 OUTLIER -57.43 -24.35 55.08 Favored 'General case' 1 N--CA 1.546 4.372 0 C-N-CA 124.045 0.938 . . . . 0.0 111.505 176.41 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' B' B ' 603' ' ' VAL . . . . . 0.504 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.0 OUTLIER -107.22 -6.3 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.358 0 CA-C-O 117.862 -1.066 . . . . 0.0 113.526 -175.322 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 6.7 mp -104.88 -61.12 1.51 Allowed 'General case' 0 N--CA 1.525 3.307 0 N-CA-C 106.314 -1.736 . . . . 0.0 106.314 174.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 5.4 tp -45.36 -32.71 2.18 Favored 'General case' 0 N--CA 1.535 3.81 0 C-N-CA 125.507 1.523 . . . . 0.0 113.55 -179.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt 66.69 96.72 0.06 Allowed 'General case' 0 N--CA 1.529 3.525 0 C-N-CA 124.428 1.091 . . . . 0.0 109.904 -179.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 6.3 t . . . . . 0 N--CA 1.523 3.179 0 CA-C-O 118.548 -0.739 . . . . 0.0 109.855 -179.53 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 898' ' ' TRP . . . . . 0.512 ' HB2' HG23 ' B' ' 544' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.082 0 CA-C-O 118.355 -0.831 . . . . 0.0 108.832 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.504 2.272 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.42 -9.813 3 O4'-C1'-N19 119.323 14.404 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.412 -10.592 4 O4'-C1'-N19 120.299 15.623 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.202 4 O4'-C1'-N19 119.119 14.149 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . 0.528 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 6 C3'--C2' 1.417 -10.098 5 O4'-C1'-N19 120.116 15.395 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' E' E ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.791 5 O4'-C1'-N19 118.578 13.472 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.404 -11.365 3 O4'-C1'-N19 118.351 13.189 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' E' E ' 7' ' ' ' DA' . . . . . 0.719 H2'' " H5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.398 -11.963 4 C4'-C3'-C2' 112.378 9.178 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' E' E ' 8' ' ' ' DG' . . . . . 0.719 " H5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.417 -10.095 4 O4'-C1'-N19 119.643 14.804 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.578 11.288 4 O4'-C1'-N19 119.041 14.052 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.402 -11.553 4 O4'-C1'-N19 119.324 14.406 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.406 -11.229 5 O4'-C1'-N19 121.157 16.696 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.446 4 O4'-C1'-N19 120.581 15.977 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 4 O3'--C3' 1.555 9.562 5 O4'-C1'-N19 123.677 19.846 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' E' E ' 14' ' ' ' DT' . . . . . 0.521 ' C7 ' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.415 -10.278 4 O4'-C1'-N19 119.371 14.464 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' E' E ' 15' ' ' ' DA' . . . . . 0.665 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.416 -10.244 6 O4'-C1'-N19 119.101 14.127 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.415 -10.326 5 O4'-C1'-N19 119.889 15.111 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.464 5 O4'-C1'-N19 119.265 14.331 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.696 3 O4'-C1'-N19 120.27 15.588 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.376 5 O4'-C1'-N19 119.71 14.887 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.598 6.967 4 O4'-C1'-N19 119.223 14.279 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.499 4 C4'-C3'-C2' 116.874 13.674 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.405 -11.259 3 O4'-C1'-N19 119.618 14.772 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.312 5 O4'-C1'-N19 119.901 15.126 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' F' F ' 4' ' ' ' DA' . . . . . 0.611 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 5 C3'--C2' 1.429 -8.933 4 O4'-C1'-N19 119.362 14.452 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' F' F ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.569 10.625 3 O4'-C1'-N19 118.344 13.181 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.832 4 O4'-C1'-N19 119.362 14.452 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.415 -11.277 4 C4'-C3'-C2' 112.584 9.384 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.409 -10.864 4 O4'-C1'-N19 119.46 14.575 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.412 -10.615 3 C4'-C3'-C2' 117.343 14.143 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.81 3 O4'-C1'-N19 119.664 14.829 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.668 4 O4'-C1'-N19 120.747 16.184 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.6 2 O4'-C1'-N19 119.118 14.148 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.445 4 O4'-C1'-N19 119.286 14.358 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' F' F ' 14' ' ' ' DT' . . . . . 0.895 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.416 -10.221 3 C4'-C3'-C2' 116.879 13.679 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' F' F ' 15' ' ' ' DA' . . . . . 0.962 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.415 -10.333 6 O4'-C1'-N19 119.537 14.671 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.418 -9.989 5 O4'-C1'-N19 119.017 14.021 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.627 3 O4'-C1'-N19 118.952 13.939 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.433 4 O4'-C1'-N19 120.363 15.704 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.515 5 O4'-C1'-N19 120.042 15.302 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.515 7.296 3 O4'-C1'-N19 120.02 15.276 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 . . . . . 0 N--CA 1.502 2.138 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 25.4 m -146.39 129.99 8.35 Favored Pre-proline 0 N--CA 1.522 3.16 0 CA-C-O 117.49 -1.243 . . . . 0.0 110.062 -179.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -74.53 143.08 30.31 Favored 'Trans proline' 0 C--N 1.387 2.556 0 C-N-CA 122.565 2.177 . . . . 0.0 111.927 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -131.28 115.93 16.95 Favored 'General case' 0 N--CA 1.521 3.12 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 177.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.8 p -91.92 131.26 37.37 Favored 'General case' 0 N--CA 1.528 3.457 0 C-N-CA 122.694 0.398 . . . . 0.0 110.663 -178.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -115.54 121.41 42.56 Favored 'General case' 0 N--CA 1.516 2.857 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -154.65 133.49 12.22 Favored 'General case' 0 N--CA 1.521 3.121 0 C-N-CA 122.457 0.303 . . . . 0.0 110.875 -178.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 4.5 mpp? -125.63 125.82 43.73 Favored 'General case' 0 N--CA 1.516 2.847 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -121.52 121.18 36.91 Favored 'General case' 0 N--CA 1.518 2.972 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 179.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -162.28 147.71 12.77 Favored 'General case' 0 N--CA 1.53 3.568 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -178.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -81.79 132.82 35.29 Favored 'General case' 0 N--CA 1.523 3.209 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 -94.44 132.85 38.66 Favored 'General case' 0 N--CA 1.524 3.225 0 C-N-CA 122.939 0.495 . . . . 0.0 110.842 -178.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.0 t-80 -116.57 115.23 25.35 Favored 'General case' 0 N--CA 1.519 3.024 0 N-CA-C 105.484 -2.043 . . . . 0.0 105.484 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -84.67 119.72 25.57 Favored 'General case' 0 N--CA 1.52 3.026 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -176.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.542 ' O ' HD21 ' B' ' 551' ' ' LEU . 47.1 mt-10 -149.24 -70.27 0.2 Allowed 'General case' 0 N--CA 1.523 3.181 0 N-CA-C 105.441 -2.059 . . . . 0.0 105.441 177.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.768 ' O ' HG23 ' A' ' 23' ' ' VAL . 75.1 t-105 -59.99 -20.09 55.82 Favored 'General case' 0 N--CA 1.537 3.909 0 CA-C-O 117.824 -1.084 . . . . 0.0 110.973 174.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.546 HD22 ' N ' ' A' ' 20' ' ' LEU . 1.8 mm? -92.25 -31.42 15.42 Favored 'General case' 0 N--CA 1.52 3.039 0 C-N-CA 124.114 0.966 . . . . 0.0 110.765 -177.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.7 mtt180 -60.83 -27.48 68.11 Favored 'General case' 0 N--CA 1.534 3.743 0 N-CA-C 106.395 -1.706 . . . . 0.0 106.395 172.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.513 ' HB2' HD23 ' B' ' 551' ' ' LEU . 20.9 t80 -88.53 -31.55 18.63 Favored 'General case' 0 CA--C 1.595 2.695 0 CA-C-O 116.645 -1.645 . . . . 0.0 109.332 175.088 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.768 HG23 ' O ' ' A' ' 19' ' ' TRP . 93.3 t -74.54 -62.38 1.34 Allowed 'Isoleucine or valine' 1 N--CA 1.565 5.285 0 CA-C-N 122.215 2.28 . . . . 0.0 110.425 -178.597 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -52.91 -36.18 59.16 Favored 'General case' 1 N--CA 1.548 4.452 0 CA-C-N 119.106 0.866 . . . . 0.0 111.62 -178.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.94 -35.32 66.96 Favored 'General case' 0 N--CA 1.533 3.699 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 177.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.03 -40.84 95.12 Favored 'General case' 0 N--CA 1.529 3.477 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 176.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.439 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 22.3 tttt -56.47 -30.46 62.96 Favored 'General case' 0 N--CA 1.531 3.609 0 C-N-CA 123.216 0.606 . . . . 0.0 111.743 179.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -71.67 -42.33 67.63 Favored 'General case' 0 N--CA 1.529 3.511 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.603 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -87.81 3.35 48.57 Favored 'General case' 0 N--CA 1.517 2.889 0 O-C-N 123.176 0.297 . . . . 0.0 110.295 177.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.439 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -87.54 -45.65 10.27 Favored 'General case' 0 N--CA 1.524 3.236 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 -179.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -58.21 -39.72 79.74 Favored 'General case' 1 N--CA 1.541 4.088 0 C-N-CA 123.292 0.637 . . . . 0.0 109.3 178.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 65.5 m-80 -92.63 -83.21 0.31 Allowed 'General case' 0 N--CA 1.512 2.669 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 177.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 p30 145.51 44.16 0.0 OUTLIER 'General case' 1 N--CA 1.562 5.157 0 C-N-CA 128.444 2.698 . . . . 0.0 107.879 178.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.43 HD22 ' CD2' ' B' ' 596' ' ' LEU . 13.3 mt -98.22 12.02 35.96 Favored 'General case' 0 N--CA 1.53 3.541 0 O-C-N 121.368 -0.832 . . . . 0.0 110.693 -179.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.555 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -89.86 16.39 8.21 Favored 'General case' 0 N--CA 1.515 2.799 0 C-N-CA 123.984 0.913 . . . . 0.0 109.071 174.894 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.503 HD21 HD11 ' B' ' 520' ' ' LEU . 23.6 mt -98.96 -51.93 0.2 Allowed Pre-proline 0 N--CA 1.503 2.198 0 C-N-CA 125.335 1.454 . . . . 0.0 107.581 -178.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.484 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 6.1 Cg_exo -70.03 -33.43 15.57 Favored 'Trans proline' 0 C--N 1.393 2.869 0 N-CA-C 107.098 -1.924 . . . . 0.0 107.098 170.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.5 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.1 OUTLIER -65.79 -42.08 91.2 Favored 'General case' 0 N--CA 1.517 2.903 0 CA-C-O 117.93 -1.033 . . . . 0.0 108.495 177.357 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.518 HD22 ' CE2' ' B' ' 519' ' ' TRP 0.268 0.1 OUTLIER -77.42 -11.08 59.8 Favored 'General case' 1 N--CA 1.552 4.649 0 CA-C-N 120.316 1.416 . . . . 0.0 110.934 176.628 . . . . . . . . 5 4 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -91.59 9.77 30.79 Favored 'General case' 0 N--CA 1.524 3.228 0 CA-C-N 119.057 0.844 . . . . 0.0 110.038 176.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.647 HD13 ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -125.57 -50.08 1.63 Allowed 'General case' 0 N--CA 1.522 3.166 0 CA-C-N 119.407 1.003 . . . . 0.0 109.686 -178.872 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.647 ' N ' HD13 ' A' ' 41' ' ' LEU . 7.9 ptp -93.95 -14.0 26.44 Favored 'General case' 1 N--CA 1.543 4.222 0 CA-C-O 118.273 -0.87 . . . . 0.0 113.298 -177.661 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.464 ' O ' HG23 ' A' ' 44' ' ' THR . 3.6 mp -110.88 -83.38 0.57 Allowed 'General case' 0 N--CA 1.502 2.167 0 CA-C-O 117.934 -1.031 . . . . 0.0 110.911 -177.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.76 HG23 ' HB2' ' B' ' 998' ' ' TRP . 0.9 OUTLIER 150.52 166.09 0.0 OUTLIER Pre-proline 1 N--CA 1.564 5.233 0 C-N-CA 126.144 1.778 . . . . 0.0 109.1 -178.445 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -68.86 -33.86 19.35 Favored 'Trans proline' 0 CA--C 1.574 2.515 0 C-N-CA 122.304 2.003 . . . . 0.0 108.399 173.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -62.66 -19.69 64.08 Favored 'General case' 0 N--CA 1.529 3.476 0 CA-C-O 118.058 -0.972 . . . . 0.0 111.15 177.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -73.2 -32.6 64.9 Favored 'General case' 0 N--CA 1.523 3.203 0 CA-C-O 117.684 -1.15 . . . . 0.0 109.969 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.8 ptt180 -89.5 -14.27 35.62 Favored 'General case' 0 N--CA 1.538 3.956 0 CA-C-N 119.689 1.131 . . . . 0.0 108.779 173.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -79.52 -19.35 49.81 Favored 'General case' 0 N--CA 1.516 2.847 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 172.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -95.46 -38.06 10.63 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 123.932 0.893 . . . . 0.0 109.467 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.483 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 23.3 tp -75.26 -21.77 58.31 Favored 'General case' 0 N--CA 1.534 3.753 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 173.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.452 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -69.08 -71.34 0.99 Allowed Glycine 0 N--CA 1.497 2.704 0 C-N-CA 125.104 1.335 . . . . 0.0 110.553 176.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.6 m -70.33 -28.44 65.16 Favored 'General case' 0 N--CA 1.537 3.893 0 CA-C-O 117.842 -1.075 . . . . 0.0 112.991 -177.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -69.47 -51.7 33.57 Favored 'General case' 0 N--CA 1.534 3.751 0 CA-C-N 120.007 1.276 . . . . 0.0 107.848 178.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 33.2 t -61.78 -19.31 21.0 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.241 0 CA-C-O 117.683 -1.151 . . . . 0.0 109.793 175.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.5 mtp180 -77.39 -43.94 30.97 Favored 'General case' 0 N--CA 1.526 3.355 0 CA-C-N 120.371 1.441 . . . . 0.0 112.299 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.422 HD13 ' N ' ' A' ' 58' ' ' VAL . 0.0 OUTLIER -73.03 -21.69 19.33 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.75 0 CA-C-N 121.719 2.054 . . . . 0.0 111.011 179.508 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.473 HG11 HD11 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -89.15 -52.18 11.25 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.024 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 -178.855 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -59.61 -23.06 62.66 Favored 'General case' 0 N--CA 1.529 3.509 0 CA-C-O 119.087 -0.482 . . . . 0.0 109.984 177.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -96.34 -22.52 17.14 Favored 'General case' 0 N--CA 1.526 3.357 0 CA-C-O 117.861 -1.066 . . . . 0.0 110.97 177.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.3 mt -75.3 -54.66 6.7 Favored 'General case' 1 N--CA 1.544 4.235 0 CA-C-N 119.999 1.272 . . . . 0.0 107.903 178.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.3 -36.34 4.02 Favored 'General case' 1 N--CA 1.545 4.278 0 C-N-CA 125.346 1.458 . . . . 0.0 112.003 179.727 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.9 mmm180 -81.85 -52.6 6.93 Favored 'General case' 0 N--CA 1.527 3.397 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.06 59.73 3.31 Favored Glycine 1 N--CA 1.517 4.081 0 CA-C-O 119.349 -0.695 . . . . 0.0 111.795 178.098 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -116.05 -54.52 2.48 Favored 'General case' 0 N--CA 1.524 3.234 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 178.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 10.7 ptp -149.39 77.64 1.35 Allowed 'General case' 0 N--CA 1.526 3.351 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 178.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.41 ' HA ' HD22 ' A' ' 71' ' ' LEU . 5.6 t -128.97 -8.54 4.9 Favored 'General case' 0 N--CA 1.528 3.429 0 N-CA-C 114.066 1.136 . . . . 0.0 114.066 -176.161 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -114.97 -59.24 2.04 Favored 'General case' 0 N--CA 1.528 3.468 0 CA-C-N 120.056 1.298 . . . . 0.0 111.955 -178.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 3.2 mmt-85 -94.68 -55.12 3.24 Favored 'General case' 0 N--CA 1.528 3.432 0 CA-C-N 118.093 0.406 . . . . 0.0 111.46 -177.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -76.87 -9.3 58.59 Favored 'General case' 0 N--CA 1.524 3.273 0 N-CA-C 114.05 1.129 . . . . 0.0 114.05 -177.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.55 HD23 HG21 ' A' ' 82' ' ' ILE . 36.4 tp -77.66 -49.65 14.08 Favored 'General case' 0 N--CA 1.526 3.37 0 CA-C-N 119.973 1.26 . . . . 0.0 112.299 -177.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.45 -34.07 15.75 Favored 'General case' 0 N--CA 1.534 3.747 0 N-CA-C 114.306 1.225 . . . . 0.0 114.306 -176.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -68.34 -33.54 74.47 Favored 'General case' 0 N--CA 1.535 3.805 0 CA-C-O 119.051 -0.5 . . . . 0.0 111.709 -178.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -52.54 -46.42 66.76 Favored 'General case' 0 N--CA 1.531 3.611 0 C-N-CA 124.275 1.03 . . . . 0.0 112.584 -178.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.407 HD23 ' N ' ' A' ' 75' ' ' LEU . 1.2 pt? -138.16 -40.56 0.53 Allowed 'General case' 0 N--CA 1.527 3.388 0 CA-C-O 118.63 -0.7 . . . . 0.0 111.852 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 107.87 79.21 1.16 Allowed Glycine 1 N--CA 1.524 4.517 0 CA-C-N 119.185 0.902 . . . . 0.0 111.712 178.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -112.47 -9.78 13.78 Favored 'General case' 0 N--CA 1.526 3.367 0 C-N-CA 123.626 0.77 . . . . 0.0 111.269 177.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 87.81 162.88 38.47 Favored Glycine 0 N--CA 1.513 3.78 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 -178.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.611 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.3 OUTLIER -85.33 -23.31 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.522 3.17 0 CA-C-N 118.825 1.313 . . . . 0.0 108.387 178.625 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.665 ' HB2' ' H62' ' E' ' 15' ' ' ' DA' . . . -64.32 -29.21 70.29 Favored 'General case' 0 N--CA 1.515 2.776 0 CA-C-O 116.921 -1.514 . . . . 0.0 111.509 179.27 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.8 p -83.08 -46.91 12.25 Favored 'General case' 1 N--CA 1.545 4.296 0 CA-C-N 120.809 1.64 . . . . 0.0 110.545 178.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.55 HG21 HD23 ' A' ' 71' ' ' LEU . 15.9 pt -68.36 -16.3 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.99 0 CA-C-O 117.879 -1.058 . . . . 0.0 113.114 -177.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 62.7 p -111.19 -29.88 7.67 Favored 'General case' 0 N--CA 1.516 2.861 0 CA-C-N 120.022 1.283 . . . . 0.0 110.721 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -74.96 -21.76 58.97 Favored 'General case' 0 N--CA 1.53 3.564 0 CA-C-N 119.528 1.058 . . . . 0.0 108.309 174.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.07 -29.65 74.81 Favored Glycine 0 N--CA 1.516 3.983 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 176.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.2 t -64.37 -39.55 94.1 Favored 'General case' 0 N--CA 1.539 3.978 0 CA-C-N 118.402 1.101 . . . . 0.0 109.326 176.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -62.04 -19.1 62.52 Favored 'General case' 1 N--CA 1.543 4.187 0 CA-C-O 118.41 -0.805 . . . . 0.0 112.367 179.075 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 14.3 m -72.04 -39.93 68.74 Favored 'General case' 0 N--CA 1.535 3.79 0 CA-C-N 119.297 0.953 . . . . 0.0 110.288 179.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 54.9 mt -56.47 -49.28 75.12 Favored 'General case' 0 N--CA 1.525 3.285 0 C-N-CA 124.324 1.05 . . . . 0.0 112.525 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.66 -11.94 59.36 Favored 'General case' 1 N--CA 1.54 4.071 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -179.421 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.03 -44.72 12.79 Favored 'General case' 0 N--CA 1.519 2.997 0 CA-C-N 119.537 1.062 . . . . 0.0 110.974 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.39 161.98 5.01 Favored Pre-proline 1 N--CA 1.546 4.344 0 CA-C-O 118.249 -0.882 . . . . 0.0 112.663 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.429 ' O ' ' HB2' ' A' ' 97' ' ' ARG . 39.1 Cg_endo -78.22 174.61 12.19 Favored 'Trans proline' 0 C--N 1.38 2.21 0 C-N-CA 121.758 1.639 . . . . 0.0 110.43 178.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -94.56 -28.08 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.077 0 CA-C-O 117.302 -1.332 . . . . 0.0 111.721 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -64.24 -39.6 94.29 Favored 'General case' 0 N--CA 1.517 2.903 0 CA-C-N 120.37 1.441 . . . . 0.0 110.904 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.474 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.2 mp -98.9 -17.55 18.32 Favored 'General case' 0 N--CA 1.513 2.721 0 C-N-CA 123.291 0.636 . . . . 0.0 111.751 178.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.429 ' HB2' ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -65.35 -32.85 74.71 Favored 'General case' 1 N--CA 1.545 4.3 0 N-CA-C 103.047 -2.946 . . . . 0.0 103.047 168.459 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -55.18 -40.28 70.53 Favored 'General case' 0 N--CA 1.515 2.808 0 C-N-CA 124.371 1.068 . . . . 0.0 110.686 174.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.615 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 54.4 t90 -62.65 -35.49 79.79 Favored 'General case' 0 N--CA 1.536 3.855 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 177.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -52.25 -39.1 59.91 Favored 'General case' 1 N--CA 1.542 4.147 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 175.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -68.83 -37.25 79.04 Favored 'General case' 1 N--CA 1.542 4.129 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 175.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.425 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 1.2 mm-40 -60.79 -23.39 64.99 Favored 'General case' 1 N--CA 1.546 4.362 0 C-N-CA 123.542 0.737 . . . . 0.0 110.609 175.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.511 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -115.49 -3.19 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.179 0 CA-C-O 118.375 -0.821 . . . . 0.0 111.921 -177.268 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.25 -56.24 2.53 Favored 'General case' 0 N--CA 1.516 2.842 0 N-CA-C 106.121 -1.807 . . . . 0.0 106.121 175.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.2 tt -66.68 -42.75 86.03 Favored 'General case' 0 N--CA 1.535 3.777 0 C-N-CA 124.95 1.3 . . . . 0.0 110.014 178.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 23.6 mtmt 91.87 -45.86 0.01 OUTLIER 'General case' 1 N--CA 1.549 4.478 0 C-N-CA 126.375 1.87 . . . . 0.0 110.682 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 60.5 p . . . . . 0 N--CA 1.535 3.816 0 C-N-CA 125.128 1.371 . . . . 0.0 111.861 -179.573 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 . . . . . 0 N--CA 1.501 2.105 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 6.9 t 63.57 102.48 0.04 OUTLIER Pre-proline 0 N--CA 1.535 3.82 0 C-N-CA 124.361 1.064 . . . . 0.0 109.849 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -79.84 146.06 18.31 Favored 'Trans proline' 0 C--N 1.388 2.655 0 C-N-CA 122.817 2.344 . . . . 0.0 112.15 -178.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -118.08 -51.27 2.45 Favored 'General case' 0 N--CA 1.523 3.179 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 177.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 75.6 m -119.1 137.07 53.83 Favored 'General case' 0 N--CA 1.524 3.251 0 C-N-CA 123.545 0.738 . . . . 0.0 110.222 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -81.47 -36.26 29.52 Favored 'General case' 0 N--CA 1.528 3.462 0 CA-C-O 118.944 -0.551 . . . . 0.0 111.14 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . 68.21 159.23 0.16 Allowed 'General case' 1 N--CA 1.543 4.19 0 C-N-CA 124.121 0.968 . . . . 0.0 112.294 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 7.9 tpt -98.52 142.24 30.36 Favored 'General case' 0 N--CA 1.534 3.759 0 C-N-CA 123.434 0.694 . . . . 0.0 110.162 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -155.54 -43.65 0.08 Allowed 'General case' 0 N--CA 1.526 3.364 0 CA-C-O 118.921 -0.562 . . . . 0.0 112.375 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -104.5 148.39 26.52 Favored 'General case' 0 N--CA 1.538 3.927 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -75.07 132.43 41.27 Favored 'General case' 0 N--CA 1.533 3.678 0 C-N-CA 123.008 0.523 . . . . 0.0 110.531 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -93.53 -46.96 7.06 Favored 'General case' 0 N--CA 1.527 3.412 0 CA-C-O 119.163 -0.446 . . . . 0.0 109.895 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 24.6 t60 -101.99 120.1 39.87 Favored 'General case' 0 N--CA 1.523 3.208 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -93.13 126.48 38.25 Favored 'General case' 0 N--CA 1.528 3.475 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -122.28 -84.35 0.66 Allowed 'General case' 0 N--CA 1.524 3.228 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.019 -179.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 519' ' ' TRP . . . . . 0.539 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 73.6 t-105 -44.65 -27.27 0.46 Allowed 'General case' 1 N--CA 1.55 4.57 0 CA-C-N 119.961 1.255 . . . . 0.0 113.291 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 520' ' ' LEU . . . . . 0.608 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.2 mm? -99.3 -28.08 13.48 Favored 'General case' 0 N--CA 1.529 3.491 0 CA-C-O 117.645 -1.169 . . . . 0.0 113.273 -173.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 18.8 ttm180 -61.33 -26.11 67.59 Favored 'General case' 1 N--CA 1.544 4.228 0 N-CA-C 105.38 -2.081 . . . . 0.0 105.38 171.278 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . 0.539 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.8 m-85 -77.05 -43.8 33.16 Favored 'General case' 0 N--CA 1.507 2.423 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 174.311 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 523' ' ' VAL . . . . . 0.522 HG23 ' O ' ' B' ' 519' ' ' TRP . 99.2 t -71.57 -17.45 19.56 Favored 'Isoleucine or valine' 1 N--CA 1.571 5.604 0 CA-C-O 117.755 -1.116 . . . . 0.0 113.203 -178.899 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -79.34 -48.64 13.72 Favored 'General case' 0 N--CA 1.534 3.772 0 CA-C-N 120.631 1.56 . . . . 0.0 108.45 -178.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 5.1 mp -76.95 -18.77 58.04 Favored 'General case' 0 N--CA 1.525 3.301 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 175.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 526' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' B' ' 522' ' ' PHE . 0.2 OUTLIER -69.43 -34.4 74.39 Favored 'General case' 0 N--CA 1.519 2.989 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 173.779 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 52.5 tttt -64.37 -27.7 69.19 Favored 'General case' 0 N--CA 1.519 3.003 0 CA-C-O 118.569 -0.729 . . . . 0.0 110.543 176.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -64.67 -41.62 95.96 Favored 'General case' 0 N--CA 1.536 3.873 0 CA-C-N 118.981 0.809 . . . . 0.0 109.492 177.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 529' ' ' ALA . . . . . 0.615 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -83.33 -13.34 55.28 Favored 'General case' 0 N--CA 1.505 2.308 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.894 178.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -76.54 -31.79 57.82 Favored 'General case' 0 N--CA 1.539 3.991 0 CA-C-N 120.401 1.455 . . . . 0.0 109.62 179.393 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -64.79 -44.66 89.24 Favored 'General case' 0 N--CA 1.536 3.872 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 178.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -89.63 -90.01 0.15 Allowed 'General case' 0 N--CA 1.515 2.782 0 N-CA-C 105.779 -1.934 . . . . 0.0 105.779 176.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.3 p30 155.56 48.9 0.0 OUTLIER 'General case' 1 N--CA 1.559 4.979 0 C-N-CA 127.447 2.299 . . . . 0.0 108.021 176.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 534' ' ' LEU . . . . . 0.474 HD22 ' CD2' ' A' ' 96' ' ' LEU . 9.4 mt -105.38 12.6 31.41 Favored 'General case' 0 N--CA 1.52 3.041 0 C-N-CA 124.531 1.132 . . . . 0.0 110.257 -178.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 535' ' ' HIS . . . . . 0.555 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 30.9 p-80 -85.17 5.57 29.45 Favored 'General case' 0 N--CA 1.51 2.565 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 175.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 536' ' ' LEU . . . . . 0.473 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 31.3 mt -97.03 -51.33 0.22 Allowed Pre-proline 0 N--CA 1.501 2.11 0 CA-C-O 116.362 -1.78 . . . . 0.0 108.45 -175.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 537' ' ' PRO . . . . . 0.473 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 6.3 Cg_exo -68.44 -36.47 15.38 Favored 'Trans proline' 0 C--N 1.394 2.925 0 N-CA-C 106.999 -1.962 . . . . 0.0 106.999 171.397 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 538' ' ' LEU . . . . . 0.51 HD11 ' HE1' ' B' ' 542' ' ' MET . 0.8 OUTLIER -59.87 -45.11 93.52 Favored 'General case' 0 N--CA 1.526 3.326 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 176.382 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 39.9 mt -73.43 -20.89 60.61 Favored 'General case' 0 N--CA 1.535 3.802 0 CA-C-O 118.224 -0.893 . . . . 0.0 111.456 179.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -74.2 -23.33 59.18 Favored 'General case' 0 N--CA 1.532 3.638 0 CA-C-N 119.772 1.169 . . . . 0.0 110.049 176.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 541' ' ' LEU . . . . . 0.563 HD13 ' N ' ' B' ' 542' ' ' MET . 0.1 OUTLIER -86.1 -51.83 6.07 Favored 'General case' 0 N--CA 1.514 2.757 0 C-N-CA 123.82 0.848 . . . . 0.0 109.649 -179.098 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 542' ' ' MET . . . . . 0.563 ' N ' HD13 ' B' ' 541' ' ' LEU . 8.8 ptt? -99.49 17.17 21.01 Favored 'General case' 0 N--CA 1.53 3.531 0 CA-C-O 118.024 -0.989 . . . . 0.0 113.588 -177.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -134.34 -98.85 0.25 Allowed 'General case' 0 N--CA 1.535 3.798 0 CA-C-N 120.467 1.485 . . . . 0.0 113.31 178.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 544' ' ' THR . . . . . 0.76 HG23 ' HB2' ' A' ' 898' ' ' TRP . 0.6 OUTLIER 158.17 175.11 0.02 OUTLIER Pre-proline 1 N--CA 1.586 6.331 0 CA-C-N 120.985 1.72 . . . . 0.0 109.511 -177.187 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -63.18 -23.81 72.85 Favored 'Trans proline' 0 N--CA 1.525 3.364 0 C-N-CA 122.135 1.89 . . . . 0.0 110.544 174.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -54.03 -22.45 10.69 Favored 'General case' 1 N--CA 1.55 4.53 0 C-N-CA 123.894 0.877 . . . . 0.0 110.751 176.067 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -45.71 -76.23 0.03 OUTLIER 'General case' 0 N--CA 1.519 3.001 0 C-N-CA 126.333 1.853 . . . . 0.0 112.19 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 548' ' ' ARG . . . . . 0.515 ' HA ' HD12 ' B' ' 551' ' ' LEU . 28.7 ptt180 -93.77 -0.6 55.82 Favored 'General case' 0 N--CA 1.526 3.356 0 N-CA-C 113.634 0.975 . . . . 0.0 113.634 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -75.69 -52.46 10.44 Favored 'General case' 1 N--CA 1.544 4.243 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 173.259 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -73.88 -22.05 59.86 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 117.016 -1.469 . . . . 0.0 111.656 177.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 551' ' ' LEU . . . . . 0.673 HD13 ' N ' ' B' ' 552' ' ' GLY . 0.0 OUTLIER -74.22 -40.24 62.56 Favored 'General case' 0 N--CA 1.533 3.701 0 CA-C-N 121.039 1.745 . . . . 0.0 107.67 176.242 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 552' ' ' GLY . . . . . 0.673 ' N ' HD13 ' B' ' 551' ' ' LEU . . . -63.46 -47.77 84.34 Favored Glycine 0 N--CA 1.507 3.378 0 N-CA-C 110.803 -0.919 . . . . 0.0 110.803 -177.221 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.2 m -79.52 -39.56 31.69 Favored 'General case' 0 N--CA 1.534 3.754 0 CA-C-N 118.244 1.022 . . . . 0.0 112.086 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.2 -49.05 71.22 Favored 'General case' 0 N--CA 1.539 3.994 0 CA-C-N 119.511 1.05 . . . . 0.0 108.982 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 46.2 t -67.74 -19.82 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.761 0 CA-C-O 117.484 -1.246 . . . . 0.0 109.697 177.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 34.1 mtt180 -82.97 -33.49 26.65 Favored 'General case' 0 N--CA 1.521 3.101 0 CA-C-O 116.413 -1.756 . . . . 0.0 112.574 178.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 557' ' ' ILE . . . . . 0.464 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -78.19 -22.12 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.484 0 CA-C-N 122.984 2.629 . . . . 0.0 109.573 178.221 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 558' ' ' VAL . . . . . 0.464 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.0 OUTLIER -85.75 -52.97 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.738 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 179.826 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -60.87 -28.29 68.75 Favored 'General case' 0 N--CA 1.53 3.53 0 CA-C-O 118.653 -0.689 . . . . 0.0 110.659 178.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -86.52 -26.73 24.4 Favored 'General case' 0 N--CA 1.529 3.514 0 CA-C-N 118.667 0.667 . . . . 0.0 109.592 176.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 15.9 tp -65.69 -44.07 87.33 Favored 'General case' 1 N--CA 1.54 4.046 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 21.4 mt -59.65 -21.66 60.8 Favored 'General case' 0 N--CA 1.533 3.685 0 C-N-CA 123.752 0.821 . . . . 0.0 111.719 178.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 14.2 mmm180 -77.83 -53.44 7.49 Favored 'General case' 0 N--CA 1.524 3.235 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 69.04 77.1 0.42 Allowed Glycine 1 N--CA 1.523 4.458 0 CA-C-O 119.195 -0.781 . . . . 0.0 111.197 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -162.51 -52.69 0.04 OUTLIER 'General case' 0 N--CA 1.529 3.512 0 CA-C-N 117.834 0.817 . . . . 0.0 110.36 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 75.3 mtm -136.03 62.82 1.61 Allowed 'General case' 0 N--CA 1.521 3.108 0 N-CA-C 106.106 -1.813 . . . . 0.0 106.106 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 57.9 m -136.42 9.62 3.18 Favored 'General case' 0 N--CA 1.518 2.949 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.718 -176.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -112.15 -64.31 1.31 Allowed 'General case' 0 N--CA 1.517 2.907 0 CA-C-N 119.259 0.936 . . . . 0.0 110.404 -179.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -110.03 -43.53 3.96 Favored 'General case' 0 N--CA 1.519 3.01 0 C-N-CA 123.166 0.586 . . . . 0.0 110.271 -178.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -70.07 -13.12 62.06 Favored 'General case' 0 N--CA 1.514 2.767 0 CA-C-O 117.89 -1.052 . . . . 0.0 113.551 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 571' ' ' LEU . . . . . 0.853 HD23 HD11 ' B' ' 582' ' ' ILE . 18.2 tp -82.4 -51.46 7.83 Favored 'General case' 0 N--CA 1.527 3.411 0 CA-C-N 120.245 1.384 . . . . 0.0 110.615 -179.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -44.56 -30.51 0.91 Allowed 'General case' 1 N--CA 1.55 4.563 0 CA-C-N 119.125 0.875 . . . . 0.0 113.308 179.956 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -67.21 -43.59 81.71 Favored 'General case' 0 N--CA 1.535 3.806 0 C-N-CA 122.882 0.473 . . . . 0.0 110.795 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -47.68 -50.55 24.57 Favored 'General case' 0 N--CA 1.534 3.741 0 C-N-CA 124.734 1.214 . . . . 0.0 113.449 -178.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 2.0 pp -135.97 -43.86 0.65 Allowed 'General case' 0 N--CA 1.537 3.885 0 CA-C-O 118.938 -0.554 . . . . 0.0 111.604 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 113.85 82.37 1.1 Allowed Glycine 1 N--CA 1.523 4.479 0 N-CA-C 110.305 -1.118 . . . . 0.0 110.305 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -103.2 -43.04 5.57 Favored 'General case' 0 N--CA 1.526 3.352 0 C-N-CA 123.426 0.691 . . . . 0.0 109.594 178.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 108.61 157.94 18.99 Favored Glycine 0 N--CA 1.515 3.913 0 N-CA-C 109.734 -1.346 . . . . 0.0 109.734 -179.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 579' ' ' ILE . . . . . 0.528 HG21 ' N6 ' ' E' ' 4' ' ' ' DA' . 0.8 OUTLIER -82.74 -15.82 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.898 0 CA-C-N 119.235 1.518 . . . . 0.0 108.265 177.701 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 580' ' ' ALA . . . . . 0.962 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -69.4 -42.62 74.87 Favored 'General case' 0 N--CA 1.525 3.318 0 CA-C-N 120.047 1.294 . . . . 0.0 109.149 176.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.2 p -75.94 -38.68 57.35 Favored 'General case' 1 N--CA 1.542 4.142 0 CA-C-N 119.127 0.876 . . . . 0.0 112.365 179.31 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 582' ' ' ILE . . . . . 0.853 HD11 HD23 ' B' ' 571' ' ' LEU . 0.8 OUTLIER -67.66 -37.19 78.23 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.356 0 C-N-CA 123.347 0.659 . . . . 0.0 112.35 -175.112 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 75.6 p -101.07 -24.79 14.23 Favored 'General case' 0 N--CA 1.511 2.608 0 CA-C-O 117.897 -1.049 . . . . 0.0 111.685 -179.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 13.7 ptt180 -74.59 -23.69 58.78 Favored 'General case' 0 N--CA 1.526 3.365 0 CA-C-N 119.936 1.244 . . . . 0.0 109.004 175.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -63.02 -35.03 91.54 Favored Glycine 1 N--CA 1.528 4.781 0 N-CA-C 107.871 -2.092 . . . . 0.0 107.871 173.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 19.4 m -65.35 -34.52 78.52 Favored 'General case' 1 N--CA 1.541 4.104 0 C-N-CA 123.136 0.575 . . . . 0.0 110.403 176.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -62.85 -35.09 78.83 Favored 'General case' 1 N--CA 1.547 4.408 0 C-N-CA 123.354 0.662 . . . . 0.0 110.274 178.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.84 -35.26 76.1 Favored 'General case' 0 N--CA 1.534 3.758 0 C-N-CA 123.773 0.829 . . . . 0.0 111.133 179.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 24.1 mt -58.25 -42.47 86.46 Favored 'General case' 0 N--CA 1.531 3.575 0 C-N-CA 123.724 0.81 . . . . 0.0 110.731 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 3.1 mptt -60.29 -29.41 68.81 Favored 'General case' 1 N--CA 1.543 4.21 0 C-N-CA 123.205 0.602 . . . . 0.0 111.89 179.148 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -71.8 -40.88 68.87 Favored 'General case' 0 N--CA 1.517 2.884 0 CA-C-O 119.226 -0.416 . . . . 0.0 110.241 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -70.82 159.0 86.77 Favored Pre-proline 0 N--CA 1.527 3.41 0 CA-C-O 118.5 -0.762 . . . . 0.0 111.439 178.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -82.07 178.88 5.99 Favored 'Trans proline' 0 C--N 1.376 2.015 0 C-N-CA 122.013 1.809 . . . . 0.0 111.731 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.8 t -92.36 -26.97 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.906 0 CA-C-O 117.558 -1.211 . . . . 0.0 110.272 179.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -65.35 -38.14 89.18 Favored 'General case' 0 N--CA 1.515 2.819 0 CA-C-N 119.938 1.244 . . . . 0.0 110.195 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 596' ' ' LEU . . . . . 0.43 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.8 mp -97.95 -20.92 17.14 Favored 'General case' 0 N--CA 1.513 2.676 0 C-N-CA 123.443 0.697 . . . . 0.0 110.973 178.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -27.42 66.83 Favored 'General case' 0 N--CA 1.536 3.854 0 N-CA-C 103.389 -2.819 . . . . 0.0 103.389 168.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.16 -39.88 79.98 Favored 'General case' 0 N--CA 1.523 3.224 0 C-N-CA 124.345 1.058 . . . . 0.0 109.742 173.401 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 599' ' ' TRP . . . . . 0.603 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 45.7 t90 -61.86 -35.72 79.14 Favored 'General case' 0 N--CA 1.526 3.374 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 178.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.81 -36.26 47.27 Favored 'General case' 1 N--CA 1.541 4.092 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 176.781 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -73.38 -37.28 66.07 Favored 'General case' 0 N--CA 1.533 3.716 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 175.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 602' ' ' GLU . . . . . 0.445 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.2 OUTLIER -59.65 -22.16 61.5 Favored 'General case' 1 N--CA 1.544 4.261 0 CA-C-O 118.675 -0.679 . . . . 0.0 110.912 175.513 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' B' B ' 603' ' ' VAL . . . . . 0.519 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.0 OUTLIER -112.93 3.15 8.32 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.763 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -176.548 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 75.6 mt -114.43 -60.26 1.91 Allowed 'General case' 0 N--CA 1.519 3.017 0 N-CA-C 106.395 -1.705 . . . . 0.0 106.395 175.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 4.1 mp -62.12 -64.28 0.98 Allowed 'General case' 0 N--CA 1.536 3.841 0 C-N-CA 124.467 1.107 . . . . 0.0 111.768 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 61.9 mttm -63.82 -45.85 87.76 Favored 'General case' 0 N--CA 1.534 3.752 0 C-N-CA 122.926 0.49 . . . . 0.0 111.333 -177.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 73.3 m . . . . . 0 N--CA 1.525 3.306 0 CA-C-O 118.654 -0.689 . . . . 0.0 110.418 -179.718 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 898' ' ' TRP . . . . . 0.76 ' HB2' HG23 ' B' ' 544' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.001 0 CA-C-O 117.328 -1.32 . . . . 0.0 109.03 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 998' ' ' TRP . . . . . 0.76 ' HB2' HG23 ' A' ' 44' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.956 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.421 -9.745 3 O4'-C1'-N19 119.034 14.042 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.559 4 O4'-C1'-N19 120.862 16.328 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -10.002 3 O4'-C1'-N19 119.661 14.826 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . 0.417 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 6 C3'--C2' 1.418 -9.967 4 O4'-C1'-N19 119.061 14.076 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' E' E ' 5' ' ' ' DC' . . . . . 0.416 ' H41' ' HA ' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.411 -10.663 3 O4'-C1'-N19 119.488 14.61 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.409 -10.921 5 O4'-C1'-N19 119.27 14.338 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' E' E ' 7' ' ' ' DA' . . . . . 0.635 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.396 -12.157 3 C4'-C3'-C2' 113.03 9.83 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' E' E ' 8' ' ' ' DG' . . . . . 0.635 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 O3'--C3' 1.56 9.931 4 O4'-C1'-N19 120.021 15.276 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.566 10.372 4 O4'-C1'-N19 119.817 15.022 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.408 -11.008 5 O4'-C1'-N19 120.168 15.46 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.278 2 O4'-C1'-N19 120.647 16.059 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.768 5 O4'-C1'-N19 119.014 14.017 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' E' E ' 13' ' ' ' DC' . . . . . 0.5 H2'' " O5'" ' E' ' 14' ' ' ' DT' . . . . . . . . 6 O3'--C3' 1.551 9.206 3 O4'-C1'-N19 119.586 14.733 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' E' E ' 14' ' ' ' DT' . . . . . 0.693 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.402 -11.606 6 O4'-C1'-N19 119.534 14.667 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' E' E ' 15' ' ' ' DA' . . . . . 0.748 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 5 C3'--C2' 1.423 -9.516 3 O4'-C1'-N19 119.828 15.035 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.427 -9.114 4 O4'-C1'-N19 119.437 14.546 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.072 6 O4'-C1'-N19 119.169 14.211 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.293 4 O4'-C1'-N19 119.818 15.023 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.12 4 O4'-C1'-N19 119.935 15.169 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.598 6.987 4 O4'-C1'-N19 119.446 14.557 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.395 3 O4'-C1'-N19 119.551 14.689 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.407 -11.096 3 O4'-C1'-N19 119.582 14.727 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.455 5 O4'-C1'-N19 120.268 15.586 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' F' F ' 4' ' ' ' DA' . . . . . 0.552 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.424 -9.447 4 O4'-C1'-N19 119.458 14.572 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' F' F ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.177 4 O4'-C1'-N19 118.688 13.61 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.407 -11.146 3 O4'-C1'-N19 120.112 15.39 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.408 -11.952 4 N19-C1'-C2' 130.914 10.446 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.42 -9.751 3 O4'-C1'-N19 119.692 14.865 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.565 10.297 3 C4'-C3'-C2' 117.038 13.838 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.407 -11.091 4 O4'-C1'-N19 118.644 13.555 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.414 -10.377 5 O4'-C1'-N19 120.31 15.637 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -10.028 5 O4'-C1'-N19 119.367 14.459 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.426 -9.173 4 O4'-C1'-N19 118.995 13.994 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' F' F ' 14' ' ' ' DT' . . . . . 0.61 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.416 -10.207 3 O4'-C1'-N19 119.327 14.409 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' F' F ' 15' ' ' ' DA' . . . . . 0.833 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.414 -10.354 6 O4'-C1'-N19 119.899 15.124 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.417 -10.077 4 O4'-C1'-N19 119.347 14.433 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.618 3 O4'-C1'-N19 119.513 14.641 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.058 4 O4'-C1'-N19 120.607 16.009 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.355 4 O4'-C1'-N19 119.371 14.464 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.513 7.116 4 O4'-C1'-N19 119.909 15.136 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 . . . . . 0 N--CA 1.505 2.318 0 CA-C-O 119.628 -0.225 . . . . 0.0 110.488 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 52.7 p -154.02 124.55 3.43 Favored Pre-proline 0 N--CA 1.524 3.26 0 CA-C-O 117.135 -1.412 . . . . 0.0 110.156 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -76.27 132.23 13.59 Favored 'Trans proline' 0 C--N 1.389 2.708 0 C-N-CA 122.648 2.232 . . . . 0.0 109.871 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -89.64 137.73 32.08 Favored 'General case' 0 N--CA 1.531 3.577 0 C-N-CA 122.486 0.314 . . . . 0.0 110.796 -179.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 50.5 p -127.99 129.7 47.17 Favored 'General case' 0 N--CA 1.522 3.13 0 C-N-CA 123.563 0.745 . . . . 0.0 109.767 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -101.43 131.65 47.42 Favored 'General case' 0 N--CA 1.522 3.161 0 C-N-CA 122.974 0.51 . . . . 0.0 110.196 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -156.23 -51.94 0.08 Allowed 'General case' 0 N--CA 1.522 3.163 0 C-N-CA 122.673 0.389 . . . . 0.0 110.284 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.44 -34.82 63.3 Favored 'General case' 0 N--CA 1.531 3.591 0 CA-C-O 118.805 -0.617 . . . . 0.0 111.18 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -95.37 123.23 38.79 Favored 'General case' 0 N--CA 1.517 2.893 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -112.9 122.64 48.24 Favored 'General case' 0 N--CA 1.516 2.849 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -138.1 152.1 48.44 Favored 'General case' 0 N--CA 1.528 3.429 0 C-N-CA 122.81 0.444 . . . . 0.0 111.02 -178.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? 61.83 119.14 0.01 OUTLIER 'General case' 0 N--CA 1.533 3.695 0 C-N-CA 124.629 1.171 . . . . 0.0 111.638 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 56.34 103.67 0.01 OUTLIER 'General case' 0 N--CA 1.531 3.589 0 C-N-CA 124.561 1.144 . . . . 0.0 111.648 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -111.46 63.59 0.61 Allowed 'General case' 0 N--CA 1.516 2.849 0 N-CA-C 106.697 -1.594 . . . . 0.0 106.697 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -132.08 -92.46 0.39 Allowed 'General case' 0 N--CA 1.514 2.74 0 CA-C-O 118.205 -0.902 . . . . 0.0 109.265 -178.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.681 ' CZ3' HD22 ' B' ' 551' ' ' LEU . 72.6 t-105 -48.45 -38.49 19.96 Favored 'General case' 0 N--CA 1.534 3.728 0 CA-C-N 119.862 1.21 . . . . 0.0 112.148 179.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.505 HD22 ' N ' ' A' ' 20' ' ' LEU . 2.6 mm? -87.37 -27.11 22.99 Favored 'General case' 0 N--CA 1.524 3.239 0 CA-C-O 117.369 -1.3 . . . . 0.0 112.891 -174.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.71 -28.4 68.63 Favored 'General case' 1 N--CA 1.54 4.059 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 173.272 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.488 ' HB2' HG21 ' B' ' 555' ' ' VAL . 0.1 OUTLIER -79.6 -39.44 31.65 Favored 'General case' 0 N--CA 1.5 2.046 0 CA-C-O 116.366 -1.778 . . . . 0.0 108.075 173.585 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 19' ' ' TRP . 86.7 t -68.22 -21.28 26.45 Favored 'Isoleucine or valine' 1 N--CA 1.568 5.456 0 CA-C-N 121.138 1.79 . . . . 0.0 112.569 -177.631 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -78.19 -53.02 7.81 Favored 'General case' 0 N--CA 1.534 3.741 0 CA-C-N 120.112 1.324 . . . . 0.0 107.51 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.6 mp -70.03 -15.94 63.08 Favored 'General case' 0 N--CA 1.529 3.492 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 175.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.473 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -72.34 -37.8 68.77 Favored 'General case' 0 N--CA 1.513 2.694 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 176.305 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.677 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 11.0 tptp -69.16 -15.02 63.31 Favored 'General case' 0 N--CA 1.515 2.804 0 CA-C-O 117.924 -1.036 . . . . 0.0 111.483 176.171 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -74.16 -41.28 61.75 Favored 'General case' 0 N--CA 1.533 3.681 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 175.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.601 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -87.62 -7.1 57.91 Favored 'General case' 0 N--CA 1.505 2.301 0 CA-C-O 118.671 -0.681 . . . . 0.0 110.364 177.216 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.677 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -82.99 -33.34 26.62 Favored 'General case' 0 N--CA 1.537 3.92 0 CA-C-N 120.071 1.305 . . . . 0.0 109.073 179.532 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -65.56 -40.12 92.47 Favored 'General case' 0 N--CA 1.532 3.649 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 176.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -90.94 -90.61 0.15 Allowed 'General case' 0 N--CA 1.514 2.736 0 N-CA-C 106.143 -1.799 . . . . 0.0 106.143 176.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 152.93 50.73 0.0 OUTLIER 'General case' 1 N--CA 1.558 4.93 0 C-N-CA 127.629 2.372 . . . . 0.0 108.474 176.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.483 HD22 ' CD2' ' B' ' 596' ' ' LEU . 5.7 mt -112.16 13.29 20.54 Favored 'General case' 0 N--CA 1.527 3.389 0 C-N-CA 124.312 1.045 . . . . 0.0 109.855 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.497 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 43.6 p-80 -83.07 3.61 29.74 Favored 'General case' 0 N--CA 1.506 2.341 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 175.566 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.803 ' HA ' HD23 ' A' ' 39' ' ' LEU . 21.2 mt -94.92 -50.95 0.25 Allowed Pre-proline 0 N--CA 1.509 2.503 0 CA-C-O 116.957 -1.497 . . . . 0.0 108.971 -175.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.472 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 3.9 Cg_exo -65.41 -30.87 52.8 Favored 'Trans proline' 0 C--N 1.396 3.036 0 N-CA-C 106.563 -2.13 . . . . 0.0 106.563 170.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.497 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.2 OUTLIER -67.32 -37.83 83.96 Favored 'General case' 0 N--CA 1.52 3.068 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 175.88 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.803 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -73.99 -15.98 61.08 Favored 'General case' 1 N--CA 1.543 4.186 0 CA-C-N 119.549 1.068 . . . . 0.0 110.407 175.956 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -82.58 -17.91 43.18 Favored 'General case' 0 N--CA 1.523 3.218 0 CA-C-N 119.651 1.114 . . . . 0.0 110.151 177.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 pp -99.83 -44.91 5.9 Favored 'General case' 0 N--CA 1.531 3.578 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -177.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 12.8 ptp -109.94 2.04 19.49 Favored 'General case' 1 N--CA 1.551 4.579 0 CA-C-N 118.962 0.801 . . . . 0.0 112.637 -175.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.0 mt -115.89 -65.39 1.19 Allowed 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 117.729 -1.129 . . . . 0.0 110.416 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 35.4 p 119.45 159.66 0.0 OUTLIER Pre-proline 1 N--CA 1.573 5.705 0 C-N-CA 128.32 2.648 . . . . 0.0 109.542 -178.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -67.24 -30.97 36.74 Favored 'Trans proline' 0 C--N 1.39 2.761 0 C-N-CA 122.026 1.817 . . . . 0.0 109.276 175.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -65.63 -26.42 67.81 Favored 'General case' 0 N--CA 1.531 3.604 0 CA-C-O 118.476 -0.773 . . . . 0.0 109.77 176.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -69.64 -33.35 72.5 Favored 'General case' 0 N--CA 1.524 3.275 0 CA-C-O 117.584 -1.198 . . . . 0.0 109.579 178.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 25.3 ptt180 -83.97 -18.12 38.27 Favored 'General case' 0 N--CA 1.53 3.533 0 CA-C-N 119.653 1.115 . . . . 0.0 108.906 174.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -75.23 -21.77 58.38 Favored 'General case' 0 N--CA 1.521 3.116 0 N-CA-C 107.2 -1.408 . . . . 0.0 107.2 173.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.474 ' HB1' ' CZ ' ' A' ' 54' ' ' ARG . . . -92.91 -35.22 13.45 Favored 'General case' 0 N--CA 1.506 2.368 0 CA-C-O 118.124 -0.941 . . . . 0.0 109.05 179.028 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.465 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 25.7 tp -71.99 -21.81 61.52 Favored 'General case' 0 N--CA 1.536 3.873 0 N-CA-C 106.232 -1.766 . . . . 0.0 106.232 172.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.47 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -68.91 -75.55 0.52 Allowed Glycine 0 C--N 1.374 2.648 0 C-N-CA 125.585 1.564 . . . . 0.0 110.684 177.068 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.4 m -66.97 -26.08 66.64 Favored 'General case' 0 N--CA 1.534 3.757 0 CA-C-O 117.774 -1.108 . . . . 0.0 113.389 -177.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.474 ' CZ ' ' HB1' ' A' ' 50' ' ' ALA . 29.2 mtm180 -72.53 -47.06 51.37 Favored 'General case' 0 N--CA 1.532 3.637 0 CA-C-N 120.105 1.321 . . . . 0.0 108.329 178.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.6 t -66.77 -18.41 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.978 0 CA-C-N 119.638 1.108 . . . . 0.0 108.839 174.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.3 mtp180 -73.49 -46.81 45.81 Favored 'General case' 0 N--CA 1.528 3.454 0 CA-C-O 117.16 -1.4 . . . . 0.0 111.792 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.531 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -75.24 -23.54 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.733 0 CA-C-N 121.626 2.012 . . . . 0.0 111.304 -179.049 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.67 HG11 HD11 ' B' ' 541' ' ' LEU . 0.0 OUTLIER -83.46 -47.32 18.16 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.261 0 CA-C-N 120.374 1.443 . . . . 0.0 107.59 -179.529 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -63.88 -29.39 70.58 Favored 'General case' 0 N--CA 1.528 3.446 0 N-CA-C 109.435 -0.579 . . . . 0.0 109.435 177.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -88.28 -17.99 29.52 Favored 'General case' 0 N--CA 1.524 3.237 0 CA-C-O 118.084 -0.96 . . . . 0.0 110.549 177.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.7 mt -79.93 -40.97 26.99 Favored 'General case' 0 N--CA 1.531 3.58 0 CA-C-N 119.439 1.018 . . . . 0.0 108.342 178.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.2 tt -50.05 -36.94 31.06 Favored 'General case' 1 N--CA 1.543 4.184 0 C-N-CA 124.402 1.081 . . . . 0.0 110.537 178.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -80.07 -59.79 2.58 Favored 'General case' 0 N--CA 1.524 3.271 0 N-CA-C 106.824 -1.546 . . . . 0.0 106.824 177.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 57.11 67.59 2.14 Favored Glycine 1 N--CA 1.524 4.506 0 C-N-CA 124.222 0.915 . . . . 0.0 113.264 176.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -130.06 -52.17 1.12 Allowed 'General case' 0 N--CA 1.517 2.921 0 CA-C-N 117.765 0.782 . . . . 0.0 109.027 179.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 73.4 mtp -141.86 15.82 2.12 Favored 'General case' 0 N--CA 1.527 3.387 0 C-N-CA 122.895 0.478 . . . . 0.0 111.761 -179.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 5.1 t -115.67 37.37 3.62 Favored 'General case' 0 N--CA 1.531 3.603 0 CA-C-N 119.517 1.053 . . . . 0.0 111.581 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -114.92 -47.07 2.89 Favored 'General case' 0 N--CA 1.518 2.928 0 C-N-CA 124.381 1.072 . . . . 0.0 109.26 178.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -105.21 -55.6 2.3 Favored 'General case' 0 N--CA 1.526 3.342 0 C-N-CA 123.745 0.818 . . . . 0.0 109.555 -179.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -69.29 -9.2 52.15 Favored 'General case' 0 N--CA 1.52 3.055 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -178.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.705 HD23 HG21 ' A' ' 82' ' ' ILE . 22.1 tp -69.0 -46.99 66.59 Favored 'General case' 0 N--CA 1.528 3.43 0 CA-C-N 119.526 1.057 . . . . 0.0 111.229 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -41.42 -41.42 2.02 Favored 'General case' 1 N--CA 1.549 4.519 0 N-CA-C 114.555 1.316 . . . . 0.0 114.555 -178.093 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -68.32 -36.14 78.85 Favored 'General case' 0 N--CA 1.538 3.943 0 C-N-CA 122.859 0.464 . . . . 0.0 111.94 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -47.61 -55.99 8.15 Favored 'General case' 0 N--CA 1.535 3.814 0 C-N-CA 124.838 1.255 . . . . 0.0 113.383 -178.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -128.81 -38.87 1.64 Allowed 'General case' 0 N--CA 1.532 3.663 0 CA-C-O 118.621 -0.705 . . . . 0.0 111.68 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 125.3 78.98 0.34 Allowed Glycine 1 N--CA 1.522 4.38 0 CA-C-N 119.181 0.9 . . . . 0.0 111.539 178.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.56 104.99 4.11 Favored 'General case' 0 N--CA 1.523 3.204 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 177.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -38.69 168.37 0.01 OUTLIER Glycine 1 N--CA 1.536 5.309 0 C-N-CA 125.576 1.56 . . . . 0.0 116.021 -176.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.552 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.5 OUTLIER -80.68 -20.37 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.981 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 177.754 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.748 ' HB2' ' H62' ' E' ' 15' ' ' ' DA' . . . -63.2 -32.49 73.9 Favored 'General case' 0 N--CA 1.522 3.171 0 CA-C-O 117.797 -1.097 . . . . 0.0 110.158 177.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 5.3 p -80.97 -50.17 10.04 Favored 'General case' 0 N--CA 1.536 3.873 0 CA-C-N 119.614 1.097 . . . . 0.0 111.962 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.705 HG21 HD23 ' A' ' 71' ' ' LEU . 0.3 OUTLIER -65.83 -20.73 27.83 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.239 0 CA-C-O 117.831 -1.081 . . . . 0.0 112.888 -178.004 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 46.1 p -107.96 -25.68 11.06 Favored 'General case' 0 N--CA 1.514 2.763 0 CA-C-N 119.794 1.179 . . . . 0.0 111.904 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 14.4 ptt180 -79.28 -21.92 45.4 Favored 'General case' 0 N--CA 1.532 3.633 0 CA-C-N 119.722 1.147 . . . . 0.0 108.3 174.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.14 -32.67 69.13 Favored Glycine 0 N--CA 1.513 3.808 0 N-CA-C 110.259 -1.137 . . . . 0.0 110.259 177.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 51.5 p -67.88 -35.34 78.33 Favored 'General case' 1 N--CA 1.541 4.082 0 CA-C-N 118.579 1.189 . . . . 0.0 111.084 179.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -61.28 -30.53 70.53 Favored 'General case' 1 N--CA 1.541 4.114 0 C-N-CA 123.31 0.644 . . . . 0.0 110.962 179.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.3 m -69.0 -38.91 79.56 Favored 'General case' 0 N--CA 1.534 3.746 0 C-N-CA 123.422 0.689 . . . . 0.0 110.46 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 15.5 mt -59.54 -40.43 87.22 Favored 'General case' 0 N--CA 1.528 3.465 0 C-N-CA 124.02 0.928 . . . . 0.0 111.506 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.08 -19.72 54.6 Favored 'General case' 1 N--CA 1.541 4.112 0 CA-C-O 118.309 -0.853 . . . . 0.0 112.682 -179.322 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -96.27 -35.82 11.12 Favored 'General case' 0 N--CA 1.517 2.92 0 CA-C-N 119.179 0.9 . . . . 0.0 111.907 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -48.1 160.77 0.4 Allowed Pre-proline 1 N--CA 1.55 4.568 0 CA-C-O 118.253 -0.88 . . . . 0.0 113.259 -179.126 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -81.77 150.11 16.34 Favored 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 121.996 1.798 . . . . 0.0 109.946 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -84.11 -25.12 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.865 0 CA-C-O 117.817 -1.087 . . . . 0.0 111.24 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -62.83 -39.48 94.48 Favored 'General case' 0 N--CA 1.518 2.967 0 CA-C-N 120.16 1.346 . . . . 0.0 109.881 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.528 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.4 mp -98.08 -16.35 19.62 Favored 'General case' 0 N--CA 1.513 2.723 0 C-N-CA 123.836 0.854 . . . . 0.0 111.438 178.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -34.93 79.09 Favored 'General case' 1 N--CA 1.544 4.252 0 N-CA-C 103.458 -2.793 . . . . 0.0 103.458 169.348 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -56.17 -39.9 73.08 Favored 'General case' 0 N--CA 1.508 2.432 0 C-N-CA 124.401 1.08 . . . . 0.0 111.144 175.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.593 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 63.8 t90 -63.39 -34.67 78.23 Favored 'General case' 0 N--CA 1.53 3.548 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 177.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.16 -40.85 64.64 Favored 'General case' 0 N--CA 1.539 3.992 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 175.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -67.5 -36.79 81.76 Favored 'General case' 1 N--CA 1.54 4.045 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 175.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.476 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 3.0 mt-10 -60.75 -22.8 64.41 Favored 'General case' 1 N--CA 1.542 4.149 0 C-N-CA 123.635 0.774 . . . . 0.0 110.737 176.645 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -121.81 6.67 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.366 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -177.104 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.36 -55.4 2.52 Favored 'General case' 0 N--CA 1.513 2.715 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 176.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.9 tp -61.52 -41.53 97.46 Favored 'General case' 0 N--CA 1.529 3.489 0 C-N-CA 124.861 1.264 . . . . 0.0 111.68 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt 77.18 100.58 0.07 Allowed 'General case' 0 N--CA 1.533 3.685 0 C-N-CA 124.779 1.232 . . . . 0.0 108.401 -178.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 6.5 t . . . . . 0 N--CA 1.524 3.257 0 CA-C-O 118.476 -0.773 . . . . 0.0 110.227 -179.205 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 . . . . . 0 N--CA 1.5 2.034 0 N-CA-C 109.541 -0.541 . . . . 0.0 109.541 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 72.4 m -136.6 124.19 14.53 Favored Pre-proline 0 N--CA 1.518 2.935 0 CA-C-O 117.508 -1.234 . . . . 0.0 109.665 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -81.55 4.69 6.81 Favored 'Trans proline' 0 CA--C 1.586 3.092 0 C-N-CA 122.352 2.035 . . . . 0.0 112.31 179.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -93.3 -52.95 4.3 Favored 'General case' 0 N--CA 1.53 3.573 0 CA-C-N 119.717 1.144 . . . . 0.0 110.251 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 7.8 t -118.64 132.17 56.18 Favored 'General case' 0 N--CA 1.524 3.269 0 C-N-CA 123.064 0.546 . . . . 0.0 110.544 -179.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -155.24 142.95 19.8 Favored 'General case' 0 N--CA 1.527 3.398 0 C-N-CA 123.184 0.594 . . . . 0.0 110.876 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -154.62 149.79 27.0 Favored 'General case' 0 N--CA 1.525 3.314 0 N-CA-C 112.443 0.535 . . . . 0.0 112.443 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 3.9 mtt -94.5 126.07 39.55 Favored 'General case' 0 N--CA 1.524 3.229 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 178.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -151.1 -49.28 0.12 Allowed 'General case' 0 N--CA 1.52 3.052 0 CA-C-O 119.101 -0.476 . . . . 0.0 111.864 -178.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -93.1 -56.43 2.97 Favored 'General case' 0 N--CA 1.525 3.315 0 CA-C-N 118.112 0.415 . . . . 0.0 110.608 -178.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 65.5 mt-30 -102.55 128.75 49.07 Favored 'General case' 0 N--CA 1.528 3.456 0 C-N-CA 122.7 0.4 . . . . 0.0 110.091 -178.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 38.9 ttt180 -159.24 -53.72 0.06 Allowed 'General case' 0 N--CA 1.524 3.271 0 CA-C-O 119.247 -0.406 . . . . 0.0 110.95 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -78.59 168.97 18.98 Favored 'General case' 0 N--CA 1.535 3.783 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -178.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -79.24 145.43 33.58 Favored 'General case' 0 N--CA 1.53 3.564 0 C-N-CA 122.89 0.476 . . . . 0.0 110.914 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -100.38 -69.03 0.78 Allowed 'General case' 0 N--CA 1.524 3.242 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 519' ' ' TRP . . . . . 0.704 ' CE2' HD22 ' A' ' 39' ' ' LEU . 72.1 t-105 -42.69 -29.27 0.29 Allowed 'General case' 1 N--CA 1.546 4.354 0 C-N-CA 124.373 1.069 . . . . 0.0 113.509 179.676 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 520' ' ' LEU . . . . . 0.571 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.4 mm? -94.34 -29.15 15.17 Favored 'General case' 0 N--CA 1.529 3.476 0 CA-C-O 117.769 -1.11 . . . . 0.0 113.863 -172.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 37.0 mtm180 -64.26 -23.77 67.42 Favored 'General case' 0 N--CA 1.533 3.686 0 N-CA-C 106.266 -1.753 . . . . 0.0 106.266 171.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . 0.545 ' O ' HD23 ' B' ' 526' ' ' LEU . 1.9 m-85 -77.61 -38.74 47.46 Favored 'General case' 0 N--CA 1.514 2.739 0 N-CA-C 106.7 -1.593 . . . . 0.0 106.7 173.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.75 -24.31 34.08 Favored 'Isoleucine or valine' 1 N--CA 1.551 4.622 0 CA-C-O 116.924 -1.512 . . . . 0.0 112.627 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -77.48 -42.14 36.88 Favored 'General case' 1 N--CA 1.542 4.136 0 CA-C-N 121.463 1.938 . . . . 0.0 108.443 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . 0.411 HD12 ' HB ' ' A' ' 103' ' ' VAL . 0.8 OUTLIER -68.79 -28.99 67.26 Favored 'General case' 1 N--CA 1.539 4.003 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 175.473 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' B' B ' 526' ' ' LEU . . . . . 0.545 HD23 ' O ' ' B' ' 522' ' ' PHE . 2.7 mm? -72.25 -32.78 66.99 Favored 'General case' 0 N--CA 1.524 3.243 0 CA-C-O 118.511 -0.757 . . . . 0.0 109.459 177.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 31.1 ttmt -71.6 -28.88 64.11 Favored 'General case' 0 N--CA 1.517 2.901 0 CA-C-O 118.388 -0.815 . . . . 0.0 110.641 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -71.71 -35.94 70.37 Favored 'General case' 0 N--CA 1.533 3.702 0 CA-C-N 119.052 0.842 . . . . 0.0 108.98 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 529' ' ' ALA . . . . . 0.593 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -89.44 -9.38 50.4 Favored 'General case' 0 CA--C 1.578 2.028 0 CA-C-O 118.358 -0.829 . . . . 0.0 110.209 178.132 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -82.07 -34.41 29.42 Favored 'General case' 0 N--CA 1.533 3.678 0 CA-C-N 120.411 1.459 . . . . 0.0 108.574 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -61.69 -41.0 96.99 Favored 'General case' 0 N--CA 1.538 3.926 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 177.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 66.2 m-80 -95.42 -88.9 0.25 Allowed 'General case' 0 N--CA 1.514 2.736 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 176.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.8 p30 153.54 49.74 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.062 0 C-N-CA 127.764 2.426 . . . . 0.0 108.228 177.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 534' ' ' LEU . . . . . 0.528 HD22 ' CD2' ' A' ' 96' ' ' LEU . 10.0 mt -101.73 2.05 38.09 Favored 'General case' 0 N--CA 1.529 3.523 0 C-N-CA 124.561 1.144 . . . . 0.0 111.197 -179.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 535' ' ' HIS . . . . . 0.582 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 56.7 p-80 -80.64 0.48 34.06 Favored 'General case' 0 N--CA 1.511 2.617 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 174.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 536' ' ' LEU . . . . . . . . . . . . . 46.7 mt -93.38 -49.62 0.28 Allowed Pre-proline 0 N--CA 1.509 2.48 0 CA-C-O 116.673 -1.632 . . . . 0.0 109.492 -176.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 537' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -63.16 -36.42 58.13 Favored 'Trans proline' 0 C--N 1.397 3.11 0 N-CA-C 106.539 -2.139 . . . . 0.0 106.539 171.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.28 -49.8 74.93 Favored 'General case' 0 N--CA 1.531 3.594 0 C-N-CA 124.21 1.004 . . . . 0.0 109.19 174.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 13.2 mt -66.17 -21.54 66.33 Favored 'General case' 1 N--CA 1.54 4.04 0 CA-C-O 118.086 -0.959 . . . . 0.0 112.599 -178.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 21.9 t30 -70.77 -12.31 61.47 Favored 'General case' 0 N--CA 1.534 3.752 0 CA-C-N 119.297 0.953 . . . . 0.0 111.514 178.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 541' ' ' LEU . . . . . 0.67 HD11 HG11 ' A' ' 58' ' ' VAL . 0.0 OUTLIER -117.29 -37.4 3.53 Favored 'General case' 0 N--CA 1.52 3.059 0 CA-C-N 119.212 0.914 . . . . 0.0 110.344 -178.662 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 542' ' ' MET . . . . . 0.659 ' N ' HD13 ' B' ' 541' ' ' LEU . 6.7 ptt? -96.95 9.77 41.02 Favored 'General case' 1 N--CA 1.544 4.234 0 CA-C-N 119.618 1.099 . . . . 0.0 112.796 -179.001 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 543' ' ' LEU . . . . . 0.473 ' O ' HG23 ' B' ' 544' ' ' THR . 1.5 tp -132.05 -93.42 0.37 Allowed 'General case' 0 N--CA 1.53 3.547 0 CA-C-N 119.898 1.226 . . . . 0.0 111.995 178.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 544' ' ' THR . . . . . 0.577 HG23 ' HB2' ' A' ' 898' ' ' TRP . 1.2 p 147.3 135.7 0.0 OUTLIER Pre-proline 1 N--CA 1.566 5.352 0 C-N-CA 127.101 2.161 . . . . 0.0 107.511 -178.875 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -60.15 -33.98 94.61 Favored 'Trans proline' 0 N--CA 1.519 3.01 0 C-N-CA 122.734 2.289 . . . . 0.0 112.137 178.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -64.47 -34.73 78.89 Favored 'General case' 0 N--CA 1.536 3.864 0 CA-C-O 118.856 -0.592 . . . . 0.0 111.651 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -75.5 -29.78 59.62 Favored 'General case' 0 N--CA 1.524 3.259 0 CA-C-O 117.46 -1.257 . . . . 0.0 111.133 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 548' ' ' ARG . . . . . 0.476 ' HB2' ' HB2' ' A' ' 19' ' ' TRP . 32.9 ptt180 -76.3 -24.44 54.37 Favored 'General case' 0 N--CA 1.532 3.627 0 CA-C-N 120.238 1.381 . . . . 0.0 109.152 175.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -64.29 -43.25 95.35 Favored 'General case' 0 N--CA 1.536 3.855 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 173.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -73.02 -21.66 60.78 Favored 'General case' 0 N--CA 1.517 2.904 0 CA-C-O 117.104 -1.427 . . . . 0.0 110.649 176.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 551' ' ' LEU . . . . . 0.681 HD22 ' CZ3' ' A' ' 19' ' ' TRP . 10.9 tp -75.29 -23.39 57.38 Favored 'General case' 0 N--CA 1.521 3.095 0 CA-C-N 120.287 1.403 . . . . 0.0 107.909 174.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -73.71 -59.57 4.02 Favored Glycine 0 N--CA 1.499 2.889 0 N-CA-C 108.67 -1.772 . . . . 0.0 108.67 178.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 1.7 t -65.17 -26.13 68.03 Favored 'General case' 0 N--CA 1.535 3.813 0 CA-C-N 117.95 0.875 . . . . 0.0 111.363 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 45.7 mtt180 -62.2 -52.99 61.56 Favored 'General case' 1 N--CA 1.543 4.195 0 N-CA-C 107.063 -1.458 . . . . 0.0 107.063 176.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 555' ' ' VAL . . . . . 0.488 HG21 ' HB2' ' A' ' 22' ' ' PHE . 18.0 t -71.96 -14.91 17.78 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.547 0 CA-C-O 118.15 -0.929 . . . . 0.0 110.553 178.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 76.1 mtt-85 -77.56 -46.76 21.29 Favored 'General case' 0 N--CA 1.527 3.382 0 CA-C-N 119.88 1.218 . . . . 0.0 110.725 178.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 557' ' ' ILE . . . . . 0.561 ' O ' HD13 ' B' ' 561' ' ' LEU . 0.0 OUTLIER -72.15 -23.98 22.1 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.669 0 CA-C-N 119.622 1.101 . . . . 0.0 110.524 -177.712 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 558' ' ' VAL . . . . . 0.469 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -87.1 -53.21 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.871 0 CA-C-N 119.943 1.247 . . . . 0.0 107.698 179.941 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -58.56 -24.64 61.21 Favored 'General case' 0 N--CA 1.533 3.675 0 CA-C-O 118.516 -0.754 . . . . 0.0 110.969 178.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -91.25 -27.34 18.51 Favored 'General case' 0 N--CA 1.525 3.282 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.385 178.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 561' ' ' LEU . . . . . 0.561 HD13 ' O ' ' B' ' 557' ' ' ILE . 1.9 mp -69.57 -43.93 71.87 Favored 'General case' 1 N--CA 1.541 4.108 0 CA-C-N 119.409 1.004 . . . . 0.0 109.156 178.775 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 42.7 mt -58.29 -21.62 49.6 Favored 'General case' 0 N--CA 1.537 3.897 0 C-N-CA 123.762 0.825 . . . . 0.0 112.226 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 12.3 mmm180 -80.23 -47.94 13.85 Favored 'General case' 0 N--CA 1.53 3.567 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 67.08 38.57 92.53 Favored Glycine 1 N--CA 1.525 4.613 0 CA-C-O 118.783 -1.009 . . . . 0.0 113.647 177.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -97.76 -57.36 2.25 Favored 'General case' 0 N--CA 1.517 2.908 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 178.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 16.3 ptt? -170.52 79.52 0.09 Allowed 'General case' 0 N--CA 1.536 3.839 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 178.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 75.7 m -137.4 3.67 2.59 Favored 'General case' 0 N--CA 1.516 2.826 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -176.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -88.88 -76.51 0.4 Allowed 'General case' 0 N--CA 1.524 3.247 0 CA-C-N 119.981 1.264 . . . . 0.0 111.583 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.97 -33.85 17.08 Favored 'General case' 0 N--CA 1.532 3.675 0 CA-C-N 118.995 0.816 . . . . 0.0 112.879 -177.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -83.49 -3.5 57.67 Favored 'General case' 0 N--CA 1.522 3.138 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -178.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 571' ' ' LEU . . . . . 0.684 HD23 HD11 ' B' ' 582' ' ' ILE . 24.2 tp -82.5 -45.47 14.66 Favored 'General case' 0 N--CA 1.53 3.532 0 CA-C-N 119.744 1.156 . . . . 0.0 111.507 -178.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -41.43 -32.4 0.32 Allowed 'General case' 1 N--CA 1.55 4.536 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -177.796 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -73.51 -40.34 64.14 Favored 'General case' 0 N--CA 1.532 3.647 0 CA-C-N 118.454 0.57 . . . . 0.0 111.393 -177.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -51.69 -61.56 2.18 Favored 'General case' 0 N--CA 1.53 3.53 0 C-N-CA 123.989 0.916 . . . . 0.0 113.191 -178.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -114.77 -50.98 2.76 Favored 'General case' 0 N--CA 1.536 3.827 0 CA-C-N 118.718 0.69 . . . . 0.0 110.934 -179.098 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 130.91 80.3 0.21 Allowed Glycine 1 N--CA 1.518 4.154 0 N-CA-C 109.988 -1.245 . . . . 0.0 109.988 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -136.6 99.77 4.16 Favored 'General case' 0 N--CA 1.52 3.041 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 178.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -41.32 168.24 0.01 OUTLIER Glycine 1 N--CA 1.541 5.653 0 C-N-CA 124.952 1.263 . . . . 0.0 115.319 -176.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 579' ' ' ILE . . . . . 0.636 HD13 ' CG2' ' B' ' 582' ' ' ILE . 0.6 OUTLIER -80.51 -22.37 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.108 0 CA-C-N 118.273 1.036 . . . . 0.0 108.453 178.625 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 580' ' ' ALA . . . . . 0.833 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -67.08 -39.86 86.87 Favored 'General case' 0 N--CA 1.53 3.561 0 CA-C-N 119.619 1.099 . . . . 0.0 110.139 177.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.33 -39.14 33.51 Favored 'General case' 1 N--CA 1.544 4.248 0 CA-C-N 118.759 0.709 . . . . 0.0 112.027 -179.832 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 582' ' ' ILE . . . . . 0.684 HD11 HD23 ' B' ' 571' ' ' LEU . 2.0 tt -65.53 -36.99 78.95 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.502 0 C-N-CA 123.502 0.721 . . . . 0.0 111.597 -176.2 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 69.9 p -96.92 -31.75 12.4 Favored 'General case' 0 N--CA 1.512 2.672 0 CA-C-O 118.175 -0.917 . . . . 0.0 111.132 -178.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 20.9 ptt180 -70.17 -21.39 63.06 Favored 'General case' 0 N--CA 1.535 3.789 0 CA-C-N 119.613 1.097 . . . . 0.0 109.424 175.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -68.1 -35.36 83.41 Favored Glycine 1 N--CA 1.519 4.21 0 N-CA-C 108.046 -2.022 . . . . 0.0 108.046 174.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 5.5 t -61.77 -41.27 97.48 Favored 'General case' 1 N--CA 1.54 4.028 0 CA-C-N 117.701 0.75 . . . . 0.0 110.226 177.094 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -59.65 -23.2 62.84 Favored 'General case' 1 N--CA 1.541 4.099 0 C-N-CA 123.528 0.731 . . . . 0.0 112.157 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 75.3 m -62.12 -46.68 87.96 Favored 'General case' 0 N--CA 1.535 3.797 0 C-N-CA 123.535 0.734 . . . . 0.0 110.828 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 52.3 mt -59.96 -49.41 77.77 Favored 'General case' 0 N--CA 1.524 3.256 0 C-N-CA 124.206 1.002 . . . . 0.0 111.505 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -54.63 -26.31 32.18 Favored 'General case' 1 N--CA 1.547 4.397 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -178.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -86.76 -43.44 12.54 Favored 'General case' 0 N--CA 1.515 2.823 0 CA-C-N 118.395 0.543 . . . . 0.0 110.328 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -57.72 161.8 5.86 Favored Pre-proline 1 N--CA 1.54 4.066 0 CA-C-O 118.247 -0.882 . . . . 0.0 112.545 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -80.08 162.38 23.23 Favored 'Trans proline' 0 C--N 1.378 2.13 0 C-N-CA 121.918 1.745 . . . . 0.0 110.779 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -83.72 -25.87 7.6 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.894 0 CA-C-O 117.471 -1.252 . . . . 0.0 112.077 -178.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -63.6 -41.2 98.35 Favored 'General case' 0 N--CA 1.519 2.993 0 CA-C-N 120.428 1.467 . . . . 0.0 110.398 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 596' ' ' LEU . . . . . 0.483 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.8 mp -98.83 -14.82 19.49 Favored 'General case' 0 N--CA 1.514 2.745 0 C-N-CA 123.557 0.743 . . . . 0.0 111.636 178.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -32.42 74.06 Favored 'General case' 1 N--CA 1.542 4.171 0 N-CA-C 102.807 -3.034 . . . . 0.0 102.807 166.8 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -57.12 -36.34 70.54 Favored 'General case' 0 N--CA 1.517 2.875 0 C-N-CA 124.885 1.274 . . . . 0.0 110.796 175.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 599' ' ' TRP . . . . . 0.601 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 44.2 t90 -61.13 -36.12 78.9 Favored 'General case' 0 N--CA 1.536 3.872 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 177.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 10.3 mp -56.58 -38.94 72.67 Favored 'General case' 1 N--CA 1.544 4.255 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 176.537 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -68.39 -29.88 68.68 Favored 'General case' 0 N--CA 1.537 3.885 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 175.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 602' ' ' GLU . . . . . 0.419 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.6 OUTLIER -69.14 -26.63 64.98 Favored 'General case' 1 N--CA 1.542 4.142 0 C-N-CA 124.411 1.084 . . . . 0.0 110.595 176.622 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' B' B ' 603' ' ' VAL . . . . . 0.546 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.0 OUTLIER -103.87 -14.33 8.56 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.639 0 CA-C-O 117.85 -1.071 . . . . 0.0 112.262 -175.962 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 7.0 mp -92.13 -57.53 2.68 Favored 'General case' 0 N--CA 1.522 3.156 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 173.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 6.1 mp -93.31 -99.85 0.14 Allowed 'General case' 0 N--CA 1.521 3.105 0 CA-C-O 117.693 -1.146 . . . . 0.0 108.159 177.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt 178.17 -50.39 0.01 OUTLIER 'General case' 1 N--CA 1.544 4.229 0 CA-C-N 120.487 1.494 . . . . 0.0 109.588 178.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 68.4 m . . . . . 0 N--CA 1.527 3.393 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.065 -179.472 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 898' ' ' TRP . . . . . 0.577 ' HB2' HG23 ' B' ' 544' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.135 0 CA-C-O 117.879 -1.058 . . . . 0.0 109.356 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.509 2.478 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.424 -9.396 4 C4'-C3'-C2' 116.749 13.549 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.42 -9.834 3 O4'-C1'-N19 120.098 15.372 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.425 -9.284 4 O4'-C1'-N19 119.103 14.128 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . 0.512 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 5 C3'--C2' 1.421 -9.718 4 O4'-C1'-N19 120.381 15.726 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' E' E ' 5' ' ' ' DC' . . . . . 0.468 ' H41' ' HA ' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.411 -10.687 5 O4'-C1'-N19 118.823 13.779 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.401 -11.733 5 O4'-C1'-N19 119.234 14.293 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' E' E ' 7' ' ' ' DA' . . . . . 0.535 H2'' " H5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.396 -12.219 3 C4'-C3'-C2' 112.975 9.775 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' E' E ' 8' ' ' ' DG' . . . . . 0.535 " H5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 O3'--C3' 1.563 10.149 3 O4'-C1'-N19 119.407 14.508 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.407 -11.137 4 O4'-C1'-N19 118.228 13.035 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.471 3 C4'-C3'-C2' 116.811 13.611 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.412 -10.616 4 O4'-C1'-N19 118.86 13.825 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.407 -11.149 5 O4'-C1'-N19 119.47 14.587 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' E' E ' 13' ' ' ' DC' . . . . . 0.512 H2'' " O5'" ' E' ' 14' ' ' ' DT' . . . . . . . . 6 O3'--C3' 1.55 9.173 3 O4'-C1'-N19 119.869 15.087 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' E' E ' 14' ' ' ' DT' . . . . . 0.661 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.405 -11.256 6 O4'-C1'-N19 119.866 15.082 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' E' E ' 15' ' ' ' DA' . . . . . 0.811 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.413 -10.495 4 O4'-C1'-N19 120.223 15.529 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' E' E ' 16' ' ' ' DG' . . . . . 0.413 ' O6 ' HG22 ' A' ' 79' ' ' ILE . . . . . . . . 5 C3'--C2' 1.416 -10.168 4 O4'-C1'-N19 120.087 15.359 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.566 10.369 4 O4'-C1'-N19 120.291 15.614 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.567 5 O4'-C1'-N19 120.299 15.624 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.496 5 O4'-C1'-N19 120.593 15.992 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.51 6.903 4 O4'-C1'-N19 119.186 14.232 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.565 10.308 2 O4'-C1'-N19 119.716 14.895 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.573 10.958 5 O4'-C1'-N19 119.363 14.453 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.275 5 O4'-C1'-N19 120.39 15.737 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' F' F ' 4' ' ' ' DA' . . . . . 0.613 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.416 -10.216 5 O4'-C1'-N19 119.779 14.974 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' F' F ' 5' ' ' ' DC' . . . . . 0.547 ' H41' ' HA ' ' A' ' 80' ' ' ALA . . . . . . . . 5 O3'--C3' 1.573 10.923 4 O4'-C1'-N19 118.451 13.313 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.407 -11.062 4 O4'-C1'-N19 119.253 14.316 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.412 -11.613 4 N19-C1'-C2' 129.516 9.572 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.392 4 O4'-C1'-N19 119.46 14.575 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -10.956 4 O4'-C1'-N19 120.477 15.847 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.406 -11.249 4 O4'-C1'-N19 119.042 14.053 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.176 4 O4'-C1'-N19 119.873 15.092 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.42 -9.835 2 O4'-C1'-N19 119.506 14.633 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.204 4 O4'-C1'-N19 119.283 14.353 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' F' F ' 14' ' ' ' DT' . . . . . 0.614 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 O3'--C3' 1.566 10.413 3 O4'-C1'-N19 119.201 14.251 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' F' F ' 15' ' ' ' DA' . . . . . 0.848 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.415 -10.265 6 O4'-C1'-N19 119.294 14.368 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.415 -10.273 6 O4'-C1'-N19 120.203 15.504 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.949 4 O4'-C1'-N19 118.983 13.979 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.563 4 O4'-C1'-N19 119.92 15.15 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.746 4 O4'-C1'-N19 119.97 15.213 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 O4'--C1' 1.514 7.199 4 O4'-C1'-N19 119.046 14.058 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 . . . . . 0 N--CA 1.5 2.074 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 58.0 m -105.49 112.36 64.76 Favored Pre-proline 0 N--CA 1.515 2.786 0 CA-C-O 117.862 -1.066 . . . . 0.0 108.813 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -66.73 -35.45 28.09 Favored 'Trans proline' 0 C--N 1.391 2.807 0 C-N-CA 122.17 1.913 . . . . 0.0 111.373 178.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -104.81 133.41 49.67 Favored 'General case' 0 N--CA 1.526 3.364 0 C-N-CA 123.575 0.75 . . . . 0.0 109.994 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 37.4 p -134.79 -52.76 0.8 Allowed 'General case' 0 N--CA 1.527 3.404 0 C-N-CA 123.363 0.665 . . . . 0.0 109.3 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -132.28 155.93 47.45 Favored 'General case' 0 N--CA 1.524 3.271 0 C-N-CA 123.308 0.643 . . . . 0.0 111.074 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.25 134.75 42.66 Favored 'General case' 0 N--CA 1.532 3.653 0 C-N-CA 122.732 0.413 . . . . 0.0 110.764 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 25.9 ttm -115.18 133.92 55.61 Favored 'General case' 0 N--CA 1.525 3.319 0 C-N-CA 123.074 0.55 . . . . 0.0 110.592 -179.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 59.94 158.39 0.03 OUTLIER 'General case' 1 N--CA 1.539 4.016 0 C-N-CA 124.553 1.141 . . . . 0.0 113.356 178.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -115.01 138.56 50.72 Favored 'General case' 0 N--CA 1.524 3.247 0 C-N-CA 123.476 0.71 . . . . 0.0 109.858 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -91.81 115.45 28.07 Favored 'General case' 0 N--CA 1.52 3.04 0 N-CA-C 107.52 -1.289 . . . . 0.0 107.52 178.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 78.1 mtm180 -106.75 125.52 51.11 Favored 'General case' 0 N--CA 1.521 3.106 0 C-N-CA 122.8 0.44 . . . . 0.0 109.86 -178.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 23.1 m-70 -115.35 98.2 6.61 Favored 'General case' 0 N--CA 1.52 3.029 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 179.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -112.62 -38.91 4.47 Favored 'General case' 0 N--CA 1.522 3.171 0 CA-C-O 118.699 -0.667 . . . . 0.0 112.174 -176.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -124.37 -88.21 0.61 Allowed 'General case' 0 N--CA 1.527 3.408 0 CA-C-N 118.496 0.589 . . . . 0.0 112.289 -176.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.535 ' CZ3' HD22 ' B' ' 551' ' ' LEU . 73.0 t-105 -51.18 -43.97 61.43 Favored 'General case' 1 N--CA 1.54 4.074 0 CA-C-N 119.193 0.906 . . . . 0.0 111.215 -178.548 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.473 HD22 ' N ' ' A' ' 20' ' ' LEU . 3.0 mm? -83.77 -23.29 31.58 Favored 'General case' 0 N--CA 1.517 2.893 0 CA-C-O 117.542 -1.218 . . . . 0.0 111.695 -176.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -58.4 -28.74 65.49 Favored 'General case' 0 N--CA 1.536 3.868 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 173.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.583 ' CG ' HD21 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -85.5 -36.14 20.73 Favored 'General case' 0 N--CA 1.504 2.232 0 CA-C-O 115.766 -2.064 . . . . 0.0 109.347 174.068 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 48.6 t -71.24 -27.47 29.42 Favored 'Isoleucine or valine' 1 N--CA 1.576 5.833 0 CA-C-N 121.762 2.074 . . . . 0.0 112.754 -175.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -77.39 -50.1 13.48 Favored 'General case' 0 N--CA 1.533 3.718 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 179.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.416 HD11 ' HB ' ' B' ' 603' ' ' VAL . 0.6 OUTLIER -62.65 -25.45 68.13 Favored 'General case' 0 N--CA 1.539 3.996 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 174.996 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.428 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -70.06 -38.66 75.84 Favored 'General case' 0 N--CA 1.517 2.885 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 178.093 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.1 tttt -64.36 -22.57 67.0 Favored 'General case' 0 N--CA 1.527 3.388 0 CA-C-O 118.452 -0.785 . . . . 0.0 111.049 177.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -72.27 -39.66 68.19 Favored 'General case' 0 N--CA 1.53 3.564 0 CA-C-N 119.003 0.82 . . . . 0.0 108.868 176.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.633 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -91.05 -6.33 54.02 Favored 'General case' 0 N--CA 1.506 2.332 0 CA-C-O 118.573 -0.727 . . . . 0.0 110.793 177.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.04 -33.86 26.38 Favored 'General case' 0 N--CA 1.533 3.69 0 CA-C-N 120.41 1.459 . . . . 0.0 109.005 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -65.11 -42.66 93.77 Favored 'General case' 0 N--CA 1.531 3.604 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 176.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 63.3 m-80 -86.87 -89.35 0.12 Allowed 'General case' 0 N--CA 1.516 2.864 0 N-CA-C 106.563 -1.643 . . . . 0.0 106.563 176.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 150.54 52.47 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.909 0 C-N-CA 128.013 2.525 . . . . 0.0 107.959 177.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.467 HD22 ' CD2' ' B' ' 596' ' ' LEU . 6.9 mt -114.62 11.88 17.07 Favored 'General case' 0 N--CA 1.527 3.384 0 C-N-CA 124.698 1.199 . . . . 0.0 110.245 -178.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.52 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 46.8 p-80 -80.61 0.85 32.28 Favored 'General case' 0 N--CA 1.51 2.556 0 C-N-CA 123.505 0.722 . . . . 0.0 109.225 175.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.765 ' HA ' HD23 ' A' ' 39' ' ' LEU . 22.4 mt -93.06 -50.82 0.27 Allowed Pre-proline 0 N--CA 1.511 2.592 0 CA-C-O 116.971 -1.49 . . . . 0.0 109.207 -175.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.456 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 7.6 Cg_exo -61.34 -35.16 85.46 Favored 'Trans proline' 0 C--N 1.396 3.068 0 N-CA-C 106.425 -2.183 . . . . 0.0 106.425 170.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.432 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 2.1 tm? -64.76 -39.21 93.24 Favored 'General case' 0 N--CA 1.512 2.645 0 C-N-CA 124.057 0.943 . . . . 0.0 109.974 176.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.765 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -72.08 -22.53 61.35 Favored 'General case' 1 N--CA 1.546 4.372 0 CA-C-N 119.533 1.06 . . . . 0.0 111.791 -179.862 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -96.31 21.82 8.56 Favored 'General case' 1 N--CA 1.539 4.003 0 CA-C-N 119.926 1.239 . . . . 0.0 110.049 176.454 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.614 HD13 ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -127.08 -45.63 1.55 Allowed 'General case' 0 N--CA 1.519 2.993 0 CA-C-O 118.056 -0.973 . . . . 0.0 109.361 179.763 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.614 ' N ' HD13 ' A' ' 41' ' ' LEU . 9.9 ptt? -116.86 11.01 14.32 Favored 'General case' 1 N--CA 1.551 4.618 0 CA-C-N 119.711 1.142 . . . . 0.0 112.32 179.521 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.7 mp -122.86 -94.05 0.5 Allowed 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 177.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 157.31 169.28 0.02 OUTLIER Pre-proline 1 N--CA 1.566 5.358 0 C-N-CA 125.476 1.511 . . . . 0.0 110.041 178.894 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -69.0 -37.73 10.56 Favored 'Trans proline' 0 C--N 1.39 2.735 0 C-N-CA 122.066 1.844 . . . . 0.0 107.586 172.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -66.19 -18.57 65.43 Favored 'General case' 0 N--CA 1.527 3.395 0 CA-C-O 117.942 -1.027 . . . . 0.0 110.895 176.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -71.09 -37.57 72.41 Favored 'General case' 0 N--CA 1.529 3.478 0 CA-C-N 119.613 1.097 . . . . 0.0 108.613 178.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -84.91 -15.89 42.96 Favored 'General case' 0 N--CA 1.531 3.582 0 CA-C-O 118.117 -0.944 . . . . 0.0 109.826 175.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -73.07 -29.43 62.95 Favored 'General case' 0 N--CA 1.525 3.291 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 173.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.561 ' HB1' ' NH1' ' A' ' 54' ' ' ARG . . . -88.01 -36.28 17.1 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-O 117.918 -1.039 . . . . 0.0 109.725 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.46 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 23.1 tp -69.75 -22.8 63.33 Favored 'General case' 0 N--CA 1.537 3.879 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 173.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.439 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -67.47 -73.36 0.67 Allowed Glycine 0 N--CA 1.496 2.7 0 C-N-CA 125.294 1.426 . . . . 0.0 111.277 177.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.9 m -72.06 -24.56 61.54 Favored 'General case' 0 N--CA 1.536 3.86 0 CA-C-O 118.144 -0.932 . . . . 0.0 112.785 -177.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.561 ' NH1' ' HB1' ' A' ' 50' ' ' ALA . 76.9 mtm-85 -68.15 -50.27 55.63 Favored 'General case' 0 N--CA 1.531 3.593 0 CA-C-N 120.074 1.306 . . . . 0.0 107.628 177.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 51' ' ' LEU . 11.5 t -65.98 -17.9 23.06 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.823 0 CA-C-O 118.217 -0.897 . . . . 0.0 109.88 177.022 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.7 mtt-85 -69.08 -56.92 6.24 Favored 'General case' 0 N--CA 1.529 3.515 0 CA-C-N 119.741 1.155 . . . . 0.0 111.444 177.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.421 HG22 HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -68.9 -25.63 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.757 0 CA-C-N 119.825 1.193 . . . . 0.0 112.087 -177.076 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -83.71 -53.54 11.02 Favored 'Isoleucine or valine' 1 N--CA 1.549 4.517 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 -179.653 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -61.6 -18.73 60.58 Favored 'General case' 0 N--CA 1.527 3.392 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.063 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -96.56 -23.26 16.61 Favored 'General case' 0 N--CA 1.526 3.344 0 CA-C-O 118.174 -0.917 . . . . 0.0 110.305 176.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.6 mt -75.76 -51.74 11.99 Favored 'General case' 0 N--CA 1.534 3.758 0 CA-C-N 119.535 1.062 . . . . 0.0 108.979 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 36.1 mt -54.32 -26.4 29.4 Favored 'General case' 0 N--CA 1.538 3.953 0 C-N-CA 124.163 0.985 . . . . 0.0 113.293 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 30.1 mmm180 -77.86 -45.68 23.58 Favored 'General case' 0 N--CA 1.531 3.584 0 CA-C-N 118.755 0.707 . . . . 0.0 111.278 -178.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.15 56.51 2.41 Favored Glycine 0 N--CA 1.515 3.96 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -98.71 -40.27 8.24 Favored 'General case' 0 N--CA 1.526 3.364 0 CA-C-O 118.713 -0.66 . . . . 0.0 110.074 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 76.8 mtp 121.18 69.0 0.0 OUTLIER 'General case' 1 N--CA 1.544 4.264 0 C-N-CA 128.075 2.55 . . . . 0.0 104.997 -178.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.419 ' HB3' HD22 ' A' ' 71' ' ' LEU . 23.4 m -117.8 38.48 3.62 Favored 'General case' 0 N--CA 1.52 3.03 0 CA-C-N 115.109 -0.951 . . . . 0.0 110.771 -177.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -113.16 -46.38 3.09 Favored 'General case' 0 N--CA 1.521 3.107 0 C-N-CA 123.751 0.82 . . . . 0.0 110.194 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -104.49 -56.59 2.16 Favored 'General case' 0 N--CA 1.528 3.429 0 C-N-CA 123.547 0.739 . . . . 0.0 110.968 -178.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -75.28 -0.18 18.73 Favored 'General case' 0 N--CA 1.519 2.983 0 N-CA-C 114.063 1.135 . . . . 0.0 114.063 -176.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.582 HD23 HG21 ' A' ' 82' ' ' ILE . 24.6 tp -85.35 -47.06 10.38 Favored 'General case' 0 N--CA 1.527 3.392 0 CA-C-N 119.906 1.23 . . . . 0.0 112.458 -178.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -42.65 -30.58 0.38 Allowed 'General case' 1 N--CA 1.552 4.635 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 -176.739 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -71.86 -41.13 68.44 Favored 'General case' 0 N--CA 1.535 3.793 0 CA-C-N 118.829 0.74 . . . . 0.0 111.234 -178.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -47.57 -53.35 14.83 Favored 'General case' 0 N--CA 1.533 3.702 0 C-N-CA 125.078 1.351 . . . . 0.0 113.438 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.1 pp -125.06 -39.67 2.22 Favored 'General case' 0 N--CA 1.536 3.85 0 CA-C-O 118.717 -0.659 . . . . 0.0 111.938 -178.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 112.72 64.78 0.47 Allowed Glycine 1 N--CA 1.523 4.487 0 CA-C-N 118.976 0.807 . . . . 0.0 111.621 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -127.48 108.95 11.26 Favored 'General case' 0 N--CA 1.523 3.211 0 N-CA-C 106.047 -1.835 . . . . 0.0 106.047 176.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -34.65 165.37 0.01 OUTLIER Glycine 1 N--CA 1.536 5.356 0 C-N-CA 125.863 1.696 . . . . 0.0 116.658 -176.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.613 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.3 OUTLIER -78.64 -23.67 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.903 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 177.89 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.811 ' HB2' ' H62' ' E' ' 15' ' ' ' DA' . . . -61.85 -34.37 75.85 Favored 'General case' 0 N--CA 1.521 3.076 0 CA-C-O 117.689 -1.148 . . . . 0.0 109.835 177.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 17.8 p -74.89 -56.62 4.57 Favored 'General case' 0 N--CA 1.53 3.568 0 CA-C-N 119.342 0.974 . . . . 0.0 111.965 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.582 HG21 HD23 ' A' ' 71' ' ' LEU . 0.5 OUTLIER -62.06 -24.54 34.88 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.173 0 CA-C-O 118.174 -0.917 . . . . 0.0 113.469 -176.829 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 71.9 p -101.07 -26.27 13.76 Favored 'General case' 0 N--CA 1.51 2.567 0 CA-C-O 117.955 -1.021 . . . . 0.0 110.913 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 26.2 ptt180 -75.77 -22.83 56.07 Favored 'General case' 0 N--CA 1.535 3.806 0 CA-C-N 119.82 1.191 . . . . 0.0 108.545 174.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -68.15 -32.22 76.09 Favored Glycine 0 N--CA 1.516 3.979 0 N-CA-C 109.043 -1.623 . . . . 0.0 109.043 175.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 6.6 t -63.68 -31.5 72.69 Favored 'General case' 0 N--CA 1.536 3.869 0 CA-C-N 118.18 0.99 . . . . 0.0 110.117 177.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -59.65 -33.41 71.5 Favored 'General case' 1 N--CA 1.545 4.291 0 C-N-CA 123.604 0.762 . . . . 0.0 110.311 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.15 -31.98 73.44 Favored 'General case' 0 N--CA 1.538 3.932 0 C-N-CA 123.791 0.837 . . . . 0.0 111.3 179.564 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 38.8 mt -57.26 -44.21 83.7 Favored 'General case' 0 N--CA 1.531 3.619 0 C-N-CA 123.759 0.824 . . . . 0.0 111.232 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -65.99 -20.29 66.14 Favored 'General case' 0 N--CA 1.537 3.921 0 CA-C-O 118.193 -0.908 . . . . 0.0 112.901 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.57 -32.06 18.32 Favored 'General case' 0 N--CA 1.523 3.183 0 CA-C-N 119.323 0.965 . . . . 0.0 113.133 -178.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.87 153.23 88.84 Favored Pre-proline 1 N--CA 1.54 4.07 0 CA-C-O 118.087 -0.959 . . . . 0.0 113.527 -178.218 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -87.41 171.59 6.29 Favored 'Trans proline' 0 C--N 1.387 2.576 0 C-N-CA 122.695 2.263 . . . . 0.0 111.084 177.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.4 t -87.76 -27.22 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.306 0 CA-C-O 117.803 -1.094 . . . . 0.0 111.216 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -62.14 -41.4 98.23 Favored 'General case' 0 N--CA 1.518 2.942 0 CA-C-N 120.187 1.358 . . . . 0.0 109.598 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.508 ' CD2' HD22 ' B' ' 534' ' ' LEU . 6.8 mp -98.84 -9.96 23.59 Favored 'General case' 0 N--CA 1.507 2.417 0 C-N-CA 123.569 0.748 . . . . 0.0 111.666 178.357 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -35.99 82.75 Favored 'General case' 1 N--CA 1.545 4.298 0 N-CA-C 102.528 -3.138 . . . . 0.0 102.528 166.894 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -52.6 -35.25 53.95 Favored 'General case' 0 N--CA 1.52 3.036 0 C-N-CA 124.316 1.047 . . . . 0.0 111.499 175.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.614 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 43.1 t90 -67.68 -39.26 84.49 Favored 'General case' 0 N--CA 1.53 3.563 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 177.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.403 ' O ' HD13 ' A' ' 104' ' ' LEU . 10.4 mp -55.61 -30.13 60.35 Favored 'General case' 0 N--CA 1.536 3.853 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 176.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -74.3 -37.79 63.55 Favored 'General case' 0 N--CA 1.532 3.652 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 175.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.59 -21.4 65.59 Favored 'General case' 0 N--CA 1.535 3.797 0 CA-C-O 118.325 -0.845 . . . . 0.0 111.581 177.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.5 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -119.73 -8.14 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.838 0 CA-C-O 117.884 -1.055 . . . . 0.0 113.247 -176.131 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.403 HD13 ' O ' ' A' ' 100' ' ' LEU . 8.2 mp -105.68 -51.31 3.02 Favored 'General case' 0 N--CA 1.531 3.602 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 176.192 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.0 tt -65.02 -47.62 76.79 Favored 'General case' 0 N--CA 1.536 3.855 0 C-N-CA 124.141 0.976 . . . . 0.0 110.381 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 37.8 tttm -67.2 -49.31 65.07 Favored 'General case' 0 N--CA 1.533 3.686 0 C-N-CA 122.997 0.519 . . . . 0.0 111.551 -178.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 7.0 t . . . . . 0 N--CA 1.526 3.353 0 CA-C-O 118.09 -0.957 . . . . 0.0 110.035 -179.432 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 . . . . . 0 N--CA 1.511 2.579 0 CA-C-O 118.523 -0.751 . . . . 0.0 111.801 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 73.7 m -69.73 135.39 88.0 Favored Pre-proline 0 N--CA 1.532 3.65 0 CA-C-O 117.51 -1.233 . . . . 0.0 110.468 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -75.09 -41.53 0.63 Allowed 'Trans proline' 0 C--N 1.384 2.43 0 C-N-CA 122.822 2.348 . . . . 0.0 112.211 -178.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 84.74 -67.59 0.04 OUTLIER 'General case' 0 N--CA 1.538 3.934 0 C-N-CA 125.976 1.71 . . . . 0.0 107.651 -176.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 50.8 m 63.32 140.99 0.02 OUTLIER 'General case' 0 N--CA 1.535 3.784 0 C-N-CA 124.806 1.242 . . . . 0.0 112.034 178.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -120.87 -51.54 2.13 Favored 'General case' 0 N--CA 1.521 3.123 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -146.72 -51.45 0.21 Allowed 'General case' 0 N--CA 1.52 3.063 0 C-N-CA 122.954 0.502 . . . . 0.0 110.082 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 21.6 mtp -95.02 120.96 36.12 Favored 'General case' 0 N--CA 1.52 3.033 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -137.28 -52.49 0.67 Allowed 'General case' 0 N--CA 1.521 3.091 0 C-N-CA 123.156 0.582 . . . . 0.0 109.547 -179.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -100.04 -56.56 2.34 Favored 'General case' 0 N--CA 1.52 3.039 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -168.24 -88.78 0.01 OUTLIER 'General case' 0 N--CA 1.536 3.84 0 CA-C-O 118.461 -0.781 . . . . 0.0 111.076 179.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 16.8 tpp180 65.59 116.59 0.03 OUTLIER 'General case' 0 N--CA 1.536 3.846 0 CA-C-N 119.714 1.143 . . . . 0.0 109.487 -178.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -102.79 134.89 45.44 Favored 'General case' 0 N--CA 1.527 3.4 0 C-N-CA 123.225 0.61 . . . . 0.0 110.704 -178.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -112.46 134.87 53.76 Favored 'General case' 0 N--CA 1.529 3.498 0 C-N-CA 123.36 0.664 . . . . 0.0 109.94 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -127.37 -66.03 0.91 Allowed 'General case' 0 N--CA 1.524 3.259 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 519' ' ' TRP . . . . . 0.66 ' CE2' HD22 ' A' ' 39' ' ' LEU . 71.0 t-105 -42.81 -28.33 0.24 Allowed 'General case' 1 N--CA 1.552 4.639 0 C-N-CA 124.388 1.075 . . . . 0.0 113.685 -179.694 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 520' ' ' LEU . . . . . 0.573 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.2 mm? -96.09 -29.92 13.83 Favored 'General case' 0 N--CA 1.527 3.392 0 CA-C-O 117.895 -1.05 . . . . 0.0 113.449 -172.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 23.3 mtp180 -62.23 -26.17 68.23 Favored 'General case' 1 N--CA 1.54 4.055 0 N-CA-C 105.485 -2.043 . . . . 0.0 105.485 171.651 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . 0.521 ' O ' HD23 ' B' ' 526' ' ' LEU . 1.8 m-85 -78.11 -39.77 40.33 Favored 'General case' 0 N--CA 1.515 2.8 0 N-CA-C 107.397 -1.334 . . . . 0.0 107.397 174.253 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 37.1 t -66.55 -23.36 31.29 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.259 0 CA-C-N 119.96 1.254 . . . . 0.0 112.493 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -78.01 -52.01 9.45 Favored 'General case' 0 N--CA 1.532 3.654 0 CA-C-N 120.345 1.429 . . . . 0.0 108.19 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 1.2 tp -68.16 -23.04 64.83 Favored 'General case' 0 N--CA 1.53 3.528 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 176.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 526' ' ' LEU . . . . . 0.521 HD23 ' O ' ' B' ' 522' ' ' PHE . 1.7 mm? -71.23 -36.16 71.72 Favored 'General case' 0 N--CA 1.522 3.157 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 176.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 527' ' ' LYS . . . . . 0.462 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 27.3 ttmt -66.21 -21.69 66.32 Favored 'General case' 0 N--CA 1.516 2.872 0 CA-C-O 118.383 -0.818 . . . . 0.0 111.003 177.029 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -72.43 -39.41 67.87 Favored 'General case' 0 N--CA 1.53 3.566 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 529' ' ' ALA . . . . . 0.614 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -91.63 -7.83 48.94 Favored 'General case' 0 N--CA 1.506 2.362 0 CA-C-O 118.317 -0.849 . . . . 0.0 110.802 177.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 530' ' ' TYR . . . . . 0.462 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.6 OUTLIER -81.69 -33.06 31.41 Favored 'General case' 0 N--CA 1.531 3.596 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 177.513 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -54.61 -49.31 70.76 Favored 'General case' 0 N--CA 1.536 3.833 0 C-N-CA 124.557 1.143 . . . . 0.0 108.255 176.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -93.38 -85.12 0.28 Allowed 'General case' 0 N--CA 1.515 2.816 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 177.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.9 p30 153.53 45.83 0.0 OUTLIER 'General case' 1 N--CA 1.559 4.989 0 C-N-CA 127.707 2.403 . . . . 0.0 108.44 177.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 534' ' ' LEU . . . . . 0.508 HD22 ' CD2' ' A' ' 96' ' ' LEU . 6.3 mt -103.26 13.31 34.16 Favored 'General case' 0 N--CA 1.518 2.953 0 C-N-CA 124.854 1.262 . . . . 0.0 110.068 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 535' ' ' HIS . . . . . 0.579 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 37.1 p-80 -84.37 4.15 32.63 Favored 'General case' 0 N--CA 1.512 2.657 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 174.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 536' ' ' LEU . . . . . 0.455 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 26.9 mt -94.83 -50.79 0.25 Allowed Pre-proline 0 N--CA 1.502 2.128 0 CA-C-O 116.302 -1.809 . . . . 0.0 108.296 -176.205 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 537' ' ' PRO . . . . . 0.455 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 5.7 Cg_exo -67.18 -32.32 34.04 Favored 'Trans proline' 0 C--N 1.4 3.244 0 C-N-CA 122.109 1.873 . . . . 0.0 107.485 170.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 538' ' ' LEU . . . . . 0.466 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 0.3 OUTLIER -65.86 -40.21 91.47 Favored 'General case' 0 N--CA 1.528 3.448 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 174.812 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 7.7 mt -67.76 -23.14 65.2 Favored 'General case' 1 N--CA 1.54 4.067 0 CA-C-O 118.289 -0.863 . . . . 0.0 109.965 176.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -76.71 -29.03 56.09 Favored 'General case' 0 N--CA 1.523 3.202 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 177.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 541' ' ' LEU . . . . . . . . . . . . . 5.5 tp -70.84 -43.99 67.36 Favored 'General case' 0 N--CA 1.532 3.63 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 177.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -96.96 47.95 1.05 Allowed 'General case' 0 CA--C 1.61 3.251 0 N-CA-C 101.44 -3.541 . . . . 0.0 101.44 171.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -29.34 -91.08 0.0 OUTLIER 'General case' 0 N--CA 1.534 3.766 0 C-N-CA 127.698 2.399 . . . . 0.0 116.246 -171.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 544' ' ' THR . . . . . 0.468 HG23 ' HB2' ' A' ' 898' ' ' TRP . 38.0 p 44.08 85.56 0.16 Allowed Pre-proline 0 N--CA 1.531 3.602 0 C-N-CA 124.988 1.315 . . . . 0.0 112.783 -178.181 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -67.43 -27.89 39.49 Favored 'Trans proline' 0 C--N 1.395 2.994 0 C-N-CA 122.417 2.078 . . . . 0.0 110.032 177.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -58.68 -17.45 22.68 Favored 'General case' 0 N--CA 1.538 3.939 0 CA-C-O 118.491 -0.766 . . . . 0.0 111.169 176.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -66.55 -49.69 65.62 Favored 'General case' 0 N--CA 1.527 3.423 0 CA-C-N 119.25 0.932 . . . . 0.0 108.819 178.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 24.4 ptt-85 -80.55 -11.62 59.63 Favored 'General case' 0 N--CA 1.522 3.165 0 CA-C-O 118.097 -0.954 . . . . 0.0 112.295 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -72.15 -53.58 12.3 Favored 'General case' 0 N--CA 1.534 3.729 0 N-CA-C 106.533 -1.655 . . . . 0.0 106.533 174.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -82.91 -12.33 57.45 Favored 'General case' 0 N--CA 1.508 2.459 0 CA-C-O 117.301 -1.333 . . . . 0.0 111.926 178.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 551' ' ' LEU . . . . . 0.583 HD21 ' CG ' ' A' ' 22' ' ' PHE . 18.8 tp -82.2 -31.6 30.28 Favored 'General case' 0 N--CA 1.528 3.443 0 CA-C-N 121.088 1.767 . . . . 0.0 107.69 175.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -72.3 -53.66 8.69 Favored Glycine 0 N--CA 1.496 2.69 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 178.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 5.3 m -71.03 -28.41 64.37 Favored 'General case' 0 N--CA 1.534 3.741 0 CA-C-O 117.96 -1.019 . . . . 0.0 111.973 -178.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -68.33 -55.24 12.76 Favored 'General case' 1 N--CA 1.543 4.205 0 N-CA-C 106.546 -1.65 . . . . 0.0 106.546 176.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 38.3 t -59.07 -18.61 14.02 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.999 0 CA-C-O 117.937 -1.03 . . . . 0.0 110.428 176.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 5.2 mmm180 -79.81 -44.11 21.18 Favored 'General case' 0 N--CA 1.526 3.356 0 CA-C-O 117.436 -1.269 . . . . 0.0 111.862 178.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 557' ' ' ILE . . . . . 0.456 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -72.72 -20.63 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.569 0 CA-C-N 121.365 1.893 . . . . 0.0 110.715 -179.941 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 558' ' ' VAL . . . . . 0.456 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -88.92 -51.04 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.871 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 -179.584 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -60.0 -23.58 63.77 Favored 'General case' 0 N--CA 1.53 3.569 0 CA-C-O 118.892 -0.575 . . . . 0.0 110.483 177.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -95.93 -23.15 17.0 Favored 'General case' 0 N--CA 1.523 3.191 0 CA-C-O 117.875 -1.059 . . . . 0.0 111.151 178.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 6.1 tp -80.84 -60.04 2.45 Favored 'General case' 0 N--CA 1.529 3.496 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 178.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 38.8 mt -39.11 -37.44 0.39 Allowed 'General case' 1 N--CA 1.549 4.482 0 C-N-CA 126.051 1.74 . . . . 0.0 112.415 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 29.6 mmm180 -83.47 -53.41 5.72 Favored 'General case' 0 N--CA 1.519 3.002 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 79.3 54.02 4.2 Favored Glycine 0 N--CA 1.509 3.537 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 178.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -83.15 -63.02 1.44 Allowed 'General case' 0 N--CA 1.518 2.954 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 178.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 19.0 ttm 176.75 85.29 0.01 OUTLIER 'General case' 1 N--CA 1.539 4.011 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 177.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 58.8 m -141.54 36.24 1.65 Allowed 'General case' 0 N--CA 1.518 2.944 0 C-N-CA 122.706 0.403 . . . . 0.0 111.463 -177.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -100.4 -47.75 4.8 Favored 'General case' 0 N--CA 1.522 3.157 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 177.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 1.9 mmt-85 -107.91 -31.79 7.85 Favored 'General case' 0 N--CA 1.522 3.159 0 C-N-CA 123.787 0.835 . . . . 0.0 112.059 -178.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -92.77 -13.23 29.53 Favored 'General case' 0 N--CA 1.519 2.994 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 -176.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 571' ' ' LEU . . . . . 0.784 HD23 HD11 ' B' ' 582' ' ' ILE . 14.5 tp -75.1 -45.7 39.45 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-N 120.644 1.566 . . . . 0.0 111.348 -177.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.79 -33.49 16.69 Favored 'General case' 1 N--CA 1.547 4.421 0 CA-C-N 119.71 1.141 . . . . 0.0 113.208 -179.913 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -64.97 -36.06 83.19 Favored 'General case' 1 N--CA 1.541 4.082 0 C-N-CA 122.93 0.492 . . . . 0.0 111.566 -178.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -49.2 -57.55 6.54 Favored 'General case' 0 N--CA 1.53 3.546 0 C-N-CA 124.573 1.149 . . . . 0.0 113.141 -178.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -132.96 -38.91 0.97 Allowed 'General case' 0 N--CA 1.534 3.726 0 CA-C-O 118.526 -0.75 . . . . 0.0 111.848 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 130.7 63.67 0.1 OUTLIER Glycine 1 N--CA 1.52 4.271 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 179.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -114.81 98.55 6.91 Favored 'General case' 0 N--CA 1.518 2.934 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -42.16 168.82 0.01 OUTLIER Glycine 1 N--CA 1.541 5.645 0 C-N-CA 125.012 1.292 . . . . 0.0 115.493 -176.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 579' ' ' ILE . . . . . 0.512 HG21 ' N6 ' ' E' ' 4' ' ' ' DA' . 1.9 mt -83.66 -14.19 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.335 0 CA-C-O 117.61 -1.186 . . . . 0.0 109.002 178.341 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 580' ' ' ALA . . . . . 0.848 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -69.86 -36.63 75.67 Favored 'General case' 0 N--CA 1.525 3.313 0 CA-C-N 120.091 1.314 . . . . 0.0 108.973 175.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.1 p -79.49 -36.54 38.51 Favored 'General case' 1 N--CA 1.541 4.109 0 CA-C-N 118.924 0.784 . . . . 0.0 111.825 178.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 582' ' ' ILE . . . . . 0.784 HD11 HD23 ' B' ' 571' ' ' LEU . 0.8 OUTLIER -69.66 -36.54 71.0 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.414 0 C-N-CA 123.379 0.672 . . . . 0.0 111.736 -175.643 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 81.4 p -99.57 -28.1 13.38 Favored 'General case' 0 N--CA 1.515 2.777 0 CA-C-O 117.974 -1.012 . . . . 0.0 111.396 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 11.1 ptt180 -75.94 -19.41 58.79 Favored 'General case' 0 N--CA 1.531 3.579 0 CA-C-N 120.081 1.309 . . . . 0.0 108.217 174.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -62.03 -36.42 92.87 Favored Glycine 1 N--CA 1.517 4.052 0 N-CA-C 108.645 -1.782 . . . . 0.0 108.645 175.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 84.3 p -63.3 -36.84 85.0 Favored 'General case' 0 N--CA 1.537 3.89 0 CA-C-N 117.976 0.888 . . . . 0.0 109.792 176.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -56.75 -32.47 65.62 Favored 'General case' 1 N--CA 1.546 4.361 0 C-N-CA 123.638 0.775 . . . . 0.0 111.535 179.094 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 8.7 m -61.39 -41.11 96.59 Favored 'General case' 1 N--CA 1.542 4.174 0 C-N-CA 123.39 0.676 . . . . 0.0 110.527 179.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 51.4 mt -58.93 -45.32 90.66 Favored 'General case' 0 N--CA 1.525 3.286 0 C-N-CA 123.907 0.883 . . . . 0.0 111.11 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? -62.0 -24.49 67.07 Favored 'General case' 1 N--CA 1.539 4.005 0 CA-C-O 118.549 -0.739 . . . . 0.0 112.038 179.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -78.16 -40.38 38.06 Favored 'General case' 0 N--CA 1.516 2.84 0 CA-C-N 118.729 0.695 . . . . 0.0 110.755 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -65.28 159.24 67.66 Favored Pre-proline 0 N--CA 1.537 3.918 0 CA-C-O 118.535 -0.745 . . . . 0.0 112.673 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -79.42 179.76 6.1 Favored 'Trans proline' 0 C--N 1.381 2.257 0 C-N-CA 122.105 1.87 . . . . 0.0 110.834 178.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.2 t -97.25 -27.03 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.083 0 CA-C-O 117.676 -1.154 . . . . 0.0 111.683 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -63.22 -40.52 97.69 Favored 'General case' 0 N--CA 1.515 2.804 0 CA-C-N 120.045 1.293 . . . . 0.0 110.559 -178.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 596' ' ' LEU . . . . . 0.467 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.9 mp -98.76 -15.84 19.17 Favored 'General case' 0 N--CA 1.51 2.56 0 C-N-CA 123.388 0.675 . . . . 0.0 111.76 178.461 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -29.98 69.44 Favored 'General case' 1 N--CA 1.54 4.058 0 N-CA-C 103.328 -2.841 . . . . 0.0 103.328 168.05 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -54.62 -38.24 66.58 Favored 'General case' 0 N--CA 1.52 3.043 0 C-N-CA 124.099 0.96 . . . . 0.0 110.039 174.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 599' ' ' TRP . . . . . 0.633 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 45.1 t90 -63.46 -38.11 89.88 Favored 'General case' 0 N--CA 1.534 3.729 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 176.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.6 -34.87 52.88 Favored 'General case' 1 N--CA 1.541 4.077 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 177.019 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -71.69 -38.32 70.6 Favored 'General case' 1 N--CA 1.54 4.073 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 175.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -60.11 -23.21 63.67 Favored 'General case' 1 N--CA 1.542 4.137 0 C-N-CA 123.857 0.863 . . . . 0.0 110.815 176.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 603' ' ' VAL . . . . . 0.534 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.1 OUTLIER -115.81 7.11 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.466 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -176.751 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 73.0 mt -118.88 -61.19 1.68 Allowed 'General case' 0 N--CA 1.529 3.519 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.41 -56.33 22.46 Favored 'General case' 0 N--CA 1.538 3.934 0 C-N-CA 124.691 1.197 . . . . 0.0 111.681 -178.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 70.9 tttt -98.78 -40.45 8.13 Favored 'General case' 0 N--CA 1.53 3.563 0 CA-C-O 118.656 -0.688 . . . . 0.0 110.797 -178.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 90.1 p . . . . . 0 N--CA 1.539 3.994 0 C-N-CA 124.943 1.297 . . . . 0.0 113.419 -179.223 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 898' ' ' TRP . . . . . 0.468 ' HB2' HG23 ' B' ' 544' ' ' THR . 10.4 t-105 . . . . . 0 N--CA 1.496 1.854 0 CA-C-O 118.554 -0.736 . . . . 0.0 110.212 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.505 2.311 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.758 5 O4'-C1'-N19 119.404 14.505 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.682 5 O4'-C1'-N19 120.032 15.29 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.618 2 O4'-C1'-N19 119.33 14.412 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . 0.814 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 5 C3'--C2' 1.419 -9.929 5 O4'-C1'-N19 119.488 14.609 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' E' E ' 5' ' ' ' DC' . . . . . 0.41 " H2'" ' H71' ' E' ' 6' ' ' ' DT' . . . . . . . . 5 O3'--C3' 1.568 10.562 4 C4'-C3'-C2' 117.048 13.848 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . 0.41 ' H71' " H2'" ' E' ' 5' ' ' ' DC' . . . . . . . . 6 C3'--C2' 1.401 -11.666 4 O4'-C1'-N19 119.795 14.994 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' E' E ' 7' ' ' ' DA' . . . . . 0.551 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 5 C3'--C2' 1.391 -12.72 5 N19-C1'-C2' 131.975 11.109 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' E' E ' 8' ' ' ' DG' . . . . . 0.551 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 5 C3'--C2' 1.413 -10.531 4 O4'-C1'-N19 118.088 12.86 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.414 -10.383 5 O4'-C1'-N19 120.143 15.429 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.71 6 O4'-C1'-N19 119.222 14.277 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.732 2 O4'-C1'-N19 119.311 14.389 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.626 3 O4'-C1'-N19 119.459 14.574 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.579 11.369 5 O4'-C1'-N19 118.859 13.824 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' E' E ' 14' ' ' ' DT' . . . . . 0.759 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.409 -10.886 5 O4'-C1'-N19 118.699 13.623 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' E' E ' 15' ' ' ' DA' . . . . . 1.036 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 5 C3'--C2' 1.426 -9.181 3 O4'-C1'-N19 119.567 14.709 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.429 4 O4'-C1'-N19 119.672 14.84 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.573 10.9 4 O4'-C1'-N19 119.618 14.772 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.418 4 O4'-C1'-N19 119.741 14.926 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.424 -9.435 3 O4'-C1'-N19 119.727 14.908 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.51 6.947 4 O4'-C1'-N19 119.524 14.655 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.566 10.414 3 C4'-C3'-C2' 116.95 13.75 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -11.035 3 O4'-C1'-N19 119.819 15.023 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.667 5 O4'-C1'-N19 118.776 13.72 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' F' F ' 4' ' ' ' DA' . . . . . 0.55 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.415 -10.35 2 O4'-C1'-N19 119.072 14.09 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' F' F ' 5' ' ' ' DC' . . . . . 0.576 ' H41' ' HA ' ' A' ' 80' ' ' ALA . . . . . . . . 6 O3'--C3' 1.574 10.967 4 O4'-C1'-N19 119.055 14.069 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.399 -11.922 6 O4'-C1'-N19 119.177 14.221 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.418 -9.999 3 C4'-C3'-C2' 113.739 10.539 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.411 -10.74 5 O4'-C1'-N19 119.898 15.123 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.394 5 O4'-C1'-N19 119.309 14.386 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.411 -10.686 3 O4'-C1'-N19 119.506 14.632 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.423 -9.529 4 O4'-C1'-N19 120.047 15.308 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.424 -9.44 4 O4'-C1'-N19 119.523 14.654 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.421 -9.676 4 O4'-C1'-N19 119.379 14.473 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' F' F ' 14' ' ' ' DT' . . . . . 0.642 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.407 -11.11 5 O4'-C1'-N19 118.788 13.735 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' F' F ' 15' ' ' ' DA' . . . . . 0.791 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.425 -9.25 3 O4'-C1'-N19 119.739 14.924 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.416 -10.24 5 O4'-C1'-N19 120.082 15.352 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.208 4 O4'-C1'-N19 119.251 14.314 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.156 4 O4'-C1'-N19 119.989 15.237 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.597 5 O4'-C1'-N19 119.149 14.187 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.508 6.793 3 O4'-C1'-N19 119.685 14.857 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 . . . . . 0 N--CA 1.509 2.483 0 CA-C-O 119.106 -0.473 . . . . 0.0 110.764 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.4 t -90.31 -49.12 0.37 Allowed Pre-proline 0 N--CA 1.53 3.533 0 CA-C-O 116.54 -1.695 . . . . 0.0 112.666 -179.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_endo -65.36 139.87 61.45 Favored 'Trans proline' 0 C--N 1.395 3.014 0 C-N-CA 122.51 2.14 . . . . 0.0 112.503 -178.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -120.71 126.2 49.59 Favored 'General case' 0 N--CA 1.522 3.142 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.8 t -141.51 142.9 33.57 Favored 'General case' 0 N--CA 1.526 3.352 0 C-N-CA 122.942 0.497 . . . . 0.0 110.736 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -138.1 132.53 32.19 Favored 'General case' 0 N--CA 1.516 2.87 0 C-N-CA 122.641 0.377 . . . . 0.0 111.029 -179.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 62.69 134.69 0.01 OUTLIER 'General case' 0 N--CA 1.532 3.636 0 C-N-CA 125.04 1.336 . . . . 0.0 113.17 178.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 16.1 ptt? -160.57 126.24 3.94 Favored 'General case' 0 N--CA 1.531 3.608 0 C-N-CA 123.358 0.663 . . . . 0.0 109.484 178.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -148.85 139.95 23.07 Favored 'General case' 0 N--CA 1.524 3.238 0 C-N-CA 122.385 0.274 . . . . 0.0 111.68 -178.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -146.54 -48.42 0.2 Allowed 'General case' 0 N--CA 1.526 3.329 0 C-N-CA 123.087 0.555 . . . . 0.0 109.986 179.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -129.95 131.19 45.87 Favored 'General case' 0 N--CA 1.521 3.11 0 C-N-CA 123.039 0.535 . . . . 0.0 109.807 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.0 mtp-105 -125.32 -57.71 1.47 Allowed 'General case' 0 N--CA 1.521 3.093 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 71.5 m80 -152.31 129.77 11.4 Favored 'General case' 0 N--CA 1.534 3.751 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -111.46 -79.91 0.58 Allowed 'General case' 0 N--CA 1.526 3.374 0 CA-C-O 118.881 -0.58 . . . . 0.0 110.449 -179.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -146.72 -64.86 0.29 Allowed 'General case' 0 N--CA 1.528 3.452 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 -179.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.5 ' HE1' HD22 ' B' ' 536' ' ' LEU . 29.7 t-105 -46.91 -40.55 14.35 Favored 'General case' 0 N--CA 1.533 3.681 0 C-N-CA 125.081 1.353 . . . . 0.0 110.888 176.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -88.41 -26.6 22.06 Favored 'General case' 0 N--CA 1.531 3.582 0 CA-C-O 118.154 -0.927 . . . . 0.0 111.251 -179.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.2 mtt-85 -56.17 -20.78 19.27 Favored 'General case' 0 N--CA 1.537 3.89 0 CA-C-N 119.618 1.099 . . . . 0.0 108.138 173.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.519 ' CZ ' HD21 ' A' ' 26' ' ' LEU . 57.4 t80 -96.3 -34.42 11.6 Favored 'General case' 0 N--CA 1.509 2.518 0 CA-C-O 116.799 -1.572 . . . . 0.0 109.2 171.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 64.5 t -70.69 -63.26 1.01 Allowed 'Isoleucine or valine' 1 N--CA 1.569 5.515 0 CA-C-N 121.713 2.052 . . . . 0.0 110.81 -177.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -55.6 -39.5 70.82 Favored 'General case' 1 N--CA 1.547 4.383 0 CA-C-N 119.006 0.821 . . . . 0.0 110.537 -179.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.84 -31.79 72.64 Favored 'General case' 1 N--CA 1.543 4.188 0 C-N-CA 123.081 0.552 . . . . 0.0 109.558 177.17 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.519 HD21 ' CZ ' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -65.97 -34.8 78.93 Favored 'General case' 0 N--CA 1.53 3.545 0 CA-C-O 118.747 -0.644 . . . . 0.0 109.741 177.421 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 54.0 tttt -67.83 -24.67 65.3 Favored 'General case' 0 N--CA 1.526 3.334 0 CA-C-O 118.589 -0.719 . . . . 0.0 111.132 177.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -69.61 -43.38 72.86 Favored 'General case' 1 N--CA 1.541 4.083 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 176.396 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.623 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -81.67 -9.6 59.61 Favored 'General case' 0 N--CA 1.501 2.115 0 CA-C-O 118.407 -0.806 . . . . 0.0 110.424 177.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.43 ' CE1' HD12 ' A' ' 26' ' ' LEU . 6.4 m-30 -78.74 -34.72 45.58 Favored 'General case' 0 N--CA 1.525 3.281 0 CA-C-N 120.234 1.379 . . . . 0.0 109.448 179.117 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 -62.42 -41.27 98.58 Favored 'General case' 0 N--CA 1.537 3.903 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -92.31 -86.95 0.23 Allowed 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 106.927 -1.509 . . . . 0.0 106.927 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.8 p30 148.59 51.98 0.0 OUTLIER 'General case' 1 N--CA 1.561 5.124 0 C-N-CA 128.387 2.675 . . . . 0.0 107.24 177.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.415 HD22 ' CD2' ' B' ' 596' ' ' LEU . 5.4 mt -111.14 11.7 21.9 Favored 'General case' 0 N--CA 1.526 3.371 0 C-N-CA 124.649 1.179 . . . . 0.0 110.858 -177.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.542 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 54.6 p-80 -84.09 3.84 32.95 Favored 'General case' 0 N--CA 1.507 2.398 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.765 ' HA ' HD23 ' A' ' 39' ' ' LEU . 20.0 mt -92.16 -50.75 0.29 Allowed Pre-proline 0 N--CA 1.505 2.276 0 CA-C-O 116.868 -1.539 . . . . 0.0 108.348 -176.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.459 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 7.3 Cg_exo -62.49 -36.24 66.72 Favored 'Trans proline' 0 C--N 1.395 2.979 0 N-CA-C 106.438 -2.178 . . . . 0.0 106.438 170.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.4 -44.02 79.89 Favored 'General case' 0 N--CA 1.528 3.428 0 C-N-CA 123.881 0.872 . . . . 0.0 110.439 175.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.765 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -75.68 -28.32 58.63 Favored 'General case' 1 N--CA 1.542 4.126 0 N-CA-C 113.96 1.096 . . . . 0.0 113.96 -176.176 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 30.1 p30 -88.39 6.1 39.02 Favored 'General case' 0 N--CA 1.536 3.853 0 CA-C-N 119.845 1.202 . . . . 0.0 112.36 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.493 ' O ' HD12 ' A' ' 41' ' ' LEU . 0.3 OUTLIER -119.85 -43.74 2.55 Favored 'General case' 0 N--CA 1.519 2.999 0 CA-C-N 118.942 0.792 . . . . 0.0 110.003 -179.511 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -35.76 74.59 Favored 'General case' 0 N--CA 1.534 3.726 0 CA-C-N 119.006 0.821 . . . . 0.0 111.924 -176.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.465 ' O ' HG23 ' A' ' 44' ' ' THR . 3.4 tt -135.3 -77.58 0.44 Allowed 'General case' 0 N--CA 1.504 2.271 0 CA-C-O 118.54 -0.743 . . . . 0.0 110.972 179.033 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.465 HG23 ' O ' ' A' ' 43' ' ' LEU . 6.1 p -167.24 172.91 3.3 Favored Pre-proline 1 N--CA 1.55 4.559 0 C-N-CA 124.012 0.925 . . . . 0.0 111.284 -177.707 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -68.68 -18.69 42.33 Favored 'Trans proline' 0 CA--C 1.588 3.207 0 C-N-CA 121.999 1.799 . . . . 0.0 108.761 172.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -63.09 -15.39 56.51 Favored 'General case' 0 N--CA 1.529 3.493 0 CA-C-O 118.303 -0.856 . . . . 0.0 111.196 176.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -67.02 -38.62 86.27 Favored 'General case' 0 N--CA 1.53 3.572 0 CA-C-N 119.344 0.975 . . . . 0.0 108.917 177.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 19.0 ptt180 -86.26 -14.29 44.24 Favored 'General case' 0 N--CA 1.533 3.696 0 CA-C-O 118.229 -0.891 . . . . 0.0 109.775 174.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -73.38 -27.59 61.56 Favored 'General case' 0 N--CA 1.533 3.679 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 173.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.22 -46.59 8.33 Favored 'General case' 0 N--CA 1.509 2.486 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.491 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 18.9 tp -64.01 -23.65 67.41 Favored 'General case' 1 N--CA 1.54 4.054 0 CA-C-N 120.0 1.273 . . . . 0.0 107.714 174.069 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.45 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -67.46 -77.53 0.32 Allowed Glycine 0 N--CA 1.504 3.231 0 C-N-CA 125.449 1.499 . . . . 0.0 111.845 176.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.8 m -69.82 -26.66 64.35 Favored 'General case' 0 N--CA 1.538 3.964 0 CA-C-O 118.328 -0.844 . . . . 0.0 113.005 -176.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -70.73 -47.77 58.0 Favored 'General case' 0 N--CA 1.533 3.71 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 178.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 22.7 t -65.8 -18.73 24.45 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.168 0 CA-C-N 120.008 1.277 . . . . 0.0 109.373 174.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.9 mtp180 -72.58 -46.83 52.38 Favored 'General case' 0 N--CA 1.529 3.515 0 CA-C-O 117.555 -1.212 . . . . 0.0 111.826 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.41 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -74.41 -24.39 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.609 0 CA-C-N 121.147 1.794 . . . . 0.0 111.359 -178.896 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.712 HG11 HD21 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -86.26 -52.46 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.999 0 CA-C-N 120.144 1.338 . . . . 0.0 107.984 -178.382 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -60.2 -30.53 69.43 Favored 'General case' 0 N--CA 1.529 3.522 0 C-N-CA 123.387 0.675 . . . . 0.0 109.796 178.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -76.6 -33.53 58.42 Favored 'General case' 0 N--CA 1.529 3.501 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 176.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.7 mp -75.8 -24.84 55.96 Favored 'General case' 0 N--CA 1.529 3.514 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 176.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 22.7 mt -76.99 -26.5 53.96 Favored 'General case' 0 N--CA 1.52 3.068 0 C-N-CA 123.774 0.83 . . . . 0.0 109.482 177.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? -77.38 -44.9 27.71 Favored 'General case' 0 N--CA 1.522 3.132 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 179.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.67 52.07 6.76 Favored Glycine 1 N--CA 1.516 4.029 0 CA-C-O 119.239 -0.756 . . . . 0.0 111.607 177.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -95.19 -42.04 8.77 Favored 'General case' 0 N--CA 1.523 3.223 0 CA-C-N 117.888 0.844 . . . . 0.0 109.519 178.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 5.0 ttt 119.95 82.14 0.0 OUTLIER 'General case' 1 N--CA 1.545 4.288 0 C-N-CA 127.61 2.364 . . . . 0.0 105.309 -179.319 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 19.8 m -139.39 49.13 1.83 Allowed 'General case' 0 N--CA 1.514 2.751 0 CA-C-O 122.036 0.922 . . . . 0.0 110.135 -177.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -110.83 -49.13 3.06 Favored 'General case' 0 N--CA 1.52 3.057 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 178.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -91.35 -46.63 7.92 Favored 'General case' 0 N--CA 1.522 3.147 0 C-N-CA 123.776 0.83 . . . . 0.0 109.076 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -76.46 -10.47 59.42 Favored 'General case' 0 N--CA 1.518 2.941 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -179.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 43.0 tp -83.72 -50.94 7.67 Favored 'General case' 0 N--CA 1.531 3.587 0 CA-C-O 117.591 -1.195 . . . . 0.0 113.325 -177.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -37.9 -36.6 0.2 Allowed 'General case' 1 N--CA 1.549 4.506 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 -176.354 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -66.02 -38.32 88.14 Favored 'General case' 1 N--CA 1.542 4.139 0 CA-C-N 118.569 0.622 . . . . 0.0 111.847 -177.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -50.65 -34.09 24.97 Favored 'General case' 0 N--CA 1.532 3.66 0 C-N-CA 124.427 1.091 . . . . 0.0 113.675 -178.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 pp -151.01 -44.52 0.12 Allowed 'General case' 0 N--CA 1.53 3.558 0 CA-C-N 119.045 0.839 . . . . 0.0 112.108 -179.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 114.47 81.68 1.01 Allowed Glycine 1 N--CA 1.517 4.053 0 N-CA-C 110.895 -0.882 . . . . 0.0 110.895 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -106.14 -50.65 3.12 Favored 'General case' 0 N--CA 1.522 3.165 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 177.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 119.2 158.58 10.73 Favored Glycine 1 N--CA 1.516 4.001 0 N-CA-C 110.112 -1.195 . . . . 0.0 110.112 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.55 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.5 OUTLIER -81.01 -18.53 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.984 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 177.501 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 1.036 ' HB2' ' H62' ' E' ' 15' ' ' ' DA' . . . -68.78 -36.05 77.83 Favored 'General case' 0 N--CA 1.518 2.928 0 CA-C-O 117.658 -1.163 . . . . 0.0 110.111 177.146 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 10.5 p -76.77 -50.82 12.64 Favored 'General case' 0 N--CA 1.534 3.739 0 CA-C-N 119.604 1.093 . . . . 0.0 111.895 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.41 HG22 ' HB ' ' A' ' 57' ' ' ILE . 0.1 OUTLIER -64.7 -28.54 45.05 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.038 0 CA-C-O 118.102 -0.951 . . . . 0.0 113.087 -176.833 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 44.4 p -99.77 -29.13 12.8 Favored 'General case' 0 N--CA 1.515 2.81 0 CA-C-N 119.456 1.025 . . . . 0.0 111.294 -178.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.3 ptt180 -73.85 -24.73 59.8 Favored 'General case' 0 N--CA 1.535 3.815 0 CA-C-N 119.651 1.114 . . . . 0.0 108.892 175.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.62 -32.32 82.82 Favored Glycine 1 N--CA 1.519 4.196 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 175.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 6.4 t -65.77 -42.37 90.92 Favored 'General case' 1 N--CA 1.54 4.028 0 CA-C-N 117.899 0.85 . . . . 0.0 110.126 177.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -64.14 -30.29 71.36 Favored 'General case' 0 N--CA 1.537 3.913 0 C-N-CA 123.395 0.678 . . . . 0.0 111.115 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.2 m -67.57 -38.3 83.89 Favored 'General case' 0 N--CA 1.532 3.654 0 C-N-CA 123.355 0.662 . . . . 0.0 110.576 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 21.5 mt -55.73 -44.89 77.97 Favored 'General case' 0 N--CA 1.53 3.564 0 C-N-CA 124.151 0.981 . . . . 0.0 111.387 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -28.29 69.25 Favored 'General case' 1 N--CA 1.542 4.139 0 CA-C-O 118.786 -0.626 . . . . 0.0 111.442 179.868 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -69.91 -39.95 75.86 Favored 'General case' 0 N--CA 1.52 3.033 0 CA-C-N 118.426 0.557 . . . . 0.0 110.849 179.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.44 161.11 6.14 Favored Pre-proline 1 N--CA 1.542 4.127 0 CA-C-O 118.428 -0.796 . . . . 0.0 112.712 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -79.68 156.67 24.55 Favored 'Trans proline' 0 C--N 1.377 2.059 0 C-N-CA 122.077 1.851 . . . . 0.0 110.931 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.6 t -88.8 -27.79 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.096 0 CA-C-O 117.734 -1.127 . . . . 0.0 111.947 -178.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -64.06 -34.93 79.14 Favored 'General case' 0 N--CA 1.516 2.857 0 CA-C-N 120.262 1.392 . . . . 0.0 109.987 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.412 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.1 mp -96.94 -19.61 18.68 Favored 'General case' 0 N--CA 1.51 2.538 0 C-N-CA 123.85 0.86 . . . . 0.0 110.776 177.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.29 -33.58 74.93 Favored 'General case' 1 N--CA 1.547 4.387 0 N-CA-C 104.521 -2.399 . . . . 0.0 104.521 169.721 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -51.17 -42.8 61.06 Favored 'General case' 0 N--CA 1.522 3.164 0 C-N-CA 124.535 1.134 . . . . 0.0 110.803 175.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.632 ' CZ3' HD21 ' B' ' 538' ' ' LEU . 38.3 t90 -63.18 -36.04 82.3 Favored 'General case' 0 N--CA 1.532 3.662 0 N-CA-C 107.637 -1.246 . . . . 0.0 107.637 177.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.43 ' O ' ' HB2' ' A' ' 104' ' ' LEU . 1.5 tt -50.77 -40.9 56.23 Favored 'General case' 0 N--CA 1.537 3.905 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 175.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -69.17 -37.21 78.07 Favored 'General case' 1 N--CA 1.545 4.313 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 176.028 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.501 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 1.3 mm-40 -58.02 -23.23 53.34 Favored 'General case' 1 N--CA 1.545 4.276 0 C-N-CA 123.662 0.785 . . . . 0.0 110.55 175.814 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.564 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.4 OUTLIER -122.39 -0.64 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.314 0 CA-C-O 118.28 -0.867 . . . . 0.0 113.007 -176.924 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 100' ' ' LEU . 0.1 OUTLIER -112.31 -59.04 2.06 Favored 'General case' 0 N--CA 1.517 2.919 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 176.813 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.1 tt -54.06 -58.9 5.6 Favored 'General case' 1 N--CA 1.544 4.225 0 C-N-CA 124.776 1.23 . . . . 0.0 111.714 179.192 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -63.22 -30.36 71.52 Favored 'General case' 0 N--CA 1.539 3.981 0 CA-C-O 118.535 -0.745 . . . . 0.0 111.876 -178.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 70.4 m . . . . . 0 N--CA 1.524 3.228 0 CA-C-O 117.975 -1.012 . . . . 0.0 109.68 179.362 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 33.3 tt0 . . . . . 0 N--CA 1.501 2.104 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 40.9 p -120.37 142.37 33.73 Favored Pre-proline 0 N--CA 1.53 3.545 0 CA-C-O 117.641 -1.171 . . . . 0.0 110.674 179.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -62.54 121.22 9.09 Favored 'Trans proline' 0 C--N 1.394 2.96 0 C-N-CA 122.886 2.391 . . . . 0.0 110.75 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -97.78 124.77 42.29 Favored 'General case' 0 N--CA 1.519 2.984 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -179.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 72.5 m -133.62 -46.56 0.81 Allowed 'General case' 0 N--CA 1.525 3.309 0 C-N-CA 123.663 0.785 . . . . 0.0 109.128 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . 69.63 133.73 0.03 OUTLIER 'General case' 0 N--CA 1.531 3.6 0 C-N-CA 124.708 1.203 . . . . 0.0 111.44 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -140.52 -50.22 0.46 Allowed 'General case' 0 N--CA 1.521 3.118 0 C-N-CA 123.525 0.73 . . . . 0.0 109.26 179.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 16.8 mmt -100.36 137.35 38.91 Favored 'General case' 0 N--CA 1.525 3.296 0 C-N-CA 123.366 0.666 . . . . 0.0 109.614 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . 65.34 144.3 0.03 OUTLIER 'General case' 1 N--CA 1.542 4.166 0 C-N-CA 124.287 1.035 . . . . 0.0 111.869 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -83.66 -57.58 3.17 Favored 'General case' 0 N--CA 1.523 3.185 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 64.75 136.79 0.02 OUTLIER 'General case' 1 N--CA 1.548 4.43 0 C-N-CA 124.3 1.04 . . . . 0.0 111.085 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -131.46 131.32 43.42 Favored 'General case' 0 N--CA 1.531 3.595 0 CA-C-N 118.012 0.369 . . . . 0.0 111.693 -179.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 4.0 p-80 -121.58 117.87 27.83 Favored 'General case' 0 N--CA 1.526 3.375 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 177.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -91.79 125.99 36.71 Favored 'General case' 0 N--CA 1.529 3.507 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -177.265 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -139.54 -58.97 0.57 Allowed 'General case' 0 N--CA 1.524 3.256 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 178.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 519' ' ' TRP . . . . . 0.729 ' CE2' HD22 ' A' ' 39' ' ' LEU . 64.5 t-105 -47.02 -26.67 1.09 Allowed 'General case' 1 N--CA 1.542 4.137 0 C-N-CA 124.261 1.024 . . . . 0.0 112.588 177.056 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 520' ' ' LEU . . . . . 0.599 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.1 mm? -96.13 -28.23 14.68 Favored 'General case' 0 N--CA 1.529 3.494 0 CA-C-O 117.558 -1.21 . . . . 0.0 113.105 -173.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 55.4 ttt180 -61.71 -25.45 67.43 Favored 'General case' 1 N--CA 1.542 4.174 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 170.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . 0.57 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.6 m-85 -77.93 -41.97 34.57 Favored 'General case' 0 N--CA 1.51 2.557 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 174.088 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 86.0 t -65.17 -18.22 23.39 Favored 'Isoleucine or valine' 1 N--CA 1.574 5.775 0 CA-C-N 120.116 1.325 . . . . 0.0 111.918 178.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -78.13 -57.06 3.99 Favored 'General case' 0 N--CA 1.534 3.726 0 CA-C-N 120.406 1.457 . . . . 0.0 107.338 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.1 -24.68 67.28 Favored 'General case' 0 N--CA 1.537 3.881 0 O-C-N 123.248 0.343 . . . . 0.0 110.287 175.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 526' ' ' LEU . . . . . 0.492 HD23 ' O ' ' B' ' 522' ' ' PHE . 2.0 mm? -73.06 -36.77 66.94 Favored 'General case' 0 N--CA 1.516 2.868 0 CA-C-O 118.171 -0.918 . . . . 0.0 109.452 178.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 3.5 tttt -68.42 -22.89 64.59 Favored 'General case' 0 N--CA 1.528 3.455 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.037 178.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -71.91 -44.07 64.3 Favored 'General case' 0 N--CA 1.532 3.647 0 CA-C-N 119.282 0.946 . . . . 0.0 108.809 177.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 529' ' ' ALA . . . . . 0.573 ' HB1' ' N ' ' B' ' 535' ' ' HIS . . . -82.13 -13.51 57.12 Favored 'General case' 0 N--CA 1.511 2.575 0 CA-C-O 119.028 -0.51 . . . . 0.0 110.934 178.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -78.51 -30.89 47.38 Favored 'General case' 0 N--CA 1.534 3.742 0 CA-C-N 119.566 1.076 . . . . 0.0 109.65 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -66.1 -44.44 84.34 Favored 'General case' 0 N--CA 1.535 3.793 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 177.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -87.76 -90.31 0.12 Allowed 'General case' 0 N--CA 1.515 2.781 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 176.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.1 p30 156.46 50.08 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.831 0 C-N-CA 127.041 2.136 . . . . 0.0 108.667 176.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 534' ' ' LEU . . . . . 0.702 ' O ' HD13 ' B' ' 538' ' ' LEU . 7.8 mt -107.46 5.19 26.99 Favored 'General case' 0 N--CA 1.518 2.961 0 C-N-CA 124.901 1.28 . . . . 0.0 110.569 -178.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 535' ' ' HIS . . . . . 0.587 ' HA ' HD22 ' B' ' 538' ' ' LEU . 50.5 p-80 -77.84 3.73 13.62 Favored 'General case' 0 N--CA 1.522 3.132 0 O-C-N 121.824 -0.548 . . . . 0.0 109.6 174.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 536' ' ' LEU . . . . . 0.5 HD22 ' HE1' ' A' ' 19' ' ' TRP . 24.5 mt -93.21 -52.57 0.26 Allowed Pre-proline 0 N--CA 1.504 2.264 0 CA-C-O 116.783 -1.58 . . . . 0.0 108.42 -176.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 537' ' ' PRO . . . . . 0.476 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 4.8 Cg_exo -60.75 -33.32 93.2 Favored 'Trans proline' 0 C--N 1.397 3.124 0 C-N-CA 122.152 1.901 . . . . 0.0 107.942 171.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 538' ' ' LEU . . . . . 0.702 HD13 ' O ' ' B' ' 534' ' ' LEU . 7.5 mp -62.01 -49.06 77.54 Favored 'General case' 0 N--CA 1.536 3.865 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 174.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 29.4 mt -70.74 -11.5 60.98 Favored 'General case' 0 N--CA 1.534 3.757 0 CA-C-O 118.311 -0.852 . . . . 0.0 112.374 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -81.3 -15.74 54.54 Favored 'General case' 0 N--CA 1.52 3.072 0 CA-C-O 118.108 -0.949 . . . . 0.0 110.996 177.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 541' ' ' LEU . . . . . 0.712 HD21 HG11 ' A' ' 58' ' ' VAL . 0.0 OUTLIER -117.68 -30.3 5.5 Favored 'General case' 0 N--CA 1.525 3.325 0 CA-C-N 119.774 1.17 . . . . 0.0 112.497 -177.302 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 542' ' ' MET . . . . . 0.631 ' N ' HD13 ' B' ' 541' ' ' LEU . 4.6 ptt? -101.64 10.87 39.76 Favored 'General case' 1 N--CA 1.544 4.254 0 CA-C-N 120.286 1.403 . . . . 0.0 112.726 -179.233 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 543' ' ' LEU . . . . . 0.414 ' O ' HG23 ' B' ' 544' ' ' THR . 1.3 tt -128.72 -95.77 0.41 Allowed 'General case' 0 N--CA 1.528 3.459 0 CA-C-O 117.477 -1.249 . . . . 0.0 112.372 178.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 544' ' ' THR . . . . . 0.546 HG23 ' HB2' ' A' ' 898' ' ' TRP . 0.3 OUTLIER 162.75 177.77 0.03 OUTLIER Pre-proline 1 N--CA 1.585 6.319 0 CA-C-N 120.916 1.689 . . . . 0.0 109.549 -176.698 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -57.09 -21.45 42.49 Favored 'Trans proline' 1 N--CA 1.538 4.104 0 C-N-CA 122.31 2.007 . . . . 0.0 111.225 173.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -64.46 -0.37 1.31 Allowed 'General case' 0 N--CA 1.532 3.632 0 C-N-CA 123.613 0.765 . . . . 0.0 111.47 175.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -55.45 -79.8 0.02 OUTLIER 'General case' 0 N--CA 1.521 3.112 0 CA-C-O 116.608 -1.663 . . . . 0.0 108.632 178.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 25.4 ptt180 -88.07 -8.95 54.76 Favored 'General case' 0 N--CA 1.523 3.198 0 CA-C-N 121.878 2.126 . . . . 0.0 111.976 177.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -68.94 -54.88 12.99 Favored 'General case' 0 N--CA 1.534 3.753 0 CA-C-N 120.569 1.532 . . . . 0.0 107.676 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -85.33 -30.24 23.85 Favored 'General case' 0 N--CA 1.513 2.713 0 CA-C-O 117.843 -1.075 . . . . 0.0 111.809 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 551' ' ' LEU . . . . . 0.413 HD23 ' CE3' ' A' ' 19' ' ' TRP . 14.0 tp -67.88 -36.38 80.16 Favored 'General case' 1 N--CA 1.542 4.171 0 CA-C-N 121.136 1.789 . . . . 0.0 109.787 178.385 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -74.38 -55.71 5.47 Favored Glycine 0 N--CA 1.496 2.693 0 CA-C-O 118.642 -1.088 . . . . 0.0 112.563 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.6 m -76.74 -22.59 53.62 Favored 'General case' 1 N--CA 1.543 4.22 0 CA-C-N 118.953 1.377 . . . . 0.0 113.588 -176.034 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -81.14 -41.9 21.74 Favored 'General case' 0 N--CA 1.538 3.941 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 176.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 555' ' ' VAL . . . . . 0.48 HG21 ' HB2' ' A' ' 22' ' ' PHE . 93.1 t -64.49 -18.54 23.36 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.958 0 O-C-N 121.182 -0.949 . . . . 0.0 108.684 173.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -76.47 -43.45 39.77 Favored 'General case' 0 N--CA 1.522 3.137 0 CA-C-O 116.958 -1.496 . . . . 0.0 111.657 176.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 557' ' ' ILE . . . . . 0.546 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -72.96 -24.01 20.74 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.526 0 CA-C-N 121.938 2.153 . . . . 0.0 110.555 -179.3 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 558' ' ' VAL . . . . . 0.546 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.0 OUTLIER -82.31 -44.24 19.52 Favored 'Isoleucine or valine' 1 N--CA 1.546 4.336 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 -179.806 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -64.02 -28.78 70.04 Favored 'General case' 0 N--CA 1.528 3.463 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -89.51 -19.34 25.16 Favored 'General case' 0 N--CA 1.525 3.291 0 CA-C-O 118.467 -0.778 . . . . 0.0 110.421 177.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 32.5 tp -76.12 -47.17 25.43 Favored 'General case' 0 N--CA 1.532 3.673 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 1.5 tt -46.98 -33.87 5.07 Favored 'General case' 1 N--CA 1.547 4.385 0 C-N-CA 125.09 1.356 . . . . 0.0 110.972 178.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 19.6 mmm180 -81.4 -58.85 2.85 Favored 'General case' 0 N--CA 1.518 2.973 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 178.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 51.67 37.83 43.05 Favored Glycine 1 N--CA 1.535 5.238 0 C-N-CA 124.322 0.963 . . . . 0.0 112.909 178.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -99.48 -51.8 3.67 Favored 'General case' 0 N--CA 1.519 2.996 0 CA-C-N 117.777 0.789 . . . . 0.0 109.148 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 8.2 ptt? -157.35 44.48 0.36 Allowed 'General case' 0 N--CA 1.53 3.531 0 CA-C-O 121.659 0.742 . . . . 0.0 109.795 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 28.1 m -135.36 37.72 2.93 Favored 'General case' 0 N--CA 1.517 2.922 0 C-N-CA 123.554 0.742 . . . . 0.0 109.793 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -109.84 -54.85 2.51 Favored 'General case' 0 N--CA 1.514 2.741 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 569' ' ' ARG . . . . . 0.455 ' HA ' HD11 ' B' ' 579' ' ' ILE . 0.1 OUTLIER -97.37 -43.61 7.23 Favored 'General case' 0 N--CA 1.524 3.272 0 C-N-CA 122.957 0.503 . . . . 0.0 110.998 -179.196 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -79.21 -12.59 59.97 Favored 'General case' 0 N--CA 1.523 3.203 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -177.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 571' ' ' LEU . . . . . 0.835 HD23 HD11 ' B' ' 582' ' ' ILE . 17.9 tp -70.81 -44.11 67.25 Favored 'General case' 0 N--CA 1.532 3.669 0 CA-C-N 119.749 1.159 . . . . 0.0 111.493 -178.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -40.66 -29.6 0.1 Allowed 'General case' 1 N--CA 1.558 4.939 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -179.64 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -69.68 -48.7 58.79 Favored 'General case' 0 N--CA 1.538 3.958 0 CA-C-N 119.04 0.836 . . . . 0.0 109.336 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -55.3 -39.23 69.67 Favored 'General case' 0 N--CA 1.53 3.537 0 C-N-CA 124.908 1.283 . . . . 0.0 112.609 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 42.0 mt -114.34 -60.32 1.9 Allowed 'General case' 0 N--CA 1.53 3.555 0 C-N-CA 122.88 0.472 . . . . 0.0 111.457 -177.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 114.41 28.51 3.0 Favored Glycine 1 N--CA 1.522 4.412 0 CA-C-O 118.495 -1.17 . . . . 0.0 111.307 -178.406 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -101.28 115.94 31.66 Favored 'General case' 0 N--CA 1.517 2.882 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 178.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -38.5 166.26 0.01 OUTLIER Glycine 1 N--CA 1.536 5.358 0 C-N-CA 125.303 1.43 . . . . 0.0 115.414 -177.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 579' ' ' ILE . . . . . 0.814 HG21 ' N6 ' ' E' ' 4' ' ' ' DA' . 0.6 OUTLIER -79.78 -17.7 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.963 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 177.239 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 580' ' ' ALA . . . . . 0.791 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -65.62 -20.08 66.17 Favored 'General case' 0 N--CA 1.519 3.018 0 CA-C-O 116.996 -1.478 . . . . 0.0 111.192 176.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 581' ' ' THR . . . . . 0.567 HG21 ' OP2' ' F' ' 14' ' ' ' DT' . 1.2 p -101.59 -35.82 8.99 Favored 'General case' 1 N--CA 1.542 4.152 0 CA-C-N 120.811 1.642 . . . . 0.0 111.208 178.122 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 582' ' ' ILE . . . . . 0.835 HD11 HD23 ' B' ' 571' ' ' LEU . 2.9 tt -66.51 -39.06 83.03 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.565 0 C-N-CA 123.32 0.648 . . . . 0.0 110.575 -177.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 583' ' ' THR . . . . . 0.445 HG23 HG23 ' B' ' 582' ' ' ILE . 77.8 p -96.08 -19.58 19.32 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 118.301 -0.857 . . . . 0.0 110.437 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 10.5 ttp180 -64.69 -31.3 72.47 Favored 'General case' 1 N--CA 1.549 4.503 0 N-CA-C 106.688 -1.597 . . . . 0.0 106.688 172.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -66.46 -36.96 92.27 Favored Glycine 0 N--CA 1.514 3.835 0 N-CA-C 110.215 -1.154 . . . . 0.0 110.215 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 59.7 p -61.85 -30.14 70.65 Favored 'General case' 1 N--CA 1.55 4.537 0 CA-C-N 118.614 1.207 . . . . 0.0 112.407 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -66.93 -28.8 68.59 Favored 'General case' 0 N--CA 1.539 3.977 0 CA-C-N 118.681 0.673 . . . . 0.0 110.624 178.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 14.9 m -64.04 -34.98 79.25 Favored 'General case' 0 N--CA 1.533 3.721 0 C-N-CA 123.512 0.725 . . . . 0.0 111.692 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 13.4 mt -56.36 -41.73 76.63 Favored 'General case' 0 N--CA 1.536 3.831 0 C-N-CA 123.947 0.899 . . . . 0.0 111.776 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.96 -19.57 65.24 Favored 'General case' 1 N--CA 1.543 4.205 0 CA-C-O 118.359 -0.829 . . . . 0.0 112.787 -179.23 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -108.27 -21.92 12.56 Favored 'General case' 0 N--CA 1.521 3.098 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 -178.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -66.36 160.99 62.06 Favored Pre-proline 0 N--CA 1.538 3.972 0 CA-C-N 119.598 1.09 . . . . 0.0 112.424 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -83.82 148.47 12.31 Favored 'Trans proline' 0 C--N 1.379 2.162 0 C-N-CA 122.272 1.981 . . . . 0.0 108.935 178.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -82.91 -28.03 8.12 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.948 0 CA-C-O 117.858 -1.068 . . . . 0.0 112.045 -178.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -61.88 -37.8 85.91 Favored 'General case' 0 N--CA 1.519 3.013 0 CA-C-N 120.183 1.356 . . . . 0.0 110.513 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 596' ' ' LEU . . . . . 0.416 HD12 ' N ' ' B' ' 596' ' ' LEU . 6.9 mp -99.84 -17.86 17.43 Favored 'General case' 0 N--CA 1.513 2.679 0 C-N-CA 123.887 0.875 . . . . 0.0 111.269 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.12 -36.65 82.41 Favored 'General case' 1 N--CA 1.545 4.301 0 N-CA-C 103.823 -2.658 . . . . 0.0 103.823 170.022 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -56.92 -39.3 74.21 Favored 'General case' 0 N--CA 1.513 2.714 0 C-N-CA 124.405 1.082 . . . . 0.0 111.79 175.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 599' ' ' TRP . . . . . 0.623 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 63.6 t90 -63.31 -32.76 74.26 Favored 'General case' 0 N--CA 1.531 3.604 0 CA-C-O 117.832 -1.08 . . . . 0.0 108.331 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 46.5 mt -55.3 -37.94 68.0 Favored 'General case' 1 N--CA 1.541 4.077 0 CA-C-N 119.162 0.892 . . . . 0.0 109.167 176.099 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -73.05 -30.31 63.63 Favored 'General case' 0 N--CA 1.529 3.48 0 O-C-N 123.935 0.772 . . . . 0.0 109.532 176.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 602' ' ' GLU . . . . . 0.459 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.6 OUTLIER -65.17 -27.4 68.68 Favored 'General case' 1 N--CA 1.542 4.137 0 C-N-CA 123.928 0.891 . . . . 0.0 110.076 175.495 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' B' B ' 603' ' ' VAL . . . . . 0.511 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.0 OUTLIER -111.21 -4.44 11.01 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.245 0 CA-C-O 118.08 -0.962 . . . . 0.0 112.365 -177.081 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -94.39 -59.68 1.89 Allowed 'General case' 0 N--CA 1.512 2.632 0 N-CA-C 104.349 -2.464 . . . . 0.0 104.349 175.263 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.64 -70.21 0.32 Allowed 'General case' 0 N--CA 1.526 3.367 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 176.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 44.3 tttm 59.37 98.72 0.02 OUTLIER 'General case' 0 N--CA 1.522 3.173 0 C-N-CA 125.289 1.436 . . . . 0.0 111.489 178.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 39.3 p . . . . . 0 N--CA 1.526 3.346 0 CA-C-O 118.45 -0.786 . . . . 0.0 109.444 179.739 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 898' ' ' TRP . . . . . 0.546 ' HB2' HG23 ' B' ' 544' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.075 0 CA-C-O 118.402 -0.808 . . . . 0.0 108.866 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.506 2.332 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.87 3 O4'-C1'-N19 119.377 14.471 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.882 4 O4'-C1'-N19 120.472 15.84 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.423 -9.494 3 O4'-C1'-N19 120.346 15.683 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . 0.481 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 5 C3'--C2' 1.419 -9.93 4 O4'-C1'-N19 119.789 14.986 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' E' E ' 5' ' ' ' DC' . . . . . 0.565 ' H41' ' HA ' ' B' ' 580' ' ' ALA . . . . . . . . 5 O3'--C3' 1.567 10.464 3 O4'-C1'-N19 118.581 13.476 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . 0.475 ' H71' " H2'" ' E' ' 5' ' ' ' DC' . . . . . . . . 5 C3'--C2' 1.409 -10.891 3 O4'-C1'-N19 119.521 14.652 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' E' E ' 7' ' ' ' DA' . . . . . 0.684 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.398 -12.045 4 C4'-C3'-C2' 111.885 8.685 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' E' E ' 8' ' ' ' DG' . . . . . 0.684 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.416 -10.167 4 O4'-C1'-N19 119.903 15.128 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.932 6 O4'-C1'-N19 119.322 14.403 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.705 2 O4'-C1'-N19 119.383 14.479 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.413 -10.456 4 O4'-C1'-N19 121.152 16.69 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.759 5 O4'-C1'-N19 119.287 14.359 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.407 -11.097 3 O4'-C1'-N19 119.907 15.133 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' E' E ' 14' ' ' ' DT' . . . . . 0.912 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.417 -10.117 3 C4'-C3'-C2' 117.11 13.91 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' E' E ' 15' ' ' ' DA' . . . . . 0.851 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.418 -10.005 7 O4'-C1'-N19 119.469 14.587 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.419 -9.876 5 O4'-C1'-N19 119.704 14.88 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.564 10.195 3 O4'-C1'-N19 120.113 15.391 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.412 -10.592 4 O4'-C1'-N19 120.57 15.963 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.463 5 O4'-C1'-N19 120.047 15.308 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.512 7.104 4 O4'-C1'-N19 119.477 14.596 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.564 10.202 3 C4'-C3'-C2' 117.089 13.889 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.37 3 O4'-C1'-N19 119.553 14.691 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.41 -10.842 5 O4'-C1'-N19 119.907 15.134 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' F' F ' 4' ' ' ' DA' . . . . . 0.488 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.418 -10.027 3 O4'-C1'-N19 119.859 15.074 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' F' F ' 5' ' ' ' DC' . . . . . 0.692 ' H41' ' HA ' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.41 -10.782 5 O4'-C1'-N19 118.726 13.658 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.407 -11.142 3 O4'-C1'-N19 120.241 15.552 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' F' F ' 7' ' ' ' DA' . . . . . 0.401 H2'' " O5'" ' F' ' 8' ' ' ' DG' . . . . . . . . 4 C4'--C3' 1.412 -11.606 4 N19-C1'-C2' 129.658 9.661 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' F' F ' 8' ' ' ' DG' . . . . . 0.401 " O5'" H2'' ' F' ' 7' ' ' ' DA' . . . . . . . . 4 C3'--C2' 1.427 -9.135 3 O4'-C1'-N19 119.228 14.285 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.574 10.989 4 O4'-C1'-N19 119.134 14.167 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.413 -10.496 3 O4'-C1'-N19 119.169 14.211 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.416 -10.15 5 O4'-C1'-N19 120.547 15.934 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.058 2 O4'-C1'-N19 119.931 15.164 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' F' F ' 13' ' ' ' DC' . . . . . 0.47 H2'' HG21 ' B' ' 581' ' ' THR . . . . . . . . 5 O3'--C3' 1.581 11.564 5 O4'-C1'-N19 118.39 13.238 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' F' F ' 14' ' ' ' DT' . . . . . 0.665 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.414 -10.37 3 O4'-C1'-N19 119.004 14.005 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' F' F ' 15' ' ' ' DA' . . . . . 0.948 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.415 -10.33 6 O4'-C1'-N19 119.905 15.132 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.415 -10.283 4 O4'-C1'-N19 119.712 14.89 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.33 4 O4'-C1'-N19 119.376 14.47 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.177 2 O4'-C1'-N19 120.052 15.315 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -10.964 5 O4'-C1'-N19 118.894 13.867 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 O4'--C1' 1.517 7.433 5 O4'-C1'-N19 119.89 15.113 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 . . . . . 0 N--CA 1.506 2.362 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.9 t -144.46 143.42 21.72 Favored Pre-proline 0 N--CA 1.521 3.086 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.973 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -66.32 135.91 41.61 Favored 'Trans proline' 0 C--N 1.388 2.651 0 C-N-CA 123.128 2.552 . . . . 0.0 112.078 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -112.4 144.34 42.0 Favored 'General case' 0 N--CA 1.529 3.512 0 C-N-CA 123.6 0.76 . . . . 0.0 110.47 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 66.5 m 64.9 133.48 0.02 OUTLIER 'General case' 1 N--CA 1.542 4.127 0 C-N-CA 124.582 1.153 . . . . 0.0 111.18 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -147.18 130.83 16.88 Favored 'General case' 0 N--CA 1.522 3.142 0 C-N-CA 122.744 0.418 . . . . 0.0 110.357 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -115.57 136.18 53.33 Favored 'General case' 0 N--CA 1.526 3.344 0 C-N-CA 123.176 0.59 . . . . 0.0 110.464 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 3.7 mpp? -103.93 -50.94 3.26 Favored 'General case' 0 N--CA 1.52 3.074 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 179.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -138.71 -61.44 0.58 Allowed 'General case' 0 N--CA 1.523 3.175 0 C-N-CA 122.983 0.513 . . . . 0.0 109.655 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 64.63 134.44 0.02 OUTLIER 'General case' 0 N--CA 1.532 3.666 0 C-N-CA 124.752 1.221 . . . . 0.0 111.867 179.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 7.8 mm100 -142.47 116.59 9.45 Favored 'General case' 0 N--CA 1.521 3.109 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.45 133.91 0.01 OUTLIER 'General case' 0 N--CA 1.539 3.988 0 C-N-CA 125.166 1.386 . . . . 0.0 111.65 -179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.4 t-160 -167.46 -40.23 0.02 OUTLIER 'General case' 0 N--CA 1.534 3.731 0 CA-C-O 118.614 -0.708 . . . . 0.0 112.638 -178.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -76.18 -35.49 59.1 Favored 'General case' 0 N--CA 1.534 3.76 0 N-CA-C 114.792 1.404 . . . . 0.0 114.792 -174.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -103.91 -96.04 0.32 Allowed 'General case' 0 N--CA 1.532 3.664 0 CA-C-N 120.316 1.416 . . . . 0.0 111.95 -177.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.921 ' CE3' HD22 ' B' ' 551' ' ' LEU . 64.8 t-105 -49.07 -42.53 39.02 Favored 'General case' 0 N--CA 1.527 3.415 0 CA-C-N 119.629 1.104 . . . . 0.0 112.919 -177.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.428 HD22 ' N ' ' A' ' 20' ' ' LEU . 2.3 mm? -81.2 -24.7 37.29 Favored 'General case' 0 N--CA 1.528 3.451 0 CA-C-O 117.595 -1.193 . . . . 0.0 112.859 -175.007 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -61.38 -29.53 69.97 Favored 'General case' 0 N--CA 1.532 3.675 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 173.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.681 ' CD1' HD21 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -85.24 -29.76 24.39 Favored 'General case' 0 N--CA 1.519 3.004 0 CA-C-O 116.203 -1.856 . . . . 0.0 109.723 174.913 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 86.1 t -72.79 -31.01 34.84 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.239 0 CA-C-N 121.908 2.14 . . . . 0.0 111.315 -177.289 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -73.82 -49.68 24.04 Favored 'General case' 0 N--CA 1.532 3.633 0 CA-C-N 119.335 0.97 . . . . 0.0 108.5 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.0 mp -70.15 -18.56 63.22 Favored 'General case' 0 N--CA 1.531 3.611 0 CA-C-O 119.515 -0.279 . . . . 0.0 110.323 176.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.403 HD22 ' HA ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -73.09 -33.65 65.72 Favored 'General case' 0 N--CA 1.526 3.33 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 175.256 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -64.51 -22.49 66.98 Favored 'General case' 0 N--CA 1.521 3.084 0 CA-C-O 118.502 -0.761 . . . . 0.0 110.849 175.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -72.51 -46.03 56.56 Favored 'General case' 0 N--CA 1.534 3.757 0 CA-C-N 119.114 0.87 . . . . 0.0 108.864 177.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.636 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -80.93 -10.09 59.76 Favored 'General case' 0 N--CA 1.51 2.537 0 CA-C-O 118.645 -0.693 . . . . 0.0 110.988 178.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -81.01 -34.83 32.6 Favored 'General case' 0 N--CA 1.53 3.565 0 CA-C-N 119.995 1.27 . . . . 0.0 109.061 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -61.4 -40.81 95.74 Favored 'General case' 0 N--CA 1.534 3.757 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 177.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -94.38 -88.66 0.24 Allowed 'General case' 0 N--CA 1.512 2.66 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 177.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.7 p30 151.63 53.32 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.871 0 C-N-CA 127.737 2.415 . . . . 0.0 107.795 177.072 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.498 HD22 ' CD2' ' B' ' 596' ' ' LEU . 4.5 mt -112.91 9.86 18.91 Favored 'General case' 0 N--CA 1.529 3.518 0 C-N-CA 124.176 0.99 . . . . 0.0 111.246 -178.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.565 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 53.7 p-80 -82.4 4.57 23.56 Favored 'General case' 0 N--CA 1.516 2.827 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 174.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.799 ' HA ' HD23 ' A' ' 39' ' ' LEU . 19.7 mt -93.75 -52.13 0.25 Allowed Pre-proline 0 N--CA 1.511 2.577 0 CA-C-O 116.892 -1.527 . . . . 0.0 108.689 -176.133 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.526 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 3.5 Cg_exo -65.38 -31.07 52.86 Favored 'Trans proline' 0 C--N 1.392 2.839 0 N-CA-C 106.615 -2.11 . . . . 0.0 106.615 170.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.496 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.1 OUTLIER -65.67 -37.95 87.93 Favored 'General case' 0 N--CA 1.522 3.141 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 175.823 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.799 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -73.46 -19.44 60.95 Favored 'General case' 1 N--CA 1.545 4.295 0 CA-C-N 119.826 1.194 . . . . 0.0 111.083 176.708 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -88.56 9.14 24.97 Favored 'General case' 0 N--CA 1.528 3.445 0 CA-C-N 119.099 0.863 . . . . 0.0 110.785 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.655 HD13 ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -127.33 -49.35 1.42 Allowed 'General case' 0 N--CA 1.522 3.14 0 CA-C-N 119.494 1.043 . . . . 0.0 111.188 -178.165 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.655 ' N ' HD13 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -89.53 -18.25 27.01 Favored 'General case' 1 N--CA 1.541 4.118 0 CA-C-N 120.113 1.324 . . . . 0.0 112.182 -178.275 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.513 HD11 HD12 ' B' ' 551' ' ' LEU . 2.2 mp -111.86 -87.69 0.54 Allowed 'General case' 0 N--CA 1.501 2.102 0 CA-C-O 117.833 -1.079 . . . . 0.0 108.294 -179.277 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.634 HG23 ' HB2' ' B' ' 998' ' ' TRP . 0.7 OUTLIER 160.33 166.62 0.04 OUTLIER Pre-proline 1 N--CA 1.557 4.883 0 C-N-CA 125.148 1.379 . . . . 0.0 109.452 -179.193 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -68.62 -36.64 14.16 Favored 'Trans proline' 0 N--CA 1.512 2.575 0 C-N-CA 122.322 2.015 . . . . 0.0 107.723 173.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -62.52 -23.15 66.81 Favored 'General case' 0 N--CA 1.53 3.561 0 C-N-CA 123.953 0.901 . . . . 0.0 110.533 176.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -71.88 -35.54 69.81 Favored 'General case' 0 N--CA 1.521 3.096 0 CA-C-O 117.539 -1.22 . . . . 0.0 109.772 178.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.8 ptt180 -81.04 -19.2 44.37 Favored 'General case' 1 N--CA 1.539 4.001 0 CA-C-N 119.905 1.23 . . . . 0.0 108.519 174.067 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -68.91 -30.95 69.54 Favored 'General case' 0 N--CA 1.528 3.431 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 173.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -88.57 -29.53 19.95 Favored 'General case' 0 N--CA 1.514 2.735 0 CA-C-O 117.739 -1.124 . . . . 0.0 110.74 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 26.7 tp -73.72 -21.26 60.28 Favored 'General case' 1 N--CA 1.539 4.013 0 CA-C-N 120.875 1.67 . . . . 0.0 106.69 173.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.43 -67.3 1.9 Allowed Glycine 0 N--CA 1.501 3.021 0 C-N-CA 125.26 1.41 . . . . 0.0 110.768 177.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.0 m -67.96 -27.46 66.61 Favored 'General case' 0 N--CA 1.532 3.669 0 CA-C-O 118.102 -0.952 . . . . 0.0 112.366 -178.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 17.1 mtm180 -70.52 -48.01 57.63 Favored 'General case' 0 N--CA 1.531 3.581 0 CA-C-N 119.594 1.088 . . . . 0.0 108.526 178.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.405 HG11 ' CD1' ' B' ' 522' ' ' PHE . 34.3 t -67.97 -15.71 20.06 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.074 0 O-C-N 120.742 -1.224 . . . . 0.0 109.618 174.969 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 66.4 mtt-85 -78.25 -42.94 29.64 Favored 'General case' 0 N--CA 1.53 3.557 0 CA-C-N 120.213 1.369 . . . . 0.0 111.565 178.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.403 ' CG2' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -72.17 -24.32 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.6 0 CA-C-N 121.533 1.969 . . . . 0.0 110.379 -179.908 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.499 HG11 HD11 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -86.94 -51.21 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.928 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 -179.549 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -58.86 -25.14 63.01 Favored 'General case' 0 N--CA 1.536 3.851 0 CA-C-O 118.96 -0.543 . . . . 0.0 110.2 177.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -96.62 -20.94 17.94 Favored 'General case' 0 N--CA 1.525 3.32 0 CA-C-O 118.1 -0.953 . . . . 0.0 111.073 178.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 5.3 mt -73.56 -55.4 6.35 Favored 'General case' 0 N--CA 1.539 3.978 0 CA-C-N 119.799 1.181 . . . . 0.0 108.232 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 42.4 mt -50.58 -30.92 14.41 Favored 'General case' 1 N--CA 1.543 4.2 0 C-N-CA 124.099 0.96 . . . . 0.0 112.434 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 28.6 mmm180 -82.97 -45.52 14.0 Favored 'General case' 0 N--CA 1.525 3.32 0 CA-C-N 118.213 0.46 . . . . 0.0 110.169 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.68 59.34 5.26 Favored Glycine 1 N--CA 1.522 4.383 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -116.36 -52.64 2.57 Favored 'General case' 0 N--CA 1.521 3.104 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 14.0 ptm -162.92 79.86 0.48 Allowed 'General case' 0 N--CA 1.529 3.516 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 96.1 p -133.87 1.62 3.32 Favored 'General case' 0 N--CA 1.518 2.956 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 -176.035 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -113.93 -63.99 1.37 Allowed 'General case' 0 N--CA 1.532 3.64 0 CA-C-N 120.212 1.369 . . . . 0.0 111.323 -178.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 15.5 mtt180 -103.99 -41.48 5.84 Favored 'General case' 0 N--CA 1.533 3.698 0 CA-C-N 118.525 0.602 . . . . 0.0 110.639 -178.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -74.65 -5.79 45.03 Favored 'General case' 0 N--CA 1.515 2.791 0 CA-C-O 118.389 -0.815 . . . . 0.0 112.82 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.533 HD23 HG21 ' A' ' 82' ' ' ILE . 35.2 tp -93.89 -49.5 5.78 Favored 'General case' 0 N--CA 1.527 3.398 0 CA-C-N 120.064 1.302 . . . . 0.0 113.094 -177.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -44.94 -29.46 0.83 Allowed 'General case' 1 N--CA 1.546 4.351 0 CA-C-N 120.026 1.284 . . . . 0.0 114.003 -177.54 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 15.9 t30 -80.48 -38.31 30.14 Favored 'General case' 0 N--CA 1.531 3.621 0 CA-C-O 119.02 -0.514 . . . . 0.0 112.022 -178.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -53.37 -58.83 5.71 Favored 'General case' 0 N--CA 1.532 3.655 0 N-CA-C 114.077 1.139 . . . . 0.0 114.077 -177.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.95 -39.31 2.73 Favored 'General case' 0 N--CA 1.538 3.948 0 CA-C-N 118.993 0.815 . . . . 0.0 111.808 -178.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 125.11 86.05 0.64 Allowed Glycine 1 N--CA 1.523 4.477 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -149.97 104.82 3.33 Favored 'General case' 0 N--CA 1.522 3.146 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 178.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -45.31 169.07 0.03 OUTLIER Glycine 1 N--CA 1.54 5.617 0 C-N-CA 124.268 0.937 . . . . 0.0 114.389 -177.34 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.488 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 1.8 mt -80.35 -13.72 12.98 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.759 0 CA-C-N 119.055 1.427 . . . . 0.0 109.613 179.119 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.912 ' HB3' ' H72' ' E' ' 14' ' ' ' DT' . . . -70.38 -37.26 74.51 Favored 'General case' 0 N--CA 1.524 3.249 0 CA-C-N 120.025 1.284 . . . . 0.0 110.491 177.329 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 3.2 p -78.97 -44.88 21.49 Favored 'General case' 0 N--CA 1.535 3.809 0 CA-C-N 119.296 0.953 . . . . 0.0 111.563 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.533 HG21 HD23 ' A' ' 71' ' ' LEU . 8.5 pt -70.41 -14.72 18.41 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.873 0 CA-C-O 117.658 -1.163 . . . . 0.0 114.09 -176.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 66.7 p -111.68 -35.78 5.66 Favored 'General case' 0 N--CA 1.517 2.925 0 CA-C-N 120.132 1.333 . . . . 0.0 110.134 178.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -70.17 -23.92 63.06 Favored 'General case' 0 N--CA 1.529 3.515 0 CA-C-N 119.04 0.837 . . . . 0.0 109.357 176.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.26 -32.66 84.51 Favored Glycine 1 N--CA 1.522 4.38 0 N-CA-C 109.336 -1.505 . . . . 0.0 109.336 175.58 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.7 t -70.46 -34.19 72.14 Favored 'General case' 0 N--CA 1.532 3.65 0 CA-C-N 118.146 0.973 . . . . 0.0 110.467 177.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -65.83 -22.78 66.57 Favored 'General case' 0 N--CA 1.535 3.806 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.66 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.1 m -67.38 -37.18 82.76 Favored 'General case' 0 N--CA 1.531 3.624 0 CA-C-N 118.611 0.641 . . . . 0.0 110.539 179.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.0 mt -55.12 -51.79 65.32 Favored 'General case' 0 N--CA 1.525 3.31 0 C-N-CA 124.292 1.037 . . . . 0.0 112.362 -179.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 6.7 ptpt -68.46 -9.28 47.68 Favored 'General case' 0 N--CA 1.536 3.84 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 -178.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.23 -44.81 10.59 Favored 'General case' 0 N--CA 1.521 3.089 0 CA-C-N 119.675 1.125 . . . . 0.0 110.262 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.423 ' HB1' ' HD2' ' A' ' 93' ' ' PRO . . . -56.69 167.03 1.11 Allowed Pre-proline 1 N--CA 1.546 4.374 0 CA-C-O 117.861 -1.066 . . . . 0.0 112.088 179.457 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.423 ' HD2' ' HB1' ' A' ' 92' ' ' ALA . 30.3 Cg_endo -74.31 -179.93 5.23 Favored 'Trans proline' 0 C--N 1.384 2.446 0 C-N-CA 121.055 1.17 . . . . 0.0 110.951 178.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.7 t -102.23 -30.07 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.91 0 CA-C-O 117.506 -1.235 . . . . 0.0 111.683 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -63.02 -40.92 99.21 Favored 'General case' 0 N--CA 1.517 2.907 0 CA-C-N 119.952 1.251 . . . . 0.0 110.839 -177.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.403 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.0 mp -97.84 -20.08 17.73 Favored 'General case' 0 N--CA 1.512 2.649 0 C-N-CA 123.417 0.687 . . . . 0.0 111.445 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.59 -28.63 67.92 Favored 'General case' 0 N--CA 1.536 3.866 0 N-CA-C 103.798 -2.668 . . . . 0.0 103.798 169.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -56.76 -39.84 74.76 Favored 'General case' 0 N--CA 1.515 2.822 0 C-N-CA 124.179 0.991 . . . . 0.0 110.046 173.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.634 ' CH2' ' HB2' ' B' ' 529' ' ' ALA . 54.5 t90 -64.66 -34.69 78.89 Favored 'General case' 0 N--CA 1.524 3.267 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.15 -37.57 47.05 Favored 'General case' 1 N--CA 1.542 4.174 0 CA-C-N 119.279 0.945 . . . . 0.0 108.514 175.589 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -69.11 -40.34 78.41 Favored 'General case' 1 N--CA 1.539 4.021 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 175.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.44 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 2.9 mt-10 -58.78 -22.86 59.2 Favored 'General case' 1 N--CA 1.549 4.5 0 C-N-CA 123.499 0.72 . . . . 0.0 111.031 175.893 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.543 ' HB ' HD23 ' B' ' 525' ' ' LEU . 0.0 OUTLIER -116.44 -2.65 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.508 0 CA-C-O 118.193 -0.908 . . . . 0.0 112.056 -176.87 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.31 -57.36 2.28 Favored 'General case' 0 N--CA 1.515 2.814 0 N-CA-C 104.176 -2.527 . . . . 0.0 104.176 174.645 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 47.2 mt -65.35 -44.41 87.78 Favored 'General case' 0 N--CA 1.535 3.804 0 C-N-CA 124.935 1.294 . . . . 0.0 109.411 175.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 42.9 tttm 90.37 -45.39 0.02 OUTLIER 'General case' 1 N--CA 1.541 4.076 0 C-N-CA 126.454 1.902 . . . . 0.0 110.226 -179.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 38.2 p . . . . . 0 N--CA 1.526 3.373 0 CA-C-O 118.556 -0.735 . . . . 0.0 110.089 179.789 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 . . . . . 0 N--CA 1.502 2.154 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 37.3 p -72.9 145.65 86.81 Favored Pre-proline 0 N--CA 1.532 3.634 0 CA-C-O 118.025 -0.988 . . . . 0.0 111.695 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -71.63 131.18 18.2 Favored 'Trans proline' 0 C--N 1.387 2.599 0 C-N-CA 122.829 2.353 . . . . 0.0 111.576 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -86.59 133.88 33.68 Favored 'General case' 0 N--CA 1.528 3.437 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 178.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 7.8 m 74.92 111.71 0.07 Allowed 'General case' 0 N--CA 1.538 3.932 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -107.83 144.26 35.26 Favored 'General case' 0 N--CA 1.526 3.34 0 C-N-CA 123.028 0.531 . . . . 0.0 111.671 -178.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -123.65 145.66 48.79 Favored 'General case' 0 N--CA 1.524 3.263 0 C-N-CA 123.494 0.718 . . . . 0.0 110.752 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 60.2 mtt -76.97 120.7 22.45 Favored 'General case' 0 N--CA 1.526 3.33 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 178.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -131.2 129.6 41.9 Favored 'General case' 0 N--CA 1.515 2.777 0 C-N-CA 122.719 0.408 . . . . 0.0 110.444 -178.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -112.67 -47.59 3.06 Favored 'General case' 0 N--CA 1.514 2.762 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -117.99 -23.96 7.24 Favored 'General case' 0 N--CA 1.528 3.437 0 CA-C-O 118.149 -0.929 . . . . 0.0 112.329 -179.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 6.7 mmt180 -67.5 151.29 47.61 Favored 'General case' 1 N--CA 1.54 4.051 0 CA-C-N 119.632 1.105 . . . . 0.0 112.328 -179.025 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 4.3 t-80 84.48 -57.36 0.11 Allowed 'General case' 1 N--CA 1.539 4.009 0 C-N-CA 125.894 1.678 . . . . 0.0 110.173 179.135 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -79.12 116.8 19.63 Favored 'General case' 0 N--CA 1.522 3.169 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 179.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -146.64 -82.35 0.13 Allowed 'General case' 0 N--CA 1.527 3.422 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 519' ' ' TRP . . . . . 0.761 ' CE2' HD22 ' A' ' 39' ' ' LEU . 60.7 t-105 -44.33 -26.32 0.32 Allowed 'General case' 1 N--CA 1.551 4.603 0 C-N-CA 124.188 0.995 . . . . 0.0 113.236 178.216 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 520' ' ' LEU . . . . . 0.539 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.4 mm? -95.39 -32.18 13.05 Favored 'General case' 0 N--CA 1.523 3.212 0 CA-C-O 117.655 -1.164 . . . . 0.0 113.815 -172.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 521' ' ' ARG . . . . . 0.449 HH11 ' HG2' ' B' ' 521' ' ' ARG . 10.7 tpt180 -63.83 -23.28 67.29 Favored 'General case' 0 N--CA 1.529 3.495 0 N-CA-C 106.047 -1.834 . . . . 0.0 106.047 172.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . 0.505 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.7 m-85 -77.93 -42.06 34.33 Favored 'General case' 0 N--CA 1.505 2.302 0 N-CA-C 106.555 -1.646 . . . . 0.0 106.555 174.082 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 523' ' ' VAL . . . . . 0.486 HG23 ' O ' ' B' ' 519' ' ' TRP . 79.0 t -67.34 -20.27 26.41 Favored 'Isoleucine or valine' 1 N--CA 1.563 5.194 0 CA-C-O 117.665 -1.159 . . . . 0.0 112.374 179.008 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -77.15 -54.39 6.58 Favored 'General case' 0 N--CA 1.533 3.713 0 CA-C-N 120.37 1.441 . . . . 0.0 108.43 -178.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . 0.543 HD23 ' HB ' ' A' ' 103' ' ' VAL . 5.1 mp -70.96 -17.42 62.66 Favored 'General case' 0 N--CA 1.527 3.416 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 175.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 526' ' ' LEU . . . . . 0.464 ' HB2' ' HA ' ' B' ' 523' ' ' VAL . 0.6 OUTLIER -69.08 -38.32 78.95 Favored 'General case' 0 N--CA 1.516 2.828 0 N-CA-C 107.162 -1.421 . . . . 0.0 107.162 175.153 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 527' ' ' LYS . . . . . 0.712 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 8.4 tptm -68.85 -19.9 64.27 Favored 'General case' 0 N--CA 1.516 2.87 0 CA-C-O 118.029 -0.986 . . . . 0.0 111.473 176.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -66.95 -38.56 86.36 Favored 'General case' 1 N--CA 1.541 4.122 0 CA-C-N 119.798 1.181 . . . . 0.0 108.325 174.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 529' ' ' ALA . . . . . 0.634 ' HB2' ' CH2' ' A' ' 99' ' ' TRP . . . -89.37 -14.35 35.77 Favored 'General case' 0 N--CA 1.504 2.272 0 CA-C-O 118.52 -0.752 . . . . 0.0 111.012 177.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 530' ' ' TYR . . . . . 0.712 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.7 OUTLIER -75.9 -32.02 59.46 Favored 'General case' 0 N--CA 1.538 3.974 0 CA-C-N 120.098 1.317 . . . . 0.0 109.683 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -65.09 -44.24 89.5 Favored 'General case' 0 N--CA 1.534 3.755 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 177.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -90.63 -87.47 0.19 Allowed 'General case' 0 N--CA 1.518 2.928 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 177.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.8 p30 152.71 52.88 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.827 0 C-N-CA 127.406 2.282 . . . . 0.0 108.025 177.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 534' ' ' LEU . . . . . 0.403 HD22 ' CD2' ' A' ' 96' ' ' LEU . 5.6 mt -111.45 9.38 21.37 Favored 'General case' 0 N--CA 1.529 3.485 0 C-N-CA 124.718 1.207 . . . . 0.0 110.858 -178.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 535' ' ' HIS . . . . . 0.593 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 47.9 p-80 -83.82 1.66 41.98 Favored 'General case' 0 N--CA 1.517 2.879 0 C-N-CA 123.501 0.72 . . . . 0.0 109.499 175.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 536' ' ' LEU . . . . . 0.461 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 42.8 mt -95.17 -51.01 0.24 Allowed Pre-proline 0 N--CA 1.497 1.878 0 CA-C-O 116.507 -1.711 . . . . 0.0 108.488 -176.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 537' ' ' PRO . . . . . 0.461 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 4.5 Cg_exo -66.94 -33.73 31.91 Favored 'Trans proline' 0 C--N 1.394 2.943 0 N-CA-C 107.51 -1.765 . . . . 0.0 107.51 172.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.16 -44.14 93.04 Favored 'General case' 0 N--CA 1.522 3.165 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 175.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 43.3 mt -76.5 -11.38 59.87 Favored 'General case' 0 N--CA 1.535 3.804 0 CA-C-O 118.183 -0.913 . . . . 0.0 112.41 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -83.96 -0.66 52.41 Favored 'General case' 0 N--CA 1.526 3.343 0 CA-C-N 119.56 1.073 . . . . 0.0 109.428 174.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 541' ' ' LEU . . . . . 0.617 HD13 ' N ' ' B' ' 542' ' ' MET . 0.0 OUTLIER -114.46 -50.09 2.81 Favored 'General case' 0 N--CA 1.51 2.536 0 C-N-CA 124.979 1.312 . . . . 0.0 108.416 -179.312 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 542' ' ' MET . . . . . 0.617 ' N ' HD13 ' B' ' 541' ' ' LEU . 4.7 ptm -95.85 7.55 46.02 Favored 'General case' 0 N--CA 1.534 3.738 0 CA-C-O 118.266 -0.874 . . . . 0.0 112.89 -178.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 543' ' ' LEU . . . . . 0.43 ' O ' HG23 ' B' ' 544' ' ' THR . 0.2 OUTLIER -130.39 -102.14 0.3 Allowed 'General case' 0 N--CA 1.531 3.612 0 CA-C-N 120.274 1.397 . . . . 0.0 113.187 -179.576 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 544' ' ' THR . . . . . 0.605 HG23 ' HB2' ' A' ' 898' ' ' TRP . 0.3 OUTLIER 165.04 156.38 0.08 OUTLIER Pre-proline 1 N--CA 1.571 5.621 0 CA-C-N 121.425 1.921 . . . . 0.0 110.562 -178.118 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -74.11 -45.7 0.35 Allowed 'Trans proline' 0 C--N 1.388 2.615 0 C-N-CA 123.194 2.596 . . . . 0.0 110.076 177.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -56.33 -28.22 58.3 Favored 'General case' 1 N--CA 1.54 4.037 0 CA-C-O 118.759 -0.639 . . . . 0.0 112.025 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -75.61 -34.66 60.6 Favored 'General case' 0 N--CA 1.524 3.228 0 CA-C-O 117.766 -1.111 . . . . 0.0 110.927 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 9.5 ptt-85 -71.95 -28.55 63.53 Favored 'General case' 0 N--CA 1.534 3.768 0 CA-C-N 119.902 1.228 . . . . 0.0 109.909 177.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -64.29 -48.61 75.02 Favored 'General case' 1 N--CA 1.54 4.048 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 175.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -76.83 -8.91 58.22 Favored 'General case' 0 N--CA 1.52 3.064 0 CA-C-O 118.155 -0.926 . . . . 0.0 111.398 177.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 551' ' ' LEU . . . . . 0.921 HD22 ' CE3' ' A' ' 19' ' ' TRP . 4.2 tp -78.88 -40.38 32.54 Favored 'General case' 0 N--CA 1.519 3.02 0 CA-C-N 120.141 1.337 . . . . 0.0 108.143 176.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -73.85 -42.47 38.18 Favored Glycine 0 N--CA 1.513 3.797 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 3.3 m -71.38 -35.45 71.09 Favored 'General case' 0 N--CA 1.532 3.633 0 CA-C-N 117.612 0.706 . . . . 0.0 110.878 -178.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -67.54 -45.68 74.98 Favored 'General case' 0 N--CA 1.537 3.883 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 177.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 555' ' ' VAL . . . . . 0.471 HG23 ' O ' ' B' ' 551' ' ' LEU . 44.0 t -66.55 -17.87 23.22 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.059 0 CA-C-O 117.703 -1.141 . . . . 0.0 109.622 175.897 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -81.83 -40.08 23.03 Favored 'General case' 0 N--CA 1.519 2.985 0 CA-C-O 116.943 -1.503 . . . . 0.0 111.703 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 557' ' ' ILE . . . . . 0.448 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -73.02 -23.82 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.31 0 CA-C-N 122.277 2.308 . . . . 0.0 109.955 179.057 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 558' ' ' VAL . . . . . 0.554 HG11 HD11 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -85.56 -48.0 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.981 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 179.626 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -61.93 -22.46 65.63 Favored 'General case' 0 N--CA 1.532 3.626 0 CA-C-O 118.801 -0.619 . . . . 0.0 109.856 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -87.79 -29.98 20.59 Favored 'General case' 0 N--CA 1.522 3.159 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 13.5 mt -66.4 -46.58 76.1 Favored 'General case' 1 N--CA 1.542 4.144 0 CA-C-N 118.9 0.773 . . . . 0.0 109.305 178.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 33.1 mt -54.41 -27.02 33.95 Favored 'General case' 0 N--CA 1.537 3.906 0 C-N-CA 123.685 0.794 . . . . 0.0 111.762 178.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 1.9 mmm-85 -79.78 -52.07 8.39 Favored 'General case' 0 N--CA 1.526 3.348 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 59.62 72.07 0.67 Allowed Glycine 1 N--CA 1.527 4.728 0 CA-C-O 119.341 -0.699 . . . . 0.0 112.833 178.001 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -145.76 -56.31 0.3 Allowed 'General case' 0 N--CA 1.525 3.305 0 N-CA-C 108.558 -0.905 . . . . 0.0 108.558 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 46.2 mtt -144.59 61.41 1.33 Allowed 'General case' 0 N--CA 1.526 3.363 0 N-CA-C 106.174 -1.787 . . . . 0.0 106.174 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 65.0 m -131.12 4.26 4.41 Favored 'General case' 0 N--CA 1.52 3.027 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -175.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -96.03 -80.15 0.43 Allowed 'General case' 0 N--CA 1.524 3.241 0 CA-C-N 119.81 1.186 . . . . 0.0 110.28 -179.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.62 -34.3 11.0 Favored 'General case' 0 N--CA 1.539 3.996 0 CA-C-N 119.578 1.081 . . . . 0.0 111.515 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -70.45 -10.1 58.25 Favored 'General case' 0 N--CA 1.518 2.971 0 CA-C-O 118.358 -0.83 . . . . 0.0 112.793 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 571' ' ' LEU . . . . . 0.768 HD23 HD11 ' B' ' 582' ' ' ILE . 14.8 tp -89.6 -43.67 10.61 Favored 'General case' 0 N--CA 1.527 3.395 0 CA-C-N 119.767 1.167 . . . . 0.0 111.106 -178.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -38.48 -32.31 0.07 Allowed 'General case' 1 N--CA 1.558 4.939 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 -178.96 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -74.27 -46.95 38.08 Favored 'General case' 0 N--CA 1.529 3.507 0 CA-C-N 118.183 0.447 . . . . 0.0 110.278 -179.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -46.81 -45.8 20.31 Favored 'General case' 0 N--CA 1.534 3.769 0 C-N-CA 124.94 1.296 . . . . 0.0 113.891 -178.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 1.8 pp -132.39 -44.04 0.93 Allowed 'General case' 0 N--CA 1.535 3.813 0 CA-C-N 118.68 0.673 . . . . 0.0 112.067 -178.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 109.69 81.65 1.28 Allowed Glycine 1 N--CA 1.525 4.603 0 N-CA-C 110.975 -0.85 . . . . 0.0 110.975 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -111.06 -50.99 2.9 Favored 'General case' 0 N--CA 1.522 3.161 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 114.16 163.36 14.74 Favored Glycine 1 N--CA 1.528 4.787 0 N-CA-C 110.219 -1.152 . . . . 0.0 110.219 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 579' ' ' ILE . . . . . 0.481 HG21 ' N6 ' ' E' ' 4' ' ' ' DA' . 0.6 OUTLIER -82.9 -21.02 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.377 0 CA-C-N 119.54 1.67 . . . . 0.0 108.229 177.828 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 580' ' ' ALA . . . . . 0.948 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -68.88 -54.58 14.78 Favored 'General case' 0 N--CA 1.519 2.979 0 CA-C-N 119.578 1.081 . . . . 0.0 109.57 177.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 581' ' ' THR . . . . . 0.47 HG21 H2'' ' F' ' 13' ' ' ' DC' . 0.9 OUTLIER -69.26 -36.75 77.43 Favored 'General case' 1 N--CA 1.539 4.018 0 CA-C-N 118.662 0.665 . . . . 0.0 112.699 -179.026 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' B' B ' 582' ' ' ILE . . . . . 0.768 HD11 HD23 ' B' ' 571' ' ' LEU . 2.1 tt -64.3 -38.18 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.874 0 CA-C-N 118.543 0.61 . . . . 0.0 110.682 -177.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 80.6 p -98.98 -8.75 24.97 Favored 'General case' 0 N--CA 1.509 2.499 0 CA-C-O 118.604 -0.712 . . . . 0.0 111.023 178.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 10.3 ttp180 -72.95 -36.95 67.26 Favored 'General case' 0 N--CA 1.538 3.934 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 174.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -63.32 -38.44 96.44 Favored Glycine 1 N--CA 1.52 4.288 0 N-CA-C 109.075 -1.61 . . . . 0.0 109.075 176.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 19.6 m -58.75 -41.23 86.03 Favored 'General case' 1 N--CA 1.543 4.186 0 C-N-CA 123.217 0.607 . . . . 0.0 111.196 178.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -63.39 -32.47 73.9 Favored 'General case' 1 N--CA 1.539 4.009 0 C-N-CA 123.268 0.627 . . . . 0.0 111.026 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 15.7 m -68.2 -42.05 80.46 Favored 'General case' 0 N--CA 1.534 3.735 0 C-N-CA 123.059 0.544 . . . . 0.0 109.833 178.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 22.1 mt -58.9 -41.06 86.32 Favored 'General case' 0 N--CA 1.53 3.535 0 C-N-CA 124.387 1.075 . . . . 0.0 111.601 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -65.62 -27.08 68.13 Favored 'General case' 0 N--CA 1.539 3.979 0 CA-C-O 118.575 -0.726 . . . . 0.0 112.427 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -95.49 -25.0 16.4 Favored 'General case' 0 N--CA 1.523 3.195 0 CA-C-O 118.524 -0.751 . . . . 0.0 112.606 -179.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -61.59 164.31 9.78 Favored Pre-proline 0 N--CA 1.537 3.903 0 CA-C-N 119.132 0.878 . . . . 0.0 111.758 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -77.48 146.91 24.88 Favored 'Trans proline' 0 C--N 1.381 2.26 0 C-N-CA 121.751 1.634 . . . . 0.0 108.84 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 594' ' ' VAL . . . . . 0.511 ' HA ' ' HB3' ' B' ' 597' ' ' ARG . 2.8 t -80.95 -25.55 10.78 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.826 0 CA-C-O 117.514 -1.232 . . . . 0.0 112.64 -177.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -63.74 -38.42 91.02 Favored 'General case' 0 N--CA 1.519 3.003 0 CA-C-N 120.386 1.448 . . . . 0.0 110.783 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 596' ' ' LEU . . . . . 0.498 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.8 mp -99.68 -18.01 17.49 Favored 'General case' 0 N--CA 1.513 2.689 0 C-N-CA 123.958 0.903 . . . . 0.0 111.064 179.016 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . 0.511 ' HB3' ' HA ' ' B' ' 594' ' ' VAL . 0.0 OUTLIER -63.66 -32.49 73.99 Favored 'General case' 1 N--CA 1.547 4.376 0 N-CA-C 103.635 -2.728 . . . . 0.0 103.635 168.69 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -59.19 -38.77 80.65 Favored 'General case' 0 N--CA 1.521 3.116 0 C-N-CA 125.081 1.352 . . . . 0.0 110.835 174.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 599' ' ' TRP . . . . . 0.636 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 48.0 t90 -59.4 -34.48 72.5 Favored 'General case' 0 N--CA 1.535 3.776 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.464 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 75.6 mt -52.91 -39.86 63.1 Favored 'General case' 0 N--CA 1.539 3.998 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 177.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -70.73 -33.31 70.71 Favored 'General case' 0 N--CA 1.529 3.478 0 O-C-N 123.927 0.767 . . . . 0.0 109.399 176.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -61.71 -23.68 66.28 Favored 'General case' 1 N--CA 1.546 4.374 0 C-N-CA 123.473 0.709 . . . . 0.0 109.858 174.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 603' ' ' VAL . . . . . 0.508 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.1 OUTLIER -117.7 10.47 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.708 0 C-N-CA 123.766 0.826 . . . . 0.0 112.352 -177.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -115.36 -57.82 2.2 Favored 'General case' 0 N--CA 1.512 2.634 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 177.334 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 4.9 tt -54.4 -55.7 26.1 Favored 'General case' 0 N--CA 1.539 3.996 0 C-N-CA 125.281 1.432 . . . . 0.0 111.689 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -76.77 -57.93 3.57 Favored 'General case' 0 N--CA 1.529 3.521 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 7.4 t . . . . . 0 N--CA 1.528 3.432 0 CA-C-O 118.132 -0.937 . . . . 0.0 110.385 179.897 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 898' ' ' TRP . . . . . 0.605 ' HB2' HG23 ' B' ' 544' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.007 0 CA-C-O 117.495 -1.241 . . . . 0.0 109.052 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 998' ' ' TRP . . . . . 0.634 ' HB2' HG23 ' A' ' 44' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.16 0 CA-C-O 118.322 -0.846 . . . . 0.0 108.739 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.425 -9.282 2 C4'-C3'-C2' 117.254 14.054 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.429 -8.885 4 O4'-C1'-N19 119.553 14.691 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.424 -9.445 3 O4'-C1'-N19 119.053 14.066 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.413 -10.475 2 O4'-C1'-N19 119.344 14.429 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' E' E ' 5' ' ' ' DC' . . . . . 0.673 ' H41' ' HA ' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.41 -10.791 5 O4'-C1'-N19 118.883 13.854 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 O3'--C3' 1.566 10.368 5 O4'-C1'-N19 119.335 14.419 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' E' E ' 7' ' ' ' DA' . . . . . 0.674 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.395 -12.281 4 C4'-C3'-C2' 112.0 8.8 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' E' E ' 8' ' ' ' DG' . . . . . 0.674 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 5 O3'--C3' 1.551 9.223 4 O4'-C1'-N19 119.504 14.629 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.632 6 C4'-C3'-C2' 116.726 13.526 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.404 -11.401 2 O4'-C1'-N19 119.991 15.238 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.418 -9.996 4 O4'-C1'-N19 120.96 16.45 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.262 4 O4'-C1'-N19 119.241 14.301 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.427 -9.104 4 O4'-C1'-N19 118.54 13.425 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' E' E ' 14' ' ' ' DT' . . . . . 0.741 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.416 -10.218 3 O4'-C1'-N19 119.019 14.024 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' E' E ' 15' ' ' ' DA' . . . . . 0.823 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.413 -10.476 6 O4'-C1'-N19 119.466 14.583 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.416 -10.177 4 O4'-C1'-N19 120.13 15.412 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.564 10.21 2 O4'-C1'-N19 120.336 15.671 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.42 4 O4'-C1'-N19 120.349 15.686 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.206 5 O4'-C1'-N19 119.786 14.982 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.515 7.301 3 O4'-C1'-N19 119.847 15.059 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.571 3 C4'-C3'-C2' 117.046 13.846 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.404 -11.431 6 O4'-C1'-N19 119.449 14.561 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.642 3 O4'-C1'-N19 120.382 15.727 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' F' F ' 4' ' ' ' DA' . . . . . 0.558 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 5 C3'--C2' 1.415 -10.293 4 O4'-C1'-N19 120.301 15.626 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' F' F ' 5' ' ' ' DC' . . . . . 0.645 ' H41' ' HA ' ' A' ' 80' ' ' ALA . . . . . . . . 6 O3'--C3' 1.57 10.674 4 O4'-C1'-N19 118.409 13.261 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . 0.456 ' H71' " H2'" ' F' ' 5' ' ' ' DC' . . . . . . . . 6 C3'--C2' 1.402 -11.561 3 O4'-C1'-N19 119.186 14.233 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.413 -11.464 4 N19-C1'-C2' 130.051 9.907 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.416 -10.225 4 O4'-C1'-N19 119.85 15.062 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.568 10.522 3 O4'-C1'-N19 120.047 15.308 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.379 5 O4'-C1'-N19 118.534 13.418 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.179 4 O4'-C1'-N19 121.376 16.97 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.419 -9.923 3 O4'-C1'-N19 118.836 13.795 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -9.995 4 O4'-C1'-N19 119.152 14.189 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' F' F ' 14' ' ' ' DT' . . . . . 0.768 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.411 -10.675 6 O4'-C1'-N19 118.396 13.245 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' F' F ' 15' ' ' ' DA' . . . . . 0.888 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 5 C3'--C2' 1.419 -9.864 5 O4'-C1'-N19 119.822 15.028 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.417 -10.122 4 O4'-C1'-N19 120.115 15.394 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.234 2 O4'-C1'-N19 119.539 14.674 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.478 5 O4'-C1'-N19 118.528 13.41 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.416 -10.166 4 O4'-C1'-N19 119.309 14.386 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.515 7.295 4 O4'-C1'-N19 119.06 14.075 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 . . . . . 0 N--CA 1.498 1.967 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 67.5 p -128.12 99.39 25.07 Favored Pre-proline 0 N--CA 1.518 2.957 0 CA-C-O 118.628 -0.701 . . . . 0.0 110.058 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -75.29 130.09 12.67 Favored 'Trans proline' 0 C--N 1.391 2.774 0 C-N-CA 122.866 2.377 . . . . 0.0 109.785 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -82.06 127.75 33.41 Favored 'General case' 0 N--CA 1.525 3.289 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 68.0 m -151.84 123.37 7.85 Favored 'General case' 0 N--CA 1.52 3.062 0 C-N-CA 122.673 0.389 . . . . 0.0 110.103 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 64.48 135.49 0.02 OUTLIER 'General case' 0 N--CA 1.538 3.942 0 C-N-CA 124.74 1.216 . . . . 0.0 111.875 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -153.09 -45.57 0.1 Allowed 'General case' 0 N--CA 1.523 3.2 0 C-N-CA 122.743 0.417 . . . . 0.0 111.136 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 25.4 ttp 70.46 140.26 0.04 OUTLIER 'General case' 0 N--CA 1.539 3.984 0 C-N-CA 124.384 1.074 . . . . 0.0 110.364 -179.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -118.5 134.0 55.42 Favored 'General case' 0 N--CA 1.516 2.848 0 C-N-CA 123.221 0.608 . . . . 0.0 110.802 -179.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -88.89 -55.44 3.69 Favored 'General case' 0 N--CA 1.524 3.259 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -128.18 149.19 50.55 Favored 'General case' 0 N--CA 1.522 3.164 0 C-N-CA 123.465 0.706 . . . . 0.0 109.754 178.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -97.66 -46.05 6.14 Favored 'General case' 0 N--CA 1.523 3.195 0 CA-C-O 119.026 -0.512 . . . . 0.0 110.276 -179.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 24.1 t60 -100.11 124.31 45.36 Favored 'General case' 0 N--CA 1.523 3.196 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -105.81 128.62 53.84 Favored 'General case' 0 N--CA 1.52 3.066 0 C-N-CA 123.555 0.742 . . . . 0.0 109.233 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -127.75 -67.63 0.81 Allowed 'General case' 0 N--CA 1.519 2.988 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.688 ' O ' HG23 ' A' ' 23' ' ' VAL . 71.2 t-105 -52.31 -25.19 8.93 Favored 'General case' 0 N--CA 1.538 3.931 0 CA-C-O 118.083 -0.961 . . . . 0.0 111.794 177.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.52 HD22 ' N ' ' A' ' 20' ' ' LEU . 2.6 mm? -90.2 -30.76 17.38 Favored 'General case' 0 N--CA 1.53 3.573 0 CA-C-O 118.253 -0.88 . . . . 0.0 112.153 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.06 -27.47 68.92 Favored 'General case' 0 N--CA 1.534 3.735 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 173.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -88.28 -28.5 21.04 Favored 'General case' 0 N--CA 1.511 2.62 0 CA-C-O 116.359 -1.782 . . . . 0.0 108.245 174.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.688 HG23 ' O ' ' A' ' 19' ' ' TRP . 69.5 t -72.15 -22.89 21.26 Favored 'Isoleucine or valine' 1 N--CA 1.567 5.393 0 CA-C-N 122.241 2.291 . . . . 0.0 111.045 179.286 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -77.93 -51.46 10.37 Favored 'General case' 0 N--CA 1.53 3.536 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 178.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.61 -27.79 69.48 Favored 'General case' 0 N--CA 1.536 3.83 0 O-C-N 123.267 0.354 . . . . 0.0 110.609 176.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.95 -33.25 63.84 Favored 'General case' 0 N--CA 1.524 3.274 0 CA-C-O 118.214 -0.898 . . . . 0.0 109.033 177.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.421 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 13.4 mttt -68.98 -24.09 64.19 Favored 'General case' 0 N--CA 1.524 3.261 0 CA-C-O 118.378 -0.82 . . . . 0.0 110.74 177.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -73.44 -43.32 60.61 Favored 'General case' 0 N--CA 1.533 3.722 0 CA-C-N 119.166 0.894 . . . . 0.0 108.893 177.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.639 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -85.85 -8.64 57.94 Favored 'General case' 0 N--CA 1.508 2.463 0 CA-C-O 118.314 -0.85 . . . . 0.0 110.71 178.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.421 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 1.4 m-85 -80.16 -27.45 39.0 Favored 'General case' 0 N--CA 1.53 3.55 0 CA-C-N 120.032 1.287 . . . . 0.0 107.672 177.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -62.53 -48.84 77.76 Favored 'General case' 0 N--CA 1.531 3.602 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 176.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -91.82 -89.92 0.18 Allowed 'General case' 0 N--CA 1.514 2.738 0 N-CA-C 106.29 -1.744 . . . . 0.0 106.29 177.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 p30 156.18 50.16 0.0 OUTLIER 'General case' 1 N--CA 1.555 4.805 0 C-N-CA 127.489 2.316 . . . . 0.0 107.809 177.493 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.433 HD22 ' CD2' ' B' ' 596' ' ' LEU . 8.7 mt -107.05 10.36 30.29 Favored 'General case' 0 N--CA 1.53 3.525 0 C-N-CA 124.644 1.178 . . . . 0.0 110.606 -178.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.543 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 42.2 p-80 -85.06 5.14 30.8 Favored 'General case' 0 N--CA 1.507 2.38 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 175.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.803 ' HA ' HD23 ' A' ' 39' ' ' LEU . 26.5 mt -93.95 -51.47 0.26 Allowed Pre-proline 0 N--CA 1.506 2.361 0 CA-C-O 116.8 -1.572 . . . . 0.0 108.773 -176.13 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.487 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 4.0 Cg_exo -65.57 -34.5 41.96 Favored 'Trans proline' 0 C--N 1.397 3.13 0 N-CA-C 106.1 -2.308 . . . . 0.0 106.1 170.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.543 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.3 OUTLIER -63.27 -37.7 88.26 Favored 'General case' 0 N--CA 1.518 2.938 0 C-N-CA 124.078 0.951 . . . . 0.0 109.337 176.363 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.803 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -71.43 -25.89 62.51 Favored 'General case' 1 N--CA 1.551 4.579 0 CA-C-N 120.06 1.3 . . . . 0.0 110.186 176.945 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -72.36 -19.28 61.65 Favored 'General case' 0 N--CA 1.526 3.354 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.366 177.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.5 pp -101.48 -46.32 5.02 Favored 'General case' 0 N--CA 1.53 3.527 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 -177.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 6.2 ptp -105.23 -2.29 24.28 Favored 'General case' 1 N--CA 1.54 4.05 0 CA-C-O 117.994 -1.003 . . . . 0.0 112.332 -176.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.43 -87.01 0.53 Allowed 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 117.843 -1.075 . . . . 0.0 109.065 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 154.55 163.4 0.0 OUTLIER Pre-proline 1 N--CA 1.564 5.256 0 C-N-CA 125.71 1.604 . . . . 0.0 109.888 179.672 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -71.84 -36.59 6.02 Favored 'Trans proline' 0 C--N 1.383 2.36 0 C-N-CA 122.827 2.351 . . . . 0.0 108.033 173.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -70.43 -16.61 62.96 Favored 'General case' 0 N--CA 1.525 3.288 0 CA-C-O 117.928 -1.034 . . . . 0.0 110.536 176.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -71.57 -35.25 70.52 Favored 'General case' 0 N--CA 1.527 3.415 0 CA-C-N 119.629 1.104 . . . . 0.0 108.364 176.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 10.1 ptt180 -85.5 -19.23 31.51 Favored 'General case' 0 N--CA 1.527 3.405 0 CA-C-O 118.477 -0.773 . . . . 0.0 109.549 175.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -70.01 -33.0 71.45 Favored 'General case' 0 N--CA 1.534 3.727 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 174.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.444 ' HB1' ' CZ ' ' A' ' 54' ' ' ARG . . . -88.7 -31.56 18.41 Favored 'General case' 0 N--CA 1.506 2.359 0 CA-C-O 117.719 -1.134 . . . . 0.0 110.094 179.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.531 HD23 ' CE3' ' B' ' 519' ' ' TRP . 12.3 tp -70.58 -23.28 62.56 Favored 'General case' 0 N--CA 1.535 3.818 0 CA-C-N 120.856 1.662 . . . . 0.0 107.588 175.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.425 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -72.97 -69.97 1.31 Allowed Glycine 0 N--CA 1.502 3.089 0 C-N-CA 124.802 1.191 . . . . 0.0 111.181 176.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.9 m -67.09 -24.7 65.97 Favored 'General case' 1 N--CA 1.542 4.145 0 CA-C-N 117.897 0.848 . . . . 0.0 112.505 -177.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.444 ' CZ ' ' HB1' ' A' ' 50' ' ' ALA . 84.0 mtt180 -70.0 -50.51 40.87 Favored 'General case' 0 N--CA 1.527 3.401 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 176.433 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 23.1 t -63.53 -17.77 20.73 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.103 0 CA-C-O 118.073 -0.965 . . . . 0.0 110.209 175.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 57.4 mtt-85 -70.8 -56.36 6.5 Favored 'General case' 0 N--CA 1.528 3.427 0 CA-C-N 119.635 1.107 . . . . 0.0 111.09 177.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.432 ' CG2' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -68.76 -24.48 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.91 0 CA-C-N 119.871 1.214 . . . . 0.0 112.202 -177.194 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -83.26 -48.91 17.17 Favored 'Isoleucine or valine' 1 N--CA 1.55 4.531 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 -179.803 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -63.13 -21.78 66.42 Favored 'General case' 0 N--CA 1.528 3.458 0 CA-C-O 118.693 -0.67 . . . . 0.0 110.418 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -90.65 -23.76 20.68 Favored 'General case' 0 N--CA 1.529 3.505 0 CA-C-O 118.137 -0.935 . . . . 0.0 110.27 177.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 14.5 tp -81.57 -53.09 6.55 Favored 'General case' 0 N--CA 1.522 3.132 0 CA-C-N 119.515 1.052 . . . . 0.0 109.12 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 28.9 mt -48.12 -29.58 3.76 Favored 'General case' 1 N--CA 1.541 4.117 0 C-N-CA 124.99 1.316 . . . . 0.0 112.96 -178.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 19.5 mmm-85 -89.98 -42.24 11.28 Favored 'General case' 0 N--CA 1.528 3.447 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.07 85.37 0.76 Allowed Glycine 0 N--CA 1.513 3.783 0 N-CA-C 110.071 -1.211 . . . . 0.0 110.071 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -156.7 -57.56 0.09 Allowed 'General case' 0 N--CA 1.521 3.103 0 CA-C-N 117.398 0.599 . . . . 0.0 110.546 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 36.1 mtt -139.49 80.65 1.79 Allowed 'General case' 0 N--CA 1.513 2.675 0 CA-C-O 121.976 0.893 . . . . 0.0 108.939 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.3 t -135.53 2.92 3.0 Favored 'General case' 0 N--CA 1.525 3.299 0 CA-C-N 115.582 -0.735 . . . . 0.0 112.747 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -120.41 -77.88 0.59 Allowed 'General case' 0 N--CA 1.525 3.322 0 CA-C-N 119.912 1.233 . . . . 0.0 113.147 -178.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -103.53 -44.21 5.18 Favored 'General case' 0 N--CA 1.53 3.556 0 CA-C-N 119.336 0.971 . . . . 0.0 112.019 -176.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -71.81 -9.8 58.83 Favored 'General case' 0 N--CA 1.513 2.703 0 CA-C-O 117.761 -1.114 . . . . 0.0 112.553 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.597 HD23 HG21 ' A' ' 82' ' ' ILE . 24.4 tp -80.79 -52.24 7.74 Favored 'General case' 0 N--CA 1.523 3.223 0 CA-C-N 120.185 1.357 . . . . 0.0 112.273 -178.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -43.81 -30.87 0.72 Allowed 'General case' 1 N--CA 1.547 4.414 0 CA-C-N 119.353 0.979 . . . . 0.0 113.358 -177.809 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -82.28 -38.66 24.07 Favored 'General case' 0 N--CA 1.527 3.377 0 CA-C-O 118.795 -0.621 . . . . 0.0 111.551 -178.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -47.34 -56.77 6.21 Favored 'General case' 1 N--CA 1.539 4.004 0 C-N-CA 124.365 1.066 . . . . 0.0 113.155 -178.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -124.03 -43.35 2.1 Favored 'General case' 0 N--CA 1.534 3.747 0 CA-C-O 118.777 -0.63 . . . . 0.0 111.088 -179.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 128.9 76.8 0.19 Allowed Glycine 1 N--CA 1.521 4.31 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -140.12 114.22 9.02 Favored 'General case' 0 N--CA 1.52 3.072 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 178.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -47.06 171.43 0.03 OUTLIER Glycine 1 N--CA 1.542 5.748 0 C-N-CA 124.202 0.906 . . . . 0.0 113.781 -178.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.558 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.9 OUTLIER -81.7 -18.77 11.27 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.684 0 CA-C-N 118.871 1.336 . . . . 0.0 108.404 178.473 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.823 ' HB2' ' H62' ' E' ' 15' ' ' ' DA' . . . -66.39 -45.78 78.85 Favored 'General case' 0 N--CA 1.52 3.036 0 CA-C-N 119.972 1.26 . . . . 0.0 110.774 177.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.472 HG21 ' OP2' ' E' ' 14' ' ' ' DT' . 1.0 OUTLIER -72.57 -39.31 67.53 Favored 'General case' 0 N--CA 1.536 3.83 0 CA-C-N 119.335 0.97 . . . . 0.0 112.524 -178.462 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.597 HG21 HD23 ' A' ' 71' ' ' LEU . 10.1 pt -71.33 -26.03 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.968 0 CA-C-N 119.255 0.934 . . . . 0.0 111.541 -179.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 73.1 p -102.2 -4.69 25.38 Favored 'General case' 0 N--CA 1.517 2.895 0 CA-C-N 119.125 0.875 . . . . 0.0 110.228 174.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -80.13 -33.02 38.95 Favored 'General case' 0 N--CA 1.533 3.689 0 N-CA-C 105.506 -2.035 . . . . 0.0 105.506 172.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -66.57 -28.59 73.83 Favored Glycine 1 N--CA 1.524 4.543 0 CA-C-O 118.407 -1.219 . . . . 0.0 110.634 176.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 90.7 p -64.21 -21.03 66.42 Favored 'General case' 1 N--CA 1.542 4.174 0 CA-C-N 119.015 1.407 . . . . 0.0 111.339 177.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -55.33 -23.42 23.69 Favored 'General case' 1 N--CA 1.544 4.244 0 CA-C-N 118.659 0.663 . . . . 0.0 110.549 176.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.406 ' HB3' ' HG ' ' B' ' 541' ' ' LEU . 78.5 p -45.33 -48.79 13.19 Favored 'General case' 1 N--CA 1.546 4.358 0 C-N-CA 125.709 1.603 . . . . 0.0 111.743 178.213 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.9 mt -67.69 -39.67 84.41 Favored 'General case' 0 N--CA 1.522 3.169 0 C-N-CA 124.195 0.998 . . . . 0.0 110.703 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.15 0.25 55.59 Favored 'General case' 0 N--CA 1.53 3.566 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -178.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -125.04 -61.88 1.26 Allowed 'General case' 0 N--CA 1.523 3.215 0 CA-C-N 120.218 1.372 . . . . 0.0 110.449 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.1 161.6 6.89 Favored Pre-proline 1 N--CA 1.54 4.066 0 C-N-CA 123.755 0.822 . . . . 0.0 113.146 -179.467 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.444 ' O ' ' HB2' ' A' ' 97' ' ' ARG . 41.3 Cg_endo -80.73 -179.14 4.92 Favored 'Trans proline' 0 C--N 1.38 2.214 0 C-N-CA 121.886 1.724 . . . . 0.0 110.437 178.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.1 t -99.67 -27.23 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.283 0 CA-C-O 117.864 -1.065 . . . . 0.0 111.65 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -61.73 -39.81 92.86 Favored 'General case' 0 N--CA 1.522 3.144 0 CA-C-N 119.989 1.268 . . . . 0.0 111.035 -178.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.469 ' CD2' HD22 ' B' ' 534' ' ' LEU . 6.6 mp -97.77 -18.11 18.98 Favored 'General case' 0 N--CA 1.511 2.624 0 C-N-CA 123.882 0.873 . . . . 0.0 110.817 179.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -62.37 -37.66 86.58 Favored 'General case' 1 N--CA 1.544 4.256 0 N-CA-C 103.826 -2.657 . . . . 0.0 103.826 168.725 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -53.83 -39.66 65.74 Favored 'General case' 0 N--CA 1.516 2.828 0 C-N-CA 125.102 1.361 . . . . 0.0 111.289 174.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.59 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 45.7 t90 -59.54 -36.59 76.43 Favored 'General case' 0 N--CA 1.533 3.703 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 179.171 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 44.3 mt -53.11 -40.2 63.98 Favored 'General case' 1 N--CA 1.546 4.35 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 176.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -68.85 -34.4 75.42 Favored 'General case' 0 N--CA 1.526 3.332 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 176.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.402 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 2.0 mt-10 -61.45 -25.42 67.22 Favored 'General case' 1 N--CA 1.548 4.433 0 C-N-CA 123.655 0.782 . . . . 0.0 110.051 174.604 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -116.79 6.14 7.2 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.34 0 C-N-CA 124.147 0.979 . . . . 0.0 112.093 -177.197 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 29.2 mt -112.68 -61.56 1.71 Allowed 'General case' 0 N--CA 1.521 3.098 0 N-CA-C 106.091 -1.818 . . . . 0.0 106.091 176.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.4 tp -49.73 -36.83 26.92 Favored 'General case' 0 N--CA 1.535 3.794 0 C-N-CA 125.138 1.375 . . . . 0.0 111.787 178.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.2 ttmp? -94.44 -57.38 2.51 Favored 'General case' 0 N--CA 1.52 3.06 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 68.5 m . . . . . 0 N--CA 1.526 3.335 0 CA-C-O 118.114 -0.946 . . . . 0.0 109.879 -179.83 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 . . . . . 0 N--CA 1.503 2.209 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 44.5 p -153.19 142.0 14.36 Favored Pre-proline 0 N--CA 1.529 3.481 0 CA-C-O 117.485 -1.245 . . . . 0.0 111.304 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -72.15 138.37 30.55 Favored 'Trans proline' 0 C--N 1.388 2.632 0 C-N-CA 122.557 2.171 . . . . 0.0 110.948 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 65.45 132.29 0.02 OUTLIER 'General case' 0 N--CA 1.538 3.963 0 C-N-CA 124.688 1.195 . . . . 0.0 110.896 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 8.0 t -80.83 131.25 35.37 Favored 'General case' 0 N--CA 1.525 3.298 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -77.97 -48.18 16.83 Favored 'General case' 0 N--CA 1.526 3.331 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . 66.46 128.9 0.02 OUTLIER 'General case' 0 N--CA 1.535 3.823 0 C-N-CA 124.567 1.147 . . . . 0.0 110.503 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 16.8 ptt? -111.76 -34.43 6.03 Favored 'General case' 0 N--CA 1.531 3.612 0 C-N-CA 123.249 0.619 . . . . 0.0 111.676 -179.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . 68.48 124.98 0.03 OUTLIER 'General case' 0 N--CA 1.536 3.849 0 C-N-CA 124.401 1.08 . . . . 0.0 109.711 -178.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -102.82 133.56 47.68 Favored 'General case' 0 N--CA 1.526 3.34 0 C-N-CA 122.873 0.469 . . . . 0.0 110.226 -178.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -88.5 121.37 30.82 Favored 'General case' 0 N--CA 1.524 3.264 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 178.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 48.5 mtp180 -103.28 -41.68 5.97 Favored 'General case' 0 N--CA 1.525 3.285 0 CA-C-O 118.646 -0.693 . . . . 0.0 111.51 -177.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 50.8 m-70 -142.43 131.06 22.59 Favored 'General case' 0 N--CA 1.528 3.461 0 CA-C-N 118.772 0.715 . . . . 0.0 110.033 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -98.14 -72.28 0.66 Allowed 'General case' 0 N--CA 1.519 2.979 0 CA-C-O 118.588 -0.72 . . . . 0.0 110.119 -179.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -149.18 -65.81 0.22 Allowed 'General case' 0 N--CA 1.52 3.043 0 CA-C-N 118.984 0.811 . . . . 0.0 110.976 -178.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 519' ' ' TRP . . . . . 0.662 ' NE1' HD22 ' A' ' 39' ' ' LEU . 69.0 t-105 -36.37 -55.28 0.82 Allowed 'General case' 1 N--CA 1.55 4.552 0 C-N-CA 124.951 1.3 . . . . 0.0 114.033 -176.551 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 520' ' ' LEU . . . . . 0.628 HD13 ' H ' ' B' ' 520' ' ' LEU . 0.0 OUTLIER -73.85 -24.76 59.81 Favored 'General case' 0 N--CA 1.533 3.709 0 CA-C-O 117.275 -1.345 . . . . 0.0 114.518 -175.347 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.65 -25.71 64.96 Favored 'General case' 0 N--CA 1.534 3.752 0 N-CA-C 105.626 -1.99 . . . . 0.0 105.626 172.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . 0.511 ' CD2' ' HG ' ' A' ' 51' ' ' LEU . 3.2 m-85 -76.46 -35.25 58.56 Favored 'General case' 0 N--CA 1.515 2.814 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 172.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 80.1 t -69.09 -19.24 23.58 Favored 'Isoleucine or valine' 1 N--CA 1.55 4.526 0 CA-C-O 117.599 -1.191 . . . . 0.0 111.025 176.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -73.23 -52.53 13.7 Favored 'General case' 0 N--CA 1.535 3.81 0 CA-C-N 120.614 1.552 . . . . 0.0 107.985 -179.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 5.4 mp -67.98 -23.88 65.08 Favored 'General case' 0 N--CA 1.531 3.619 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 175.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.1 -34.17 77.04 Favored 'General case' 0 N--CA 1.522 3.138 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 175.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 527' ' ' LYS . . . . . 0.424 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 0.9 OUTLIER -69.31 -26.84 64.93 Favored 'General case' 0 N--CA 1.518 2.958 0 CA-C-O 118.297 -0.858 . . . . 0.0 110.385 176.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -67.98 -37.16 81.17 Favored 'General case' 0 N--CA 1.534 3.758 0 CA-C-N 119.125 0.875 . . . . 0.0 109.16 176.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 529' ' ' ALA . . . . . 0.59 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -91.62 -8.74 46.4 Favored 'General case' 0 CA--C 1.582 2.187 0 CA-C-O 118.369 -0.825 . . . . 0.0 110.476 178.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 530' ' ' TYR . . . . . 0.424 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.1 OUTLIER -81.11 -33.62 33.16 Favored 'General case' 0 N--CA 1.533 3.716 0 CA-C-N 120.468 1.486 . . . . 0.0 108.977 179.635 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -62.14 -44.43 96.65 Favored 'General case' 0 N--CA 1.535 3.808 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 177.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 -89.74 -86.72 0.19 Allowed 'General case' 0 N--CA 1.522 3.148 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 177.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.9 p30 151.7 48.79 0.0 OUTLIER 'General case' 1 N--CA 1.559 5.023 0 C-N-CA 127.426 2.291 . . . . 0.0 108.688 177.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 534' ' ' LEU . . . . . 0.469 HD22 ' CD2' ' A' ' 96' ' ' LEU . 6.5 mt -108.45 12.54 26.13 Favored 'General case' 0 N--CA 1.524 3.273 0 C-N-CA 124.665 1.186 . . . . 0.0 110.276 -179.303 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 535' ' ' HIS . . . . . 0.55 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 46.9 p-80 -83.93 4.38 29.88 Favored 'General case' 0 N--CA 1.516 2.829 0 C-N-CA 123.595 0.758 . . . . 0.0 109.076 175.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 536' ' ' LEU . . . . . 0.464 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 35.5 mt -97.12 -49.61 0.23 Allowed Pre-proline 0 N--CA 1.506 2.365 0 CA-C-O 116.526 -1.702 . . . . 0.0 109.125 -175.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 537' ' ' PRO . . . . . 0.464 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 2.9 Cg_exo -67.69 -34.38 25.12 Favored 'Trans proline' 0 C--N 1.394 2.963 0 C-N-CA 122.386 2.057 . . . . 0.0 107.417 171.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.78 -47.12 79.3 Favored 'General case' 0 N--CA 1.523 3.185 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 176.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 76.4 mt -77.67 -6.59 54.39 Favored 'General case' 0 N--CA 1.533 3.71 0 CA-C-O 118.702 -0.666 . . . . 0.0 111.228 178.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -63.76 -30.65 71.73 Favored 'General case' 0 N--CA 1.532 3.648 0 CA-C-N 119.584 1.084 . . . . 0.0 109.52 176.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 541' ' ' LEU . . . . . 0.406 ' HG ' ' HB3' ' A' ' 88' ' ' SER . 3.4 tm? -104.31 -50.9 3.23 Favored 'General case' 0 N--CA 1.509 2.489 0 CA-C-O 118.63 -0.7 . . . . 0.0 109.942 179.07 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 9.9 ptp -82.51 17.91 1.64 Allowed 'General case' 0 N--CA 1.533 3.698 0 CA-C-N 118.938 0.79 . . . . 0.0 112.859 -177.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 7.6 tp -138.85 -73.71 0.39 Allowed 'General case' 0 N--CA 1.528 3.428 0 CA-C-N 119.674 1.124 . . . . 0.0 111.542 174.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 66.5 p 116.73 152.82 0.0 OUTLIER Pre-proline 1 N--CA 1.571 5.591 0 C-N-CA 127.947 2.499 . . . . 0.0 111.02 -179.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -69.57 -40.91 5.03 Favored 'Trans proline' 0 C--N 1.396 3.052 0 C-N-CA 123.027 2.485 . . . . 0.0 110.04 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -57.9 -29.47 65.11 Favored 'General case' 1 N--CA 1.543 4.195 0 C-N-CA 123.422 0.689 . . . . 0.0 110.773 178.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -75.05 -36.54 61.82 Favored 'General case' 0 N--CA 1.521 3.116 0 CA-C-O 118.279 -0.867 . . . . 0.0 108.744 177.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 548' ' ' ARG . . . . . 0.482 ' HA ' HD12 ' B' ' 551' ' ' LEU . 35.3 ptt180 -83.26 3.7 30.13 Favored 'General case' 0 N--CA 1.531 3.623 0 CA-C-N 118.993 0.815 . . . . 0.0 111.036 174.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -85.09 -48.96 8.67 Favored 'General case' 0 N--CA 1.519 2.99 0 N-CA-C 102.663 -3.088 . . . . 0.0 102.663 170.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -77.52 -11.91 59.91 Favored 'General case' 0 N--CA 1.504 2.253 0 CA-C-O 116.947 -1.501 . . . . 0.0 112.357 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 551' ' ' LEU . . . . . 0.679 HD11 ' N ' ' A' ' 19' ' ' TRP . 0.0 OUTLIER -75.32 -39.02 59.91 Favored 'General case' 1 N--CA 1.54 4.032 0 CA-C-N 121.559 1.982 . . . . 0.0 106.457 174.682 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' B' B ' 552' ' ' GLY . . . . . 0.667 ' N ' HD13 ' B' ' 551' ' ' LEU . . . -66.6 -56.23 14.16 Favored Glycine 0 N--CA 1.495 2.629 0 N-CA-C 109.021 -1.632 . . . . 0.0 109.021 -178.058 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.6 m -64.57 -30.52 71.55 Favored 'General case' 1 N--CA 1.542 4.141 0 CA-C-O 118.495 -0.764 . . . . 0.0 112.302 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -65.97 -52.93 45.17 Favored 'General case' 1 N--CA 1.545 4.306 0 N-CA-C 107.184 -1.413 . . . . 0.0 107.184 177.126 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 555' ' ' VAL . . . . . 0.502 HG23 ' O ' ' B' ' 551' ' ' LEU . 28.1 t -64.15 -18.51 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.738 0 CA-C-O 117.88 -1.057 . . . . 0.0 110.176 177.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -79.42 -43.6 23.04 Favored 'General case' 0 N--CA 1.529 3.498 0 CA-C-O 117.554 -1.213 . . . . 0.0 111.499 179.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 557' ' ' ILE . . . . . 0.467 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -73.46 -23.89 19.89 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.248 0 CA-C-N 121.017 1.735 . . . . 0.0 110.678 -179.701 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 558' ' ' VAL . . . . . 0.467 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -84.33 -50.62 14.87 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.809 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -179.444 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -61.34 -23.54 65.82 Favored 'General case' 0 N--CA 1.532 3.646 0 CA-C-O 118.797 -0.621 . . . . 0.0 110.049 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -96.89 -20.35 18.2 Favored 'General case' 0 N--CA 1.525 3.321 0 CA-C-O 117.541 -1.218 . . . . 0.0 111.757 179.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 3.3 pp -88.8 -33.39 17.44 Favored 'General case' 0 N--CA 1.538 3.961 0 CA-C-N 120.59 1.541 . . . . 0.0 110.102 179.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 1.1 tt -58.54 -36.57 74.07 Favored 'General case' 0 N--CA 1.537 3.906 0 C-N-CA 124.15 0.98 . . . . 0.0 110.301 178.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 11.8 mmm-85 -74.36 -52.25 12.72 Favored 'General case' 0 N--CA 1.532 3.644 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 70.76 89.09 0.1 OUTLIER Glycine 0 N--CA 1.513 3.81 0 CA-C-O 119.512 -0.604 . . . . 0.0 112.991 176.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -148.25 -54.23 0.2 Allowed 'General case' 0 N--CA 1.525 3.303 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 14.5 ptm -148.2 61.87 1.11 Allowed 'General case' 0 N--CA 1.525 3.297 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 6.8 t -123.84 1.47 8.72 Favored 'General case' 0 N--CA 1.522 3.153 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -88.17 -71.56 0.57 Allowed 'General case' 0 N--CA 1.522 3.131 0 CA-C-N 119.754 1.161 . . . . 0.0 110.67 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.53 -19.89 12.38 Favored 'General case' 0 N--CA 1.536 3.845 0 CA-C-O 118.338 -0.839 . . . . 0.0 112.36 -179.214 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -83.98 -7.7 59.34 Favored 'General case' 0 N--CA 1.518 2.957 0 CA-C-N 119.245 0.929 . . . . 0.0 113.251 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 571' ' ' LEU . . . . . 0.607 HD23 HD11 ' B' ' 582' ' ' ILE . 60.6 tp -89.69 -50.02 6.31 Favored 'General case' 0 N--CA 1.535 3.811 0 CA-C-N 120.313 1.415 . . . . 0.0 113.635 -177.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -36.18 -33.56 0.04 OUTLIER 'General case' 1 N--CA 1.548 4.475 0 N-CA-C 116.173 1.916 . . . . 0.0 116.173 -175.03 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -66.21 -44.63 83.32 Favored 'General case' 1 N--CA 1.543 4.186 0 CA-C-N 118.724 0.693 . . . . 0.0 109.816 -179.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -62.78 -43.46 98.75 Favored 'General case' 0 N--CA 1.523 3.192 0 C-N-CA 124.77 1.228 . . . . 0.0 112.282 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 51.0 mt -102.68 -64.45 1.07 Allowed 'General case' 0 N--CA 1.533 3.685 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -176.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 101.86 45.43 1.77 Allowed Glycine 0 N--CA 1.512 3.745 0 N-CA-C 108.494 -1.843 . . . . 0.0 108.494 -176.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -93.44 -37.08 12.15 Favored 'General case' 0 N--CA 1.527 3.41 0 CA-C-N 117.475 0.637 . . . . 0.0 110.329 179.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 109.48 164.56 20.01 Favored Glycine 1 N--CA 1.523 4.456 0 N-CA-C 110.0 -1.24 . . . . 0.0 110.0 -178.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 579' ' ' ILE . . . . . 0.445 ' HA ' HG22 ' B' ' 582' ' ' ILE . 1.9 mt -84.69 -16.88 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.719 0 CA-C-N 119.227 1.514 . . . . 0.0 108.36 177.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 580' ' ' ALA . . . . . 0.888 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -69.66 -39.56 76.99 Favored 'General case' 0 N--CA 1.524 3.249 0 CA-C-N 119.874 1.215 . . . . 0.0 109.159 176.113 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 2.6 p -74.78 -40.55 61.1 Favored 'General case' 0 N--CA 1.537 3.879 0 CA-C-N 118.449 0.568 . . . . 0.0 111.527 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 582' ' ' ILE . . . . . 0.607 HD11 HD23 ' B' ' 571' ' ' LEU . 2.8 tt -66.12 -37.35 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.518 0 C-N-CA 123.243 0.617 . . . . 0.0 112.336 -175.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 80.5 p -95.92 -33.12 12.3 Favored 'General case' 0 N--CA 1.515 2.812 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.221 -178.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -71.31 -21.57 62.05 Favored 'General case' 0 N--CA 1.529 3.509 0 CA-C-N 119.188 0.904 . . . . 0.0 109.333 176.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -69.37 -33.31 72.67 Favored Glycine 1 N--CA 1.517 4.052 0 N-CA-C 108.784 -1.726 . . . . 0.0 108.784 174.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 37.5 m -63.5 -39.34 94.2 Favored 'General case' 1 N--CA 1.544 4.234 0 CA-C-N 118.376 1.088 . . . . 0.0 110.166 177.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -60.13 -27.88 67.42 Favored 'General case' 1 N--CA 1.543 4.217 0 C-N-CA 123.614 0.766 . . . . 0.0 111.314 178.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 73.7 m -58.88 -44.73 91.2 Favored 'General case' 0 N--CA 1.537 3.914 0 C-N-CA 123.771 0.828 . . . . 0.0 111.57 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 33.5 mt -57.44 -42.65 82.87 Favored 'General case' 0 N--CA 1.528 3.457 0 C-N-CA 123.862 0.865 . . . . 0.0 111.127 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.54 -26.38 68.54 Favored 'General case' 1 N--CA 1.541 4.084 0 CA-C-O 118.638 -0.696 . . . . 0.0 111.889 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -76.54 -42.84 41.56 Favored 'General case' 0 N--CA 1.518 2.949 0 CA-C-N 118.598 0.635 . . . . 0.0 110.522 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -62.64 159.54 42.38 Favored Pre-proline 0 N--CA 1.536 3.844 0 CA-C-O 118.386 -0.816 . . . . 0.0 111.863 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -78.83 -176.46 3.3 Favored 'Trans proline' 0 C--N 1.377 2.059 0 C-N-CA 121.63 1.554 . . . . 0.0 110.981 178.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.4 t -96.68 -29.86 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.95 0 CA-C-O 117.8 -1.095 . . . . 0.0 111.099 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -65.83 -38.25 88.39 Favored 'General case' 0 N--CA 1.515 2.808 0 CA-C-N 119.63 1.104 . . . . 0.0 110.03 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 596' ' ' LEU . . . . . 0.433 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.7 mp -98.51 -18.33 18.24 Favored 'General case' 0 N--CA 1.511 2.579 0 C-N-CA 123.776 0.831 . . . . 0.0 111.27 178.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.52 -30.14 69.73 Favored 'General case' 0 N--CA 1.535 3.783 0 N-CA-C 103.124 -2.917 . . . . 0.0 103.124 167.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -55.34 -38.87 69.31 Favored 'General case' 0 N--CA 1.518 2.942 0 C-N-CA 123.859 0.863 . . . . 0.0 110.174 173.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 599' ' ' TRP . . . . . 0.639 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 50.5 t90 -62.17 -37.39 85.04 Favored 'General case' 0 N--CA 1.527 3.388 0 CA-C-O 117.75 -1.119 . . . . 0.0 108.168 178.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 11.2 mp -54.19 -38.17 65.33 Favored 'General case' 1 N--CA 1.542 4.165 0 CA-C-N 119.226 0.921 . . . . 0.0 108.638 176.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -71.1 -32.53 69.15 Favored 'General case' 0 N--CA 1.531 3.624 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 176.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 602' ' ' GLU . . . . . 0.426 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 2.2 mm-40 -64.4 -22.17 66.87 Favored 'General case' 1 N--CA 1.544 4.265 0 C-N-CA 123.687 0.795 . . . . 0.0 110.133 174.899 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 603' ' ' VAL . . . . . 0.562 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.1 OUTLIER -121.05 3.45 6.51 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.495 0 C-N-CA 123.807 0.843 . . . . 0.0 112.295 -177.521 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -110.91 -56.95 2.3 Favored 'General case' 0 N--CA 1.514 2.761 0 N-CA-C 105.774 -1.936 . . . . 0.0 105.774 176.307 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 2.5 tt -63.42 -57.56 9.89 Favored 'General case' 0 N--CA 1.532 3.659 0 C-N-CA 124.901 1.281 . . . . 0.0 111.486 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 68.9 tttt -66.75 -63.1 1.14 Allowed 'General case' 0 N--CA 1.536 3.832 0 C-N-CA 122.92 0.488 . . . . 0.0 110.963 -177.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 37.1 p . . . . . 0 N--CA 1.525 3.322 0 CA-C-O 118.477 -0.773 . . . . 0.0 110.149 179.972 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 898' ' ' TRP . . . . . 0.406 ' CZ2' HG22 ' A' ' 81' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.22 0 N-CA-C 108.874 -0.788 . . . . 0.0 108.874 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.504 2.251 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.424 -9.413 3 O4'-C1'-N19 119.796 14.995 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.914 4 O4'-C1'-N19 119.74 14.925 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.855 3 O4'-C1'-N19 119.723 14.904 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . 0.493 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 6 C3'--C2' 1.414 -10.444 5 O4'-C1'-N19 120.072 15.339 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' E' E ' 5' ' ' ' DC' . . . . . 0.478 ' H41' ' HA ' ' B' ' 580' ' ' ALA . . . . . . . . 6 O3'--C3' 1.576 11.168 4 O4'-C1'-N19 118.589 13.486 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.411 -10.744 5 O4'-C1'-N19 119.691 14.864 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' E' E ' 7' ' ' ' DA' . . . . . 0.663 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.394 -12.399 3 C4'-C3'-C2' 113.165 9.965 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' E' E ' 8' ' ' ' DG' . . . . . 0.663 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.421 -9.661 4 O4'-C1'-N19 119.78 14.975 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.569 10.594 4 C4'-C3'-C2' 117.064 13.864 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.566 10.415 3 O4'-C1'-N19 119.271 14.338 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.384 4 O4'-C1'-N19 120.961 16.451 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.466 5 O4'-C1'-N19 119.25 14.312 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.413 -10.549 3 O4'-C1'-N19 119.868 15.084 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' E' E ' 14' ' ' ' DT' . . . . . 0.862 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.418 -9.959 6 O4'-C1'-N19 119.053 14.066 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' E' E ' 15' ' ' ' DA' . . . . . 0.76 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 5 C3'--C2' 1.427 -9.084 4 O4'-C1'-N19 119.621 14.776 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' E' E ' 16' ' ' ' DG' . . . . . 0.447 ' O6 ' HG22 ' A' ' 79' ' ' ILE . . . . . . . . 5 C3'--C2' 1.416 -10.17 4 O4'-C1'-N19 119.4 14.5 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.565 10.276 3 O4'-C1'-N19 120.019 15.274 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.609 5 O4'-C1'-N19 120.557 15.946 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.138 5 O4'-C1'-N19 119.871 15.089 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.512 7.046 3 O4'-C1'-N19 118.847 13.808 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.564 10.227 3 C4'-C3'-C2' 117.018 13.818 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.413 -10.543 3 O4'-C1'-N19 119.886 15.108 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.411 -10.676 5 O4'-C1'-N19 120.288 15.61 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' F' F ' 4' ' ' ' DA' . . . . . 0.613 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 5 C3'--C2' 1.415 -10.257 4 O4'-C1'-N19 120.466 15.833 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' F' F ' 5' ' ' ' DC' . . . . . 0.588 ' H41' ' HA ' ' A' ' 80' ' ' ALA . . . . . . . . 5 O3'--C3' 1.575 11.041 4 O4'-C1'-N19 118.876 13.845 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.403 -11.497 6 O4'-C1'-N19 119.47 14.587 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.424 -10.367 3 C4'-C3'-C2' 113.576 10.376 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.416 -10.201 5 O4'-C1'-N19 119.949 15.187 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.574 10.978 4 O4'-C1'-N19 118.771 13.713 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.684 3 O4'-C1'-N19 119.0 14.0 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.765 3 O4'-C1'-N19 119.946 15.183 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.525 4 O4'-C1'-N19 119.434 14.542 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.414 -10.377 4 O4'-C1'-N19 119.382 14.477 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' F' F ' 14' ' ' ' DT' . . . . . 0.712 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 O3'--C3' 1.565 10.271 3 C4'-C3'-C2' 117.078 13.878 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' F' F ' 15' ' ' ' DA' . . . . . 0.778 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.416 -10.16 6 O4'-C1'-N19 119.765 14.956 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.419 -9.893 4 O4'-C1'-N19 119.608 14.76 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.423 -9.516 3 O4'-C1'-N19 119.062 14.078 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.417 -10.071 4 O4'-C1'-N19 119.976 15.22 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -10.995 4 O4'-C1'-N19 120.347 15.684 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 C4'--C3' 1.599 7.137 5 O4'-C1'-N19 120.375 15.718 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 . . . . . 0 N--CA 1.501 2.102 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 40.8 p -114.52 125.57 29.01 Favored Pre-proline 0 N--CA 1.524 3.261 0 CA-C-O 117.346 -1.311 . . . . 0.0 109.773 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -74.35 138.5 24.83 Favored 'Trans proline' 0 C--N 1.388 2.628 0 C-N-CA 122.606 2.204 . . . . 0.0 111.231 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -110.63 138.48 46.96 Favored 'General case' 0 N--CA 1.529 3.501 0 C-N-CA 123.327 0.651 . . . . 0.0 110.039 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.2 t -95.37 139.01 32.26 Favored 'General case' 0 N--CA 1.527 3.392 0 C-N-CA 123.058 0.543 . . . . 0.0 111.16 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -135.43 131.83 36.7 Favored 'General case' 0 N--CA 1.528 3.44 0 C-N-CA 123.665 0.786 . . . . 0.0 109.364 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -96.9 -69.68 0.75 Allowed 'General case' 0 N--CA 1.526 3.362 0 CA-C-O 118.914 -0.565 . . . . 0.0 111.326 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 16.3 ttt -144.74 -58.01 0.36 Allowed 'General case' 0 N--CA 1.527 3.383 0 CA-C-N 118.683 0.674 . . . . 0.0 110.079 -178.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -117.52 149.51 40.5 Favored 'General case' 0 N--CA 1.521 3.118 0 C-N-CA 123.031 0.532 . . . . 0.0 111.856 -179.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 66.24 125.34 0.02 OUTLIER 'General case' 0 N--CA 1.532 3.635 0 C-N-CA 124.642 1.177 . . . . 0.0 110.951 178.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -127.2 -50.12 1.43 Allowed 'General case' 0 N--CA 1.522 3.164 0 C-N-CA 123.691 0.796 . . . . 0.0 108.975 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.73 119.5 20.42 Favored 'General case' 0 N--CA 1.522 3.151 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 179.1 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -113.02 72.93 0.79 Allowed 'General case' 0 N--CA 1.524 3.252 0 CA-C-O 121.536 0.684 . . . . 0.0 109.945 -177.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 6.9 mp0 -112.9 97.98 6.89 Favored 'General case' 0 N--CA 1.523 3.19 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -136.28 -84.63 0.36 Allowed 'General case' 0 N--CA 1.528 3.426 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.587 ' CZ3' HD22 ' B' ' 551' ' ' LEU . 72.5 t-105 -52.99 -46.98 68.54 Favored 'General case' 0 N--CA 1.539 4.0 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 175.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.419 HD22 ' N ' ' A' ' 20' ' ' LEU . 3.6 mm? -74.15 -27.38 60.81 Favored 'General case' 0 N--CA 1.514 2.736 0 O-C-N 125.339 1.649 . . . . 0.0 112.087 -177.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.0 ttt180 -56.95 -29.51 63.22 Favored 'General case' 1 N--CA 1.544 4.242 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 173.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.48 ' O ' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -83.57 -38.71 21.31 Favored 'General case' 0 CA--C 1.586 2.338 0 CA-C-O 116.387 -1.768 . . . . 0.0 109.003 173.733 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.558 HG11 ' NE2' ' B' ' 535' ' ' HIS . 19.2 t -70.15 -27.53 32.64 Favored 'Isoleucine or valine' 1 N--CA 1.574 5.73 0 CA-C-N 121.042 1.746 . . . . 0.0 112.985 -175.185 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -73.91 -50.52 19.75 Favored 'General case' 0 N--CA 1.535 3.814 0 CA-C-N 119.994 1.27 . . . . 0.0 108.258 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.2 mp -72.51 -15.62 61.79 Favored 'General case' 0 N--CA 1.528 3.447 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 175.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -70.44 -35.2 73.22 Favored 'General case' 0 N--CA 1.518 2.951 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 174.611 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.449 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 29.6 ttmt -64.03 -24.19 67.62 Favored 'General case' 0 N--CA 1.525 3.302 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.485 176.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -69.55 -41.23 76.17 Favored 'General case' 0 N--CA 1.534 3.766 0 CA-C-N 119.282 0.946 . . . . 0.0 108.583 176.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.631 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -87.21 -7.99 57.34 Favored 'General case' 0 N--CA 1.504 2.263 0 CA-C-O 118.59 -0.719 . . . . 0.0 110.738 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.449 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -84.1 -31.83 25.06 Favored 'General case' 0 N--CA 1.534 3.743 0 CA-C-N 120.433 1.47 . . . . 0.0 109.059 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -64.5 -41.33 96.5 Favored 'General case' 0 N--CA 1.531 3.607 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 51.6 m-80 -92.75 -90.78 0.18 Allowed 'General case' 0 N--CA 1.514 2.766 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 177.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.0 p30 155.19 51.16 0.0 OUTLIER 'General case' 1 N--CA 1.555 4.782 0 C-N-CA 127.381 2.272 . . . . 0.0 108.222 177.19 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.529 HD22 ' CD2' ' B' ' 596' ' ' LEU . 7.2 mt -110.08 12.21 23.61 Favored 'General case' 0 N--CA 1.522 3.149 0 C-N-CA 124.209 1.003 . . . . 0.0 110.459 -179.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.53 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 50.0 p-80 -84.47 5.82 25.92 Favored 'General case' 0 N--CA 1.515 2.781 0 C-N-CA 123.723 0.809 . . . . 0.0 108.854 174.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.59 ' HA ' HD23 ' A' ' 39' ' ' LEU . 31.7 mt -96.09 -52.39 0.23 Allowed Pre-proline 0 N--CA 1.502 2.151 0 CA-C-O 117.058 -1.448 . . . . 0.0 108.746 -176.199 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.463 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 6.1 Cg_exo -66.41 -32.04 41.36 Favored 'Trans proline' 0 C--N 1.391 2.799 0 N-CA-C 107.106 -1.921 . . . . 0.0 107.106 170.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.53 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 1.0 OUTLIER -65.58 -41.64 92.66 Favored 'General case' 0 N--CA 1.52 3.034 0 CA-C-O 118.212 -0.899 . . . . 0.0 108.739 176.79 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.59 HD23 ' HA ' ' A' ' 36' ' ' LEU 0.274 0.1 OUTLIER -78.28 -8.58 58.56 Favored 'General case' 1 N--CA 1.552 4.653 0 CA-C-N 119.612 1.096 . . . . 0.0 111.448 177.272 . . . . . . . . 5 4 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -90.22 8.57 32.43 Favored 'General case' 0 N--CA 1.524 3.245 0 CA-C-N 118.727 0.694 . . . . 0.0 109.618 174.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.57 HD11 HG11 ' B' ' 558' ' ' VAL . 0.3 OUTLIER -125.47 -56.32 1.51 Allowed 'General case' 0 N--CA 1.513 2.723 0 C-N-CA 124.048 0.939 . . . . 0.0 109.629 -178.748 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.566 ' N ' HD13 ' A' ' 41' ' ' LEU . 15.7 ptp -98.06 7.72 45.88 Favored 'General case' 0 N--CA 1.538 3.943 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -176.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.47 ' O ' HG23 ' A' ' 44' ' ' THR . 1.8 mp -120.63 -71.36 0.74 Allowed 'General case' 0 N--CA 1.514 2.726 0 CA-C-O 117.333 -1.318 . . . . 0.0 110.229 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.57 HG23 ' HB2' ' B' ' 998' ' ' TRP . 24.9 p 128.41 161.75 0.0 OUTLIER Pre-proline 1 N--CA 1.579 6.014 0 C-N-CA 127.533 2.333 . . . . 0.0 109.071 -179.194 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -68.16 -33.36 25.07 Favored 'Trans proline' 0 C--N 1.392 2.82 0 C-N-CA 121.934 1.756 . . . . 0.0 108.929 176.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -64.56 -22.78 67.06 Favored 'General case' 0 N--CA 1.532 3.644 0 CA-C-O 118.278 -0.867 . . . . 0.0 110.561 176.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -71.26 -37.11 71.93 Favored 'General case' 0 N--CA 1.524 3.245 0 CA-C-O 117.745 -1.121 . . . . 0.0 109.658 178.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.9 ptt180 -81.85 -20.31 39.21 Favored 'General case' 1 N--CA 1.541 4.113 0 CA-C-N 119.589 1.086 . . . . 0.0 108.896 174.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -71.99 -26.3 62.18 Favored 'General case' 0 N--CA 1.523 3.217 0 N-CA-C 107.559 -1.275 . . . . 0.0 107.559 174.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.02 -35.48 16.35 Favored 'General case' 0 N--CA 1.504 2.268 0 CA-C-O 117.365 -1.302 . . . . 0.0 110.114 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.492 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 29.5 tp -74.27 -19.98 60.31 Favored 'General case' 1 N--CA 1.541 4.1 0 CA-C-N 120.646 1.566 . . . . 0.0 106.94 173.689 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.41 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -69.01 -70.24 1.21 Allowed Glycine 0 N--CA 1.497 2.742 0 C-N-CA 125.346 1.45 . . . . 0.0 110.254 177.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.4 t -72.93 -22.14 60.77 Favored 'General case' 0 N--CA 1.526 3.368 0 CA-C-O 117.628 -1.177 . . . . 0.0 113.019 -179.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 12.2 mtt180 -70.57 -51.02 31.27 Favored 'General case' 0 N--CA 1.531 3.604 0 CA-C-N 120.073 1.306 . . . . 0.0 108.035 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 20.3 t -65.66 -18.75 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.539 3.978 0 CA-C-O 117.875 -1.059 . . . . 0.0 109.39 175.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.4 mmt180 -75.71 -45.19 38.13 Favored 'General case' 0 N--CA 1.525 3.325 0 CA-C-O 117.376 -1.297 . . . . 0.0 111.807 178.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.424 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -73.6 -25.62 21.05 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.261 0 CA-C-N 121.26 1.846 . . . . 0.0 111.137 -178.371 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.517 HG11 HD11 ' B' ' 541' ' ' LEU . 0.0 OUTLIER -85.23 -47.16 17.08 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.108 0 CA-C-N 120.128 1.331 . . . . 0.0 107.536 -179.946 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -62.03 -24.28 66.97 Favored 'General case' 0 N--CA 1.534 3.741 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 177.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -92.73 -21.23 20.09 Favored 'General case' 0 N--CA 1.518 2.929 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.373 177.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 12.6 tp -74.75 -56.47 4.76 Favored 'General case' 0 N--CA 1.526 3.337 0 CA-C-N 120.091 1.314 . . . . 0.0 109.395 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 57.2 mt -51.15 -27.99 9.94 Favored 'General case' 1 N--CA 1.544 4.233 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -178.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.72 -57.45 2.98 Favored 'General case' 0 N--CA 1.524 3.261 0 N-CA-C 106.91 -1.515 . . . . 0.0 106.91 178.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 66.76 64.92 3.03 Favored Glycine 1 N--CA 1.517 4.094 0 C-N-CA 124.0 0.809 . . . . 0.0 112.698 178.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -115.17 -54.93 2.52 Favored 'General case' 0 N--CA 1.524 3.257 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 11.8 ptm -147.01 65.72 1.16 Allowed 'General case' 0 N--CA 1.528 3.463 0 N-CA-C 106.39 -1.707 . . . . 0.0 106.39 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.415 ' HA ' ' HB2' ' A' ' 71' ' ' LEU . 14.8 m -124.03 6.49 8.6 Favored 'General case' 0 N--CA 1.524 3.233 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -174.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -114.91 -70.09 0.82 Allowed 'General case' 0 N--CA 1.527 3.418 0 CA-C-N 119.61 1.096 . . . . 0.0 111.502 -179.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 8.6 mtt180 -91.44 -43.6 9.62 Favored 'General case' 0 N--CA 1.533 3.706 0 CA-C-N 118.591 0.632 . . . . 0.0 111.536 -177.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -77.07 -13.59 59.93 Favored 'General case' 0 N--CA 1.519 3.011 0 CA-C-O 118.321 -0.847 . . . . 0.0 112.925 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.547 HD23 HG21 ' A' ' 82' ' ' ILE . 24.4 tp -81.41 -50.46 9.43 Favored 'General case' 0 N--CA 1.523 3.198 0 CA-C-N 119.767 1.167 . . . . 0.0 111.522 -178.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.92 -31.79 1.39 Allowed 'General case' 1 N--CA 1.545 4.289 0 CA-C-N 119.57 1.077 . . . . 0.0 113.666 -179.171 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -77.86 -38.9 44.99 Favored 'General case' 0 N--CA 1.527 3.423 0 CA-C-O 119.232 -0.413 . . . . 0.0 111.217 -178.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -51.09 -59.19 4.44 Favored 'General case' 0 N--CA 1.529 3.521 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -177.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -119.08 -36.86 3.31 Favored 'General case' 0 N--CA 1.537 3.893 0 CA-C-O 118.455 -0.783 . . . . 0.0 112.075 -178.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 119.95 77.71 0.52 Allowed Glycine 1 N--CA 1.525 4.593 0 N-CA-C 110.76 -0.936 . . . . 0.0 110.76 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -146.0 100.83 3.45 Favored 'General case' 0 N--CA 1.524 3.242 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 178.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -40.18 170.48 0.01 OUTLIER Glycine 1 N--CA 1.54 5.624 0 C-N-CA 125.351 1.453 . . . . 0.0 116.094 -176.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.613 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.4 OUTLIER -77.14 -20.81 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.04 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 178.513 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.862 ' HB3' ' H72' ' E' ' 14' ' ' ' DT' . . . -66.94 -50.26 62.93 Favored 'General case' 0 N--CA 1.516 2.839 0 CA-C-O 117.944 -1.027 . . . . 0.0 109.302 177.367 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.416 HG22 ' CZ2' ' A' ' 898' ' ' TRP . 0.7 OUTLIER -65.09 -41.6 94.86 Favored 'General case' 1 N--CA 1.541 4.082 0 CA-C-O 117.875 -1.059 . . . . 0.0 113.459 -178.494 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.547 HG21 HD23 ' A' ' 71' ' ' LEU . 0.1 OUTLIER -69.68 -32.16 51.34 Favored 'Isoleucine or valine' 1 N--CA 1.549 4.508 0 CA-C-N 120.392 1.451 . . . . 0.0 110.96 -179.616 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 71.3 p -98.9 -2.15 38.33 Favored 'General case' 0 N--CA 1.518 2.947 0 CA-C-N 119.101 0.864 . . . . 0.0 111.443 177.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -88.22 -32.87 18.34 Favored 'General case' 0 N--CA 1.529 3.478 0 N-CA-C 105.519 -2.03 . . . . 0.0 105.519 173.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.64 -29.64 72.54 Favored Glycine 1 N--CA 1.519 4.196 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 176.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 62.2 p -69.4 -35.89 76.19 Favored 'General case' 0 N--CA 1.538 3.942 0 CA-C-N 118.544 1.172 . . . . 0.0 110.259 177.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -63.16 -26.35 68.77 Favored 'General case' 0 N--CA 1.538 3.965 0 C-N-CA 123.146 0.578 . . . . 0.0 110.721 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.3 m -68.61 -38.68 80.8 Favored 'General case' 0 N--CA 1.534 3.757 0 C-N-CA 123.584 0.754 . . . . 0.0 110.375 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 13.5 mt -57.47 -37.96 73.73 Favored 'General case' 0 N--CA 1.533 3.682 0 C-N-CA 124.05 0.94 . . . . 0.0 111.468 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -68.43 -27.98 66.67 Favored 'General case' 0 N--CA 1.531 3.618 0 CA-C-O 118.563 -0.732 . . . . 0.0 111.757 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -76.42 -46.31 27.66 Favored 'General case' 0 N--CA 1.518 2.963 0 CA-C-N 118.782 0.719 . . . . 0.0 110.992 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.25 160.04 52.76 Favored Pre-proline 0 N--CA 1.538 3.955 0 CA-C-O 118.29 -0.862 . . . . 0.0 112.571 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -81.85 175.46 9.29 Favored 'Trans proline' 0 C--N 1.377 2.072 0 C-N-CA 121.737 1.625 . . . . 0.0 111.123 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 t -95.69 -25.19 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.192 0 CA-C-O 117.945 -1.026 . . . . 0.0 111.242 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -59.79 -44.94 93.69 Favored 'General case' 0 N--CA 1.516 2.85 0 CA-C-N 120.071 1.305 . . . . 0.0 109.966 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.597 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.9 mp -98.49 -9.98 24.24 Favored 'General case' 0 N--CA 1.505 2.282 0 CA-C-O 118.061 -0.971 . . . . 0.0 112.268 178.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.1 -33.93 76.9 Favored 'General case' 1 N--CA 1.549 4.52 0 N-CA-C 102.881 -3.007 . . . . 0.0 102.881 168.014 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -53.23 -41.26 65.22 Favored 'General case' 0 N--CA 1.519 3.007 0 C-N-CA 124.501 1.121 . . . . 0.0 110.159 174.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.671 ' CH2' ' HB2' ' B' ' 529' ' ' ALA . 51.1 t90 -64.46 -35.29 80.45 Favored 'General case' 0 N--CA 1.532 3.665 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 176.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.37 -38.56 59.14 Favored 'General case' 0 N--CA 1.537 3.901 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 176.212 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -69.97 -36.41 75.2 Favored 'General case' 0 N--CA 1.539 3.994 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 175.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.428 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 0.8 OUTLIER -59.12 -24.4 62.94 Favored 'General case' 1 N--CA 1.549 4.522 0 C-N-CA 123.419 0.688 . . . . 0.0 109.984 175.124 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.529 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -119.7 3.66 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.39 0 C-N-CA 123.615 0.766 . . . . 0.0 112.356 -177.345 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -98.68 -59.36 1.75 Allowed 'General case' 0 N--CA 1.517 2.909 0 N-CA-C 104.346 -2.464 . . . . 0.0 104.346 175.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 1.6 tp -64.15 -37.47 87.57 Favored 'General case' 0 N--CA 1.528 3.464 0 C-N-CA 124.687 1.195 . . . . 0.0 109.602 176.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 60.0 tttt 94.34 -38.59 0.01 OUTLIER 'General case' 0 N--CA 1.539 4.0 0 C-N-CA 126.917 2.087 . . . . 0.0 110.831 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 6.8 t . . . . . 0 N--CA 1.539 3.98 0 C-N-CA 124.477 1.111 . . . . 0.0 111.171 179.788 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 . . . . . 0 N--CA 1.504 2.274 0 CA-C-O 120.196 0.045 . . . . 0.0 110.906 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 70.1 m -121.82 124.37 27.09 Favored Pre-proline 0 N--CA 1.522 3.162 0 CA-C-O 117.392 -1.29 . . . . 0.0 109.437 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -72.55 159.55 48.7 Favored 'Trans proline' 0 C--N 1.391 2.806 0 C-N-CA 122.221 1.947 . . . . 0.0 111.613 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 85.44 -61.23 0.07 Allowed 'General case' 1 N--CA 1.544 4.251 0 C-N-CA 126.11 1.764 . . . . 0.0 110.234 -179.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 36.9 p -87.97 134.27 33.76 Favored 'General case' 0 N--CA 1.526 3.334 0 C-N-CA 123.257 0.623 . . . . 0.0 111.02 -178.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -123.53 116.71 23.63 Favored 'General case' 0 N--CA 1.513 2.702 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 178.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -97.66 127.97 44.01 Favored 'General case' 0 N--CA 1.521 3.085 0 C-N-CA 122.476 0.31 . . . . 0.0 111.041 -177.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 16.7 ttt -111.65 135.9 51.62 Favored 'General case' 0 N--CA 1.523 3.178 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 178.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . 68.57 132.39 0.03 OUTLIER 'General case' 1 N--CA 1.54 4.046 0 C-N-CA 123.89 0.876 . . . . 0.0 109.705 -179.061 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -69.59 -36.97 76.72 Favored 'General case' 0 N--CA 1.532 3.643 0 CA-C-O 118.876 -0.583 . . . . 0.0 110.956 -179.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 63.6 mm-40 -83.06 110.26 17.84 Favored 'General case' 0 N--CA 1.523 3.178 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 29.7 ptt180 -79.89 142.65 34.98 Favored 'General case' 0 N--CA 1.53 3.566 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -177.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 77.4 m-70 -138.89 122.78 17.74 Favored 'General case' 0 N--CA 1.524 3.269 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 177.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -108.13 140.89 40.67 Favored 'General case' 0 N--CA 1.529 3.505 0 C-N-CA 123.483 0.713 . . . . 0.0 110.901 -178.108 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -95.17 -83.15 0.36 Allowed 'General case' 0 N--CA 1.52 3.025 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 519' ' ' TRP . . . . . 0.524 ' HA ' ' CD2' ' B' ' 522' ' ' PHE . 67.9 t-105 -42.92 -28.15 0.24 Allowed 'General case' 1 N--CA 1.549 4.489 0 CA-C-N 119.641 1.11 . . . . 0.0 113.65 179.865 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 520' ' ' LEU . . . . . 0.58 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.2 mm? -95.03 -29.1 14.78 Favored 'General case' 0 N--CA 1.53 3.532 0 CA-C-O 117.84 -1.076 . . . . 0.0 113.827 -172.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -27.23 68.26 Favored 'General case' 1 N--CA 1.545 4.297 0 N-CA-C 105.426 -2.064 . . . . 0.0 105.426 171.02 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . 0.561 ' O ' HD23 ' B' ' 526' ' ' LEU . 0.9 OUTLIER -78.08 -40.37 38.67 Favored 'General case' 0 N--CA 1.507 2.402 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 174.77 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 37.0 t -63.02 -22.43 30.65 Favored 'Isoleucine or valine' 1 N--CA 1.569 5.48 0 CA-C-N 120.283 1.401 . . . . 0.0 111.965 178.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -76.89 -49.83 14.75 Favored 'General case' 0 N--CA 1.536 3.84 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 179.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 6.7 tt -63.45 -31.4 72.55 Favored 'General case' 0 N--CA 1.538 3.939 0 O-C-N 123.29 0.369 . . . . 0.0 110.115 176.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 526' ' ' LEU . . . . . 0.561 HD23 ' O ' ' B' ' 522' ' ' PHE . 3.7 mm? -68.65 -33.78 74.58 Favored 'General case' 0 N--CA 1.523 3.223 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 177.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 527' ' ' LYS . . . . . 0.433 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 31.4 ttmt -67.66 -26.57 66.28 Favored 'General case' 0 N--CA 1.518 2.971 0 CA-C-O 118.161 -0.923 . . . . 0.0 110.853 177.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -69.58 -37.43 76.95 Favored 'General case' 0 N--CA 1.536 3.854 0 CA-C-N 119.462 1.028 . . . . 0.0 108.896 176.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 529' ' ' ALA . . . . . 0.671 ' HB2' ' CH2' ' A' ' 99' ' ' TRP . . . -90.98 -9.46 45.92 Favored 'General case' 0 CA--C 1.579 2.084 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.967 178.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 530' ' ' TYR . . . . . 0.496 ' CZ ' HG13 ' A' ' 23' ' ' VAL . 1.2 m-85 -82.32 -32.11 29.59 Favored 'General case' 0 N--CA 1.531 3.6 0 CA-C-N 120.312 1.414 . . . . 0.0 109.328 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -65.85 -43.0 89.76 Favored 'General case' 0 N--CA 1.534 3.766 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 177.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 65.6 m-80 -90.82 -90.15 0.16 Allowed 'General case' 0 N--CA 1.514 2.754 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 154.86 50.74 0.0 OUTLIER 'General case' 1 N--CA 1.559 4.977 0 C-N-CA 127.574 2.35 . . . . 0.0 107.984 177.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 534' ' ' LEU . . . . . 0.597 HD22 ' CD2' ' A' ' 96' ' ' LEU . 6.9 mt -106.35 7.83 31.42 Favored 'General case' 0 N--CA 1.528 3.449 0 C-N-CA 124.297 1.039 . . . . 0.0 111.021 -178.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 535' ' ' HIS . . . . . 0.616 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 29.3 p-80 -80.57 0.01 35.77 Favored 'General case' 0 N--CA 1.514 2.732 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 175.29 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 536' ' ' LEU . . . . . 0.418 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 35.5 mt -94.23 -50.95 0.26 Allowed Pre-proline 0 N--CA 1.505 2.283 0 CA-C-O 116.486 -1.721 . . . . 0.0 109.263 -175.497 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 537' ' ' PRO . . . . . 0.418 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 5.2 Cg_exo -66.33 -35.37 31.8 Favored 'Trans proline' 0 C--N 1.394 2.966 0 N-CA-C 106.775 -2.048 . . . . 0.0 106.775 171.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 538' ' ' LEU . . . . . 0.441 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 1.0 OUTLIER -62.24 -41.7 98.66 Favored 'General case' 0 N--CA 1.524 3.251 0 C-N-CA 124.267 1.027 . . . . 0.0 108.334 175.979 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 11.5 mt -72.14 -21.76 61.42 Favored 'General case' 1 N--CA 1.54 4.057 0 CA-C-O 118.358 -0.83 . . . . 0.0 111.057 178.573 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -77.72 -6.18 53.11 Favored 'General case' 0 N--CA 1.524 3.234 0 CA-C-N 118.976 0.807 . . . . 0.0 110.44 177.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 541' ' ' LEU . . . . . 0.634 HD13 ' N ' ' B' ' 542' ' ' MET . 0.0 OUTLIER -109.88 -47.77 3.3 Favored 'General case' 0 N--CA 1.512 2.63 0 C-N-CA 124.053 0.941 . . . . 0.0 109.445 -179.092 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 542' ' ' MET . . . . . 0.634 ' N ' HD13 ' B' ' 541' ' ' LEU . 12.7 ptp -89.76 -10.54 45.21 Favored 'General case' 0 N--CA 1.536 3.852 0 CA-C-O 117.407 -1.282 . . . . 0.0 113.542 -177.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 543' ' ' LEU . . . . . 0.575 ' O ' HG23 ' B' ' 544' ' ' THR . 1.2 tt -128.2 -112.58 0.27 Allowed 'General case' 0 N--CA 1.53 3.563 0 CA-C-O 116.558 -1.687 . . . . 0.0 112.752 -178.053 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 544' ' ' THR . . . . . 0.575 HG23 ' O ' ' B' ' 543' ' ' LEU . 2.2 p -174.56 161.66 2.64 Favored Pre-proline 1 N--CA 1.561 5.087 0 CA-C-N 121.505 1.957 . . . . 0.0 111.245 -178.483 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -74.81 -42.49 0.55 Allowed 'Trans proline' 0 C--N 1.388 2.621 0 C-N-CA 123.021 2.481 . . . . 0.0 109.733 176.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -58.28 -31.9 67.91 Favored 'General case' 1 N--CA 1.543 4.192 0 C-N-CA 123.707 0.803 . . . . 0.0 111.63 179.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -71.96 -34.09 68.7 Favored 'General case' 0 N--CA 1.526 3.35 0 CA-C-O 117.843 -1.075 . . . . 0.0 110.664 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 32.1 ptt180 -79.09 -23.51 44.08 Favored 'General case' 0 N--CA 1.533 3.692 0 CA-C-N 119.597 1.09 . . . . 0.0 110.133 177.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -65.16 -41.48 94.66 Favored 'General case' 0 N--CA 1.536 3.828 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 173.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -78.14 -19.95 53.01 Favored 'General case' 0 N--CA 1.508 2.448 0 CA-C-O 116.992 -1.48 . . . . 0.0 111.185 177.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 551' ' ' LEU . . . . . 0.587 HD22 ' CZ3' ' A' ' 19' ' ' TRP . 18.0 tp -76.44 -28.19 56.5 Favored 'General case' 0 N--CA 1.529 3.497 0 CA-C-N 121.368 1.895 . . . . 0.0 108.52 175.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -72.23 -56.3 6.38 Favored Glycine 0 N--CA 1.501 2.993 0 N-CA-C 108.491 -1.844 . . . . 0.0 108.491 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.4 m -66.19 -28.18 68.56 Favored 'General case' 0 N--CA 1.537 3.913 0 CA-C-O 118.432 -0.794 . . . . 0.0 112.05 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 26.0 mtm-85 -69.22 -45.81 68.94 Favored 'General case' 1 N--CA 1.541 4.102 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 176.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 555' ' ' VAL . . . . . 0.483 HG23 ' O ' ' B' ' 551' ' ' LEU . 34.9 t -70.73 -15.47 18.93 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.66 0 CA-C-O 118.11 -0.947 . . . . 0.0 109.353 177.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -79.82 -44.35 20.72 Favored 'General case' 0 N--CA 1.523 3.222 0 CA-C-O 117.395 -1.288 . . . . 0.0 111.212 178.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 557' ' ' ILE . . . . . 0.483 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -72.3 -25.07 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.213 0 CA-C-N 121.428 1.922 . . . . 0.0 110.107 179.88 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 558' ' ' VAL . . . . . 0.57 HG11 HD11 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -84.32 -52.76 12.24 Favored 'Isoleucine or valine' 1 N--CA 1.547 4.397 0 CA-C-N 120.736 1.607 . . . . 0.0 107.541 -179.888 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -58.07 -25.69 61.59 Favored 'General case' 0 N--CA 1.529 3.507 0 CA-C-O 118.874 -0.584 . . . . 0.0 110.696 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -93.7 -24.58 17.8 Favored 'General case' 0 N--CA 1.523 3.225 0 CA-C-O 118.132 -0.937 . . . . 0.0 111.043 178.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.92 -38.71 66.76 Favored 'General case' 1 N--CA 1.541 4.092 0 CA-C-N 119.728 1.149 . . . . 0.0 108.561 177.776 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 34.7 mt -57.35 -22.32 41.63 Favored 'General case' 0 N--CA 1.536 3.857 0 C-N-CA 123.665 0.786 . . . . 0.0 111.545 177.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 24.5 mmm180 -77.77 -51.39 10.6 Favored 'General case' 0 N--CA 1.527 3.406 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 66.97 50.57 45.85 Favored Glycine 1 N--CA 1.522 4.386 0 CA-C-O 119.086 -0.841 . . . . 0.0 112.494 178.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -124.76 -54.21 1.65 Allowed 'General case' 0 N--CA 1.527 3.405 0 CA-C-N 118.362 1.081 . . . . 0.0 108.431 178.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 30.6 mtt -148.98 64.32 1.04 Allowed 'General case' 0 N--CA 1.522 3.168 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 567' ' ' SER . . . . . 0.405 ' HA ' ' HB2' ' B' ' 571' ' ' LEU . 80.0 p -130.87 -4.83 4.02 Favored 'General case' 0 N--CA 1.52 3.063 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -175.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -93.49 -78.43 0.43 Allowed 'General case' 0 N--CA 1.528 3.468 0 CA-C-N 120.164 1.347 . . . . 0.0 111.255 -179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.79 -34.86 13.02 Favored 'General case' 1 N--CA 1.541 4.086 0 CA-C-N 119.146 0.885 . . . . 0.0 112.043 -178.492 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -76.96 -11.08 59.76 Favored 'General case' 0 N--CA 1.52 3.028 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -178.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 571' ' ' LEU . . . . . 0.81 HD23 HD11 ' B' ' 582' ' ' ILE . 16.8 tp -83.17 -43.65 15.93 Favored 'General case' 0 N--CA 1.532 3.639 0 CA-C-N 119.749 1.158 . . . . 0.0 112.649 -177.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -44.63 -29.21 0.7 Allowed 'General case' 1 N--CA 1.556 4.856 0 CA-C-N 120.249 1.386 . . . . 0.0 113.474 -178.591 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -66.4 -46.35 76.88 Favored 'General case' 0 N--CA 1.538 3.96 0 CA-C-N 118.698 0.681 . . . . 0.0 109.414 179.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -57.53 -51.13 70.71 Favored 'General case' 0 N--CA 1.525 3.293 0 C-N-CA 124.662 1.185 . . . . 0.0 112.413 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 61.0 mt -108.77 -61.83 1.55 Allowed 'General case' 0 N--CA 1.53 3.534 0 C-N-CA 122.988 0.515 . . . . 0.0 111.828 -177.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 122.81 20.82 2.76 Favored Glycine 1 N--CA 1.529 4.898 0 CA-C-O 118.199 -1.334 . . . . 0.0 112.619 -178.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -86.27 119.31 26.41 Favored 'General case' 0 N--CA 1.522 3.135 0 CA-C-N 119.577 1.689 . . . . 0.0 107.021 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -42.26 167.97 0.01 OUTLIER Glycine 1 N--CA 1.538 5.444 0 C-N-CA 124.616 1.103 . . . . 0.0 115.209 -177.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 579' ' ' ILE . . . . . 0.493 HG21 ' N6 ' ' E' ' 4' ' ' ' DA' . 0.7 OUTLIER -80.27 -19.05 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.743 0 CA-C-O 117.632 -1.175 . . . . 0.0 108.568 178.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 580' ' ' ALA . . . . . 0.778 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -69.22 -37.21 77.91 Favored 'General case' 0 N--CA 1.527 3.424 0 CA-C-N 119.879 1.218 . . . . 0.0 109.501 176.361 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.4 -36.65 38.81 Favored 'General case' 0 N--CA 1.536 3.831 0 CA-C-N 118.978 0.808 . . . . 0.0 111.776 178.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 582' ' ' ILE . . . . . 0.81 HD11 HD23 ' B' ' 571' ' ' LEU . 3.1 tt -67.07 -38.41 81.2 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.216 0 CA-C-O 118.975 -0.535 . . . . 0.0 112.223 -175.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 583' ' ' THR . . . . . 0.445 HG23 HG23 ' B' ' 582' ' ' ILE . 69.8 p -99.11 -27.34 13.87 Favored 'General case' 0 N--CA 1.508 2.443 0 CA-C-O 117.812 -1.089 . . . . 0.0 111.837 -178.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 13.3 ptt180 -73.66 -24.87 60.04 Favored 'General case' 0 N--CA 1.531 3.584 0 CA-C-N 120.061 1.301 . . . . 0.0 109.762 176.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -68.88 -36.11 81.08 Favored Glycine 1 N--CA 1.517 4.081 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 177.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 35.2 p -78.68 -29.49 45.62 Favored 'General case' 0 N--CA 1.531 3.607 0 CA-C-N 118.05 0.925 . . . . 0.0 111.278 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -64.01 -30.89 71.93 Favored 'General case' 1 N--CA 1.544 4.233 0 CA-C-N 119.346 0.976 . . . . 0.0 110.683 179.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 3.8 m -59.02 -35.98 74.2 Favored 'General case' 1 N--CA 1.541 4.108 0 C-N-CA 123.276 0.63 . . . . 0.0 110.411 178.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 43.7 mt -52.56 -45.84 66.57 Favored 'General case' 0 N--CA 1.532 3.641 0 C-N-CA 124.582 1.153 . . . . 0.0 111.398 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.52 -34.85 69.54 Favored 'General case' 1 N--CA 1.543 4.222 0 C-N-CA 123.268 0.627 . . . . 0.0 111.815 -179.744 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -81.2 -34.01 32.58 Favored 'General case' 0 N--CA 1.519 2.992 0 CA-C-O 118.878 -0.582 . . . . 0.0 111.859 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . 0.55 ' HB1' ' HD2' ' B' ' 593' ' ' PRO . . . -61.94 171.99 1.3 Allowed Pre-proline 1 N--CA 1.54 4.061 0 CA-C-O 118.218 -0.896 . . . . 0.0 111.707 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 593' ' ' PRO . . . . . 0.55 ' HD2' ' HB1' ' B' ' 592' ' ' ALA . 61.4 Cg_endo -83.17 140.73 10.0 Favored 'Trans proline' 0 C--N 1.377 2.033 0 C-N-CA 121.775 1.65 . . . . 0.0 109.207 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.3 t -79.64 -20.82 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.019 0 CA-C-O 117.928 -1.034 . . . . 0.0 111.027 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -63.54 -41.91 98.44 Favored 'General case' 0 N--CA 1.516 2.856 0 CA-C-N 120.101 1.319 . . . . 0.0 109.786 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 596' ' ' LEU . . . . . 0.529 ' CD2' HD22 ' A' ' 34' ' ' LEU . 7.4 mp -97.64 -13.79 21.33 Favored 'General case' 0 N--CA 1.511 2.592 0 C-N-CA 123.683 0.793 . . . . 0.0 111.349 177.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.16 -32.18 73.1 Favored 'General case' 1 N--CA 1.541 4.081 0 N-CA-C 103.595 -2.743 . . . . 0.0 103.595 168.496 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -54.16 -38.26 65.33 Favored 'General case' 0 N--CA 1.519 3.003 0 C-N-CA 124.532 1.133 . . . . 0.0 109.693 174.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 599' ' ' TRP . . . . . 0.631 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 49.7 t90 -63.25 -37.16 86.15 Favored 'General case' 0 N--CA 1.528 3.432 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 176.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -51.34 -39.03 56.16 Favored 'General case' 1 N--CA 1.543 4.204 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 175.869 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -69.64 -37.15 76.67 Favored 'General case' 1 N--CA 1.543 4.177 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 175.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 602' ' ' GLU . . . . . 0.43 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 2.9 mt-10 -59.35 -23.25 62.37 Favored 'General case' 1 N--CA 1.547 4.41 0 C-N-CA 123.424 0.69 . . . . 0.0 110.141 175.101 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 603' ' ' VAL . . . . . 0.543 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.2 OUTLIER -120.77 3.49 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.323 0 C-N-CA 123.566 0.747 . . . . 0.0 112.468 -177.399 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -111.68 -61.49 1.7 Allowed 'General case' 0 N--CA 1.509 2.508 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 176.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.74 -65.86 0.63 Allowed 'General case' 0 N--CA 1.535 3.792 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 177.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt 84.68 -44.48 0.08 Allowed 'General case' 0 N--CA 1.535 3.819 0 C-N-CA 126.452 1.901 . . . . 0.0 111.647 178.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 37.0 p . . . . . 0 N--CA 1.526 3.336 0 CA-C-O 118.129 -0.938 . . . . 0.0 109.582 179.836 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 898' ' ' TRP . . . . . 0.469 ' HB2' HG23 ' B' ' 544' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.209 0 CA-C-O 117.849 -1.072 . . . . 0.0 109.033 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 998' ' ' TRP . . . . . 0.57 ' HB2' HG23 ' A' ' 44' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.161 0 CA-C-O 118.315 -0.85 . . . . 0.0 109.537 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.054 3 O4'-C1'-N19 119.843 15.054 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.057 4 O4'-C1'-N19 120.187 15.484 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -9.982 3 O4'-C1'-N19 119.039 14.048 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . 0.61 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 6 C3'--C2' 1.416 -10.155 4 O4'-C1'-N19 120.195 15.493 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' E' E ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.566 10.392 3 C4'-C3'-C2' 116.98 13.78 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.41 -10.756 5 O4'-C1'-N19 119.731 14.913 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' E' E ' 7' ' ' ' DA' . . . . . 0.647 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 5 C3'--C2' 1.392 -12.567 4 C4'-C3'-C2' 113.058 9.858 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' E' E ' 8' ' ' ' DG' . . . . . 0.647 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.42 -9.816 4 O4'-C1'-N19 120.108 15.385 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.574 11.015 4 C4'-C3'-C2' 116.596 13.396 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.406 -11.171 5 O4'-C1'-N19 119.144 14.18 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.571 10.783 2 O4'-C1'-N19 120.004 15.255 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.406 -11.219 4 O4'-C1'-N19 119.654 14.818 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.415 -10.349 5 O4'-C1'-N19 119.876 15.094 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' E' E ' 14' ' ' ' DT' . . . . . 0.641 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.417 -10.077 2 O4'-C1'-N19 119.612 14.765 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' E' E ' 15' ' ' ' DA' . . . . . 0.939 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.416 -10.234 6 O4'-C1'-N19 119.766 14.957 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.416 -10.227 6 O4'-C1'-N19 119.513 14.641 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.578 11.317 4 O4'-C1'-N19 119.786 14.983 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.42 -9.796 4 O4'-C1'-N19 120.356 15.695 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.094 5 O4'-C1'-N19 120.004 15.255 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.598 6.995 4 O4'-C1'-N19 120.24 15.551 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.197 4 O4'-C1'-N19 118.582 13.477 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.405 -11.32 3 O4'-C1'-N19 118.919 13.899 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' F' F ' 3' ' ' ' DT' . . . . . 0.411 ' H71' ' OE1' ' A' ' 68' ' ' GLN . . . . . . . . 6 C3'--C2' 1.409 -10.862 3 O4'-C1'-N19 119.718 14.897 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' F' F ' 4' ' ' ' DA' . . . . . 0.576 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 6 O3'--C3' 1.563 10.158 4 O4'-C1'-N19 119.185 14.231 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' F' F ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.572 10.856 4 O4'-C1'-N19 118.773 13.716 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.408 -10.97 4 C4'-C3'-C2' 115.985 12.785 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.408 -12.013 4 N19-C1'-C2' 130.071 9.919 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.425 -9.341 3 O4'-C1'-N19 119.527 14.659 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.565 10.301 3 O4'-C1'-N19 119.665 14.831 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' F' F ' 10' ' ' ' DT' . . . . . 0.461 " H4'" ' OP1' ' F' ' 11' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.417 -10.076 5 O4'-C1'-N19 117.531 12.163 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . 0.461 ' OP1' " H4'" ' F' ' 10' ' ' ' DT' . . . . . . . . 5 C3'--C2' 1.413 -10.527 4 O4'-C1'-N19 121.533 17.166 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.618 5 O4'-C1'-N19 120.473 15.841 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.706 3 O4'-C1'-N19 120.914 16.392 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' F' F ' 14' ' ' ' DT' . . . . . 0.655 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 O3'--C3' 1.567 10.459 3 O4'-C1'-N19 119.129 14.161 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' F' F ' 15' ' ' ' DA' . . . . . 0.822 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.415 -10.254 6 O4'-C1'-N19 120.173 15.466 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.415 -10.328 5 O4'-C1'-N19 120.03 15.287 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.135 4 O4'-C1'-N19 119.239 14.299 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.47 5 O4'-C1'-N19 119.997 15.246 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.485 4 O4'-C1'-N19 120.397 15.746 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.511 6.966 4 O4'-C1'-N19 120.19 15.488 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 . . . . . 0 N--CA 1.498 1.947 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 36.2 p -102.77 152.5 38.46 Favored Pre-proline 0 N--CA 1.534 3.739 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.661 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -74.02 124.84 9.4 Favored 'Trans proline' 0 C--N 1.388 2.618 0 C-N-CA 122.468 2.112 . . . . 0.0 110.935 -179.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -145.49 -57.0 0.32 Allowed 'General case' 0 N--CA 1.525 3.313 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 179.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.0 p -105.61 149.86 25.93 Favored 'General case' 0 N--CA 1.528 3.426 0 C-N-CA 123.687 0.795 . . . . 0.0 108.87 177.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 71.19 127.71 0.03 OUTLIER 'General case' 1 N--CA 1.544 4.26 0 C-N-CA 123.884 0.874 . . . . 0.0 109.154 -178.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.66 -56.75 4.33 Favored 'General case' 0 N--CA 1.524 3.238 0 CA-C-O 119.107 -0.473 . . . . 0.0 111.162 -178.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 13.3 ttt -113.8 123.41 49.76 Favored 'General case' 0 N--CA 1.519 3.01 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -137.79 131.99 32.02 Favored 'General case' 0 N--CA 1.523 3.209 0 C-N-CA 123.637 0.775 . . . . 0.0 109.167 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -142.39 132.3 24.34 Favored 'General case' 0 N--CA 1.518 2.965 0 CA-C-N 117.905 0.32 . . . . 0.0 111.252 -178.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 65.4 mm-40 -102.78 -42.97 5.7 Favored 'General case' 0 N--CA 1.525 3.296 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 176.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 87.5 mtm180 68.49 139.92 0.03 OUTLIER 'General case' 0 N--CA 1.526 3.342 0 C-N-CA 125.014 1.326 . . . . 0.0 112.509 177.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 12.4 p-80 -146.99 -37.37 0.22 Allowed 'General case' 0 N--CA 1.524 3.254 0 C-N-CA 123.894 0.878 . . . . 0.0 110.554 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -68.33 132.94 47.95 Favored 'General case' 0 N--CA 1.527 3.424 0 C-N-CA 123.334 0.654 . . . . 0.0 111.533 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -148.91 -66.21 0.23 Allowed 'General case' 0 N--CA 1.528 3.445 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 177.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.663 ' CE3' HD22 ' B' ' 551' ' ' LEU . 61.6 t-105 -54.65 -38.26 66.67 Favored 'General case' 0 N--CA 1.531 3.598 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 173.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.478 HD22 ' N ' ' A' ' 20' ' ' LEU . 2.8 mm? -80.03 -27.27 39.5 Favored 'General case' 0 N--CA 1.517 2.881 0 CA-C-O 117.263 -1.351 . . . . 0.0 112.279 -175.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 mmt180 -57.9 -31.54 66.86 Favored 'General case' 1 N--CA 1.549 4.508 0 N-CA-C 105.335 -2.098 . . . . 0.0 105.335 172.138 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.501 ' O ' ' HB2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -76.59 -41.98 44.23 Favored 'General case' 0 N--CA 1.503 2.2 0 CA-C-O 116.718 -1.61 . . . . 0.0 109.382 173.628 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 26.8 t -69.91 -25.04 27.24 Favored 'Isoleucine or valine' 1 N--CA 1.566 5.349 0 CA-C-N 120.566 1.53 . . . . 0.0 113.981 -174.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -76.29 -51.56 11.74 Favored 'General case' 0 N--CA 1.535 3.815 0 CA-C-N 120.392 1.451 . . . . 0.0 108.276 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.5 mp -74.68 -12.33 60.4 Favored 'General case' 0 N--CA 1.52 3.059 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 175.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.501 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -70.76 -36.92 73.33 Favored 'General case' 0 N--CA 1.521 3.097 0 N-CA-C 106.495 -1.669 . . . . 0.0 106.495 173.22 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.441 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 17.5 tttt -62.79 -22.15 66.4 Favored 'General case' 0 N--CA 1.525 3.276 0 CA-C-O 118.495 -0.764 . . . . 0.0 111.006 176.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -70.36 -45.53 65.89 Favored 'General case' 0 N--CA 1.538 3.927 0 N-CA-C 108.307 -0.998 . . . . 0.0 108.307 176.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.661 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -81.67 -9.37 59.67 Favored 'General case' 0 N--CA 1.508 2.455 0 CA-C-O 118.695 -0.669 . . . . 0.0 110.841 177.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.441 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -81.4 -36.15 29.88 Favored 'General case' 0 N--CA 1.533 3.707 0 CA-C-N 120.251 1.387 . . . . 0.0 109.066 179.987 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -59.99 -42.43 94.18 Favored 'General case' 0 N--CA 1.536 3.863 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 177.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 61.3 m-80 -90.15 -85.59 0.21 Allowed 'General case' 0 N--CA 1.513 2.717 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 176.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 147.94 50.96 0.0 OUTLIER 'General case' 1 N--CA 1.555 4.792 0 C-N-CA 128.042 2.537 . . . . 0.0 108.422 177.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.447 HD22 ' CD2' ' B' ' 596' ' ' LEU . 3.7 mt -111.63 12.38 21.2 Favored 'General case' 0 N--CA 1.526 3.339 0 C-N-CA 124.822 1.249 . . . . 0.0 110.021 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.549 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 51.6 p-80 -83.91 6.66 20.88 Favored 'General case' 0 N--CA 1.507 2.41 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 175.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.834 ' HA ' HD23 ' A' ' 39' ' ' LEU . 18.6 mt -96.37 -52.04 0.23 Allowed Pre-proline 0 N--CA 1.509 2.505 0 CA-C-O 116.794 -1.574 . . . . 0.0 108.828 -175.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.477 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 5.7 Cg_exo -66.02 -32.27 44.59 Favored 'Trans proline' 0 C--N 1.396 3.04 0 N-CA-C 106.489 -2.158 . . . . 0.0 106.489 170.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.549 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.9 OUTLIER -64.14 -39.22 93.57 Favored 'General case' 0 N--CA 1.517 2.9 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 175.679 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.834 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -71.35 -21.5 62.03 Favored 'General case' 1 N--CA 1.543 4.196 0 CA-C-N 119.324 0.966 . . . . 0.0 109.978 176.547 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -85.73 -3.19 58.83 Favored 'General case' 0 N--CA 1.527 3.42 0 CA-C-N 119.106 0.866 . . . . 0.0 111.131 177.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.569 HD13 ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -112.96 -36.09 5.23 Favored 'General case' 0 N--CA 1.53 3.548 0 CA-C-N 119.698 1.135 . . . . 0.0 111.558 -178.26 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.569 ' N ' HD13 ' A' ' 41' ' ' LEU . 3.9 ptt? -126.81 27.18 6.07 Favored 'General case' 1 N--CA 1.554 4.725 0 CA-C-N 120.249 1.386 . . . . 0.0 111.674 -179.687 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.3 tp -134.1 -61.89 0.77 Allowed 'General case' 0 N--CA 1.516 2.867 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.9 p 118.5 158.8 0.0 OUTLIER Pre-proline 1 N--CA 1.566 5.345 0 C-N-CA 128.348 2.659 . . . . 0.0 109.495 -178.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -69.26 -31.26 23.1 Favored 'Trans proline' 0 C--N 1.392 2.864 0 C-N-CA 122.163 1.908 . . . . 0.0 109.058 175.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -67.17 -21.07 65.81 Favored 'General case' 0 N--CA 1.528 3.441 0 CA-C-O 118.131 -0.937 . . . . 0.0 110.243 176.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -75.46 -29.74 59.74 Favored 'General case' 0 N--CA 1.521 3.086 0 CA-C-O 117.599 -1.191 . . . . 0.0 109.853 178.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -87.18 -22.03 25.54 Favored 'General case' 0 N--CA 1.539 3.995 0 CA-C-N 119.933 1.242 . . . . 0.0 109.026 174.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -71.58 -27.94 63.49 Favored 'General case' 0 N--CA 1.527 3.423 0 N-CA-C 106.433 -1.692 . . . . 0.0 106.433 172.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.48 -27.24 20.48 Favored 'General case' 0 N--CA 1.503 2.177 0 CA-C-O 117.432 -1.27 . . . . 0.0 110.405 178.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 27.6 tp -75.55 -21.74 57.64 Favored 'General case' 0 N--CA 1.537 3.915 0 N-CA-C 106.249 -1.76 . . . . 0.0 106.249 173.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.459 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -67.85 -72.42 0.8 Allowed Glycine 0 C--N 1.376 2.802 0 N-CA-C 109.198 -1.561 . . . . 0.0 109.198 176.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.7 m -66.08 -22.38 66.41 Favored 'General case' 0 N--CA 1.535 3.82 0 CA-C-O 117.468 -1.253 . . . . 0.0 113.204 -179.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.3 mtm180 -71.27 -52.66 17.71 Favored 'General case' 0 N--CA 1.538 3.933 0 CA-C-N 120.498 1.499 . . . . 0.0 107.464 177.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.3 t -67.63 -16.2 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.903 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.84 176.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -76.09 -46.66 27.85 Favored 'General case' 0 N--CA 1.531 3.59 0 CA-C-N 120.052 1.296 . . . . 0.0 111.172 178.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.589 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -72.2 -23.04 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.376 0 CA-C-N 120.563 1.529 . . . . 0.0 111.573 -178.922 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.452 HG11 HD11 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -88.79 -53.31 9.75 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.765 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 -179.903 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -57.39 -22.61 44.03 Favored 'General case' 0 N--CA 1.531 3.609 0 CA-C-O 118.454 -0.784 . . . . 0.0 110.755 178.078 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -95.33 -29.01 14.69 Favored 'General case' 0 N--CA 1.522 3.132 0 CA-C-O 118.148 -0.929 . . . . 0.0 110.365 177.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 45.6 tp -67.6 -56.33 9.83 Favored 'General case' 1 N--CA 1.539 4.007 0 CA-C-N 119.598 1.09 . . . . 0.0 110.073 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 54.9 mt -54.02 -24.64 17.68 Favored 'General case' 1 N--CA 1.541 4.09 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 -179.26 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -79.22 -48.83 13.51 Favored 'General case' 0 N--CA 1.53 3.531 0 CA-C-N 118.669 0.668 . . . . 0.0 110.045 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 74.61 81.14 0.48 Allowed Glycine 1 N--CA 1.521 4.344 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 179.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -158.57 -57.17 0.07 Allowed 'General case' 0 N--CA 1.53 3.528 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 44.1 mtt -138.61 76.56 1.58 Allowed 'General case' 0 N--CA 1.522 3.156 0 N-CA-C 104.344 -2.465 . . . . 0.0 104.344 177.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.5 m -128.5 -33.17 2.12 Favored 'General case' 0 N--CA 1.525 3.324 0 N-CA-C 114.104 1.15 . . . . 0.0 114.104 -172.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.411 ' OE1' ' H71' ' F' ' 3' ' ' ' DT' . 31.7 mt-30 -105.91 -65.65 1.05 Allowed 'General case' 0 N--CA 1.526 3.343 0 CA-C-N 118.727 0.694 . . . . 0.0 111.933 -176.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 10.7 mtt180 -97.24 -45.59 6.45 Favored 'General case' 0 N--CA 1.526 3.361 0 CA-C-N 118.485 0.584 . . . . 0.0 111.419 -177.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -71.81 -14.87 62.1 Favored 'General case' 0 N--CA 1.521 3.083 0 CA-C-O 118.439 -0.791 . . . . 0.0 112.297 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.605 HD23 HG21 ' A' ' 82' ' ' ILE . 24.1 tp -79.14 -54.9 5.53 Favored 'General case' 0 N--CA 1.525 3.298 0 CA-C-N 119.484 1.038 . . . . 0.0 111.62 -178.666 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -41.77 -36.55 1.03 Allowed 'General case' 1 N--CA 1.549 4.511 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -178.174 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 14.1 t30 -74.12 -39.97 62.99 Favored 'General case' 0 N--CA 1.532 3.642 0 CA-C-N 118.112 0.415 . . . . 0.0 111.035 -178.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -46.3 -54.38 9.04 Favored 'General case' 0 N--CA 1.537 3.886 0 C-N-CA 124.824 1.25 . . . . 0.0 113.409 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -133.23 -39.88 0.92 Allowed 'General case' 0 N--CA 1.533 3.683 0 CA-C-O 118.63 -0.7 . . . . 0.0 111.835 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 117.77 86.79 1.17 Allowed Glycine 1 N--CA 1.523 4.486 0 N-CA-C 110.51 -1.036 . . . . 0.0 110.51 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -115.92 -47.1 2.8 Favored 'General case' 0 N--CA 1.522 3.152 0 C-N-CA 123.613 0.765 . . . . 0.0 109.397 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.99 161.67 22.84 Favored Glycine 1 N--CA 1.525 4.629 0 N-CA-C 109.771 -1.331 . . . . 0.0 109.771 -179.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.576 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.9 OUTLIER -83.11 -14.98 11.76 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.858 0 CA-C-N 119.439 1.619 . . . . 0.0 108.133 177.781 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.939 ' HB2' ' H62' ' E' ' 15' ' ' ' DA' . . . -70.94 -30.72 67.11 Favored 'General case' 0 N--CA 1.518 2.949 0 CA-C-O 117.463 -1.256 . . . . 0.0 111.239 177.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.9 p -93.4 -36.38 12.52 Favored 'General case' 1 N--CA 1.545 4.316 0 CA-C-N 120.45 1.477 . . . . 0.0 112.133 -179.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.605 HG21 HD23 ' A' ' 71' ' ' LEU . 1.0 OUTLIER -73.93 -25.38 20.24 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.056 0 CA-C-O 118.101 -0.952 . . . . 0.0 111.898 -179.122 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.5 p -103.95 -29.67 10.79 Favored 'General case' 0 N--CA 1.513 2.697 0 CA-C-O 117.954 -1.022 . . . . 0.0 110.554 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.0 ptt180 -73.28 -25.59 60.74 Favored 'General case' 1 N--CA 1.545 4.287 0 CA-C-N 120.042 1.292 . . . . 0.0 108.154 173.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -64.71 -27.58 72.18 Favored Glycine 1 N--CA 1.524 4.543 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 174.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 20.1 m -70.33 -35.47 73.63 Favored 'General case' 0 N--CA 1.535 3.795 0 CA-C-N 117.973 0.886 . . . . 0.0 108.753 176.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -60.92 -30.69 70.35 Favored 'General case' 1 N--CA 1.542 4.143 0 C-N-CA 123.457 0.703 . . . . 0.0 110.096 177.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.481 ' HB3' ' HA ' ' B' ' 541' ' ' LEU . 1.6 m -64.76 -38.14 89.98 Favored 'General case' 0 N--CA 1.533 3.711 0 C-N-CA 123.509 0.723 . . . . 0.0 110.716 179.33 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.8 mt -53.39 -37.91 62.9 Favored 'General case' 0 N--CA 1.538 3.935 0 C-N-CA 123.734 0.813 . . . . 0.0 111.135 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -68.27 -36.3 79.19 Favored 'General case' 0 N--CA 1.534 3.755 0 C-N-CA 123.096 0.558 . . . . 0.0 111.174 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.67 -36.77 81.32 Favored 'General case' 0 N--CA 1.525 3.276 0 C-N-CA 123.216 0.607 . . . . 0.0 111.905 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.35 158.41 88.06 Favored Pre-proline 0 N--CA 1.526 3.363 0 CA-C-O 118.535 -0.745 . . . . 0.0 111.851 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -86.46 -178.54 2.75 Favored 'Trans proline' 0 CA--C 1.563 1.972 0 C-N-CA 122.331 2.021 . . . . 0.0 111.189 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.446 ' HA ' ' HB3' ' A' ' 97' ' ' ARG . 3.1 t -97.04 -28.76 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.101 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.773 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -59.78 -45.22 92.94 Favored 'General case' 0 N--CA 1.514 2.762 0 CA-C-N 119.666 1.121 . . . . 0.0 110.009 -178.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.587 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.6 mp -100.02 -11.63 20.42 Favored 'General case' 0 N--CA 1.511 2.591 0 CA-C-O 118.307 -0.854 . . . . 0.0 112.706 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.446 ' HB3' ' HA ' ' A' ' 94' ' ' VAL . 0.2 OUTLIER -67.56 -30.84 70.58 Favored 'General case' 1 N--CA 1.544 4.269 0 N-CA-C 102.368 -3.197 . . . . 0.0 102.368 167.849 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -56.67 -38.54 72.37 Favored 'General case' 0 N--CA 1.515 2.823 0 C-N-CA 124.134 0.973 . . . . 0.0 110.277 175.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.646 ' CH2' ' HB2' ' B' ' 529' ' ' ALA . 53.5 t90 -66.45 -34.22 77.45 Favored 'General case' 0 N--CA 1.538 3.963 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 176.282 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.52 -37.15 62.53 Favored 'General case' 0 N--CA 1.535 3.775 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 176.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -68.06 -38.94 83.0 Favored 'General case' 1 N--CA 1.541 4.089 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 175.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.51 -23.8 58.99 Favored 'General case' 1 N--CA 1.544 4.247 0 C-N-CA 123.459 0.704 . . . . 0.0 110.643 175.734 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.504 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -120.88 2.73 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.493 0 C-N-CA 123.375 0.67 . . . . 0.0 112.617 -177.143 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -109.57 -56.95 2.24 Favored 'General case' 0 N--CA 1.518 2.935 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 177.117 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.3 tp -50.2 -44.93 53.24 Favored 'General case' 0 N--CA 1.531 3.591 0 C-N-CA 125.149 1.38 . . . . 0.0 111.491 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -80.6 -55.59 4.75 Favored 'General case' 0 N--CA 1.524 3.267 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 N--CA 1.523 3.189 0 CA-C-O 118.761 -0.638 . . . . 0.0 109.992 -179.584 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.503 2.185 0 CA-C-O 119.209 -0.424 . . . . 0.0 109.914 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 58.5 m -110.01 109.57 59.04 Favored Pre-proline 0 N--CA 1.518 2.938 0 CA-C-O 118.031 -0.985 . . . . 0.0 108.666 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -70.09 130.8 19.55 Favored 'Trans proline' 0 C--N 1.394 2.943 0 C-N-CA 122.696 2.264 . . . . 0.0 110.443 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -99.72 140.57 33.73 Favored 'General case' 0 N--CA 1.524 3.272 0 C-N-CA 122.878 0.471 . . . . 0.0 110.579 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 60.8 m 67.35 -82.45 0.03 OUTLIER 'General case' 0 N--CA 1.528 3.432 0 C-N-CA 125.067 1.347 . . . . 0.0 112.627 178.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -114.92 167.09 11.09 Favored 'General case' 0 N--CA 1.53 3.57 0 CA-C-N 119.549 1.068 . . . . 0.0 112.993 -177.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -118.57 144.34 46.17 Favored 'General case' 0 N--CA 1.526 3.341 0 C-N-CA 123.675 0.79 . . . . 0.0 110.678 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 31.7 mtt -100.54 149.39 23.76 Favored 'General case' 0 N--CA 1.537 3.883 0 C-N-CA 123.155 0.582 . . . . 0.0 110.553 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -136.8 -53.64 0.71 Allowed 'General case' 0 N--CA 1.524 3.232 0 CA-C-O 118.965 -0.54 . . . . 0.0 111.208 -179.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -103.52 149.77 24.55 Favored 'General case' 0 N--CA 1.533 3.695 0 CA-C-N 118.439 0.563 . . . . 0.0 111.989 -178.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -148.32 132.03 16.93 Favored 'General case' 0 N--CA 1.526 3.352 0 C-N-CA 123.519 0.728 . . . . 0.0 109.449 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 86.8 mtt-85 65.79 134.49 0.02 OUTLIER 'General case' 1 N--CA 1.542 4.166 0 C-N-CA 124.601 1.16 . . . . 0.0 110.707 -179.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 -152.53 118.93 5.59 Favored 'General case' 0 N--CA 1.527 3.395 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 178.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -104.22 136.08 44.49 Favored 'General case' 0 N--CA 1.525 3.324 0 C-N-CA 122.744 0.417 . . . . 0.0 110.965 -178.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -128.55 -61.23 1.08 Allowed 'General case' 0 N--CA 1.52 3.047 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 178.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 519' ' ' TRP . . . . . 0.727 ' CE2' HD22 ' A' ' 39' ' ' LEU . 63.1 t-105 -42.54 -26.43 0.12 Allowed 'General case' 1 N--CA 1.552 4.64 0 C-N-CA 124.558 1.143 . . . . 0.0 113.753 178.523 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 520' ' ' LEU . . . . . 0.54 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.4 mm? -93.88 -34.29 13.18 Favored 'General case' 0 N--CA 1.526 3.369 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -172.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.58 -25.02 68.04 Favored 'General case' 0 N--CA 1.534 3.755 0 N-CA-C 106.291 -1.744 . . . . 0.0 106.291 172.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . 0.459 ' CE2' ' HA2' ' A' ' 52' ' ' GLY . 2.2 m-85 -78.74 -37.33 41.56 Favored 'General case' 0 N--CA 1.513 2.716 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 173.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 523' ' ' VAL . . . . . 0.47 HG23 ' O ' ' B' ' 519' ' ' TRP . 25.4 t -66.4 -23.35 31.46 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.232 0 CA-C-N 120.169 1.349 . . . . 0.0 111.646 179.103 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -75.19 -49.38 19.61 Favored 'General case' 0 N--CA 1.536 3.849 0 CA-C-N 120.063 1.301 . . . . 0.0 108.345 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 1.8 tp -65.5 -29.31 69.94 Favored 'General case' 1 N--CA 1.54 4.05 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 176.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 526' ' ' LEU . . . . . 0.443 HD23 ' O ' ' B' ' 522' ' ' PHE . 0.9 OUTLIER -68.41 -33.05 73.54 Favored 'General case' 0 N--CA 1.522 3.171 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 177.128 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 527' ' ' LYS . . . . . 0.447 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 31.0 ttmt -65.89 -25.52 67.21 Favored 'General case' 0 N--CA 1.519 3.01 0 CA-C-O 118.387 -0.816 . . . . 0.0 111.144 177.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -69.22 -39.94 78.28 Favored 'General case' 0 N--CA 1.536 3.829 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 176.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 529' ' ' ALA . . . . . 0.646 ' HB2' ' CH2' ' A' ' 99' ' ' TRP . . . -88.63 -9.5 51.93 Favored 'General case' 0 N--CA 1.506 2.367 0 CA-C-O 118.417 -0.802 . . . . 0.0 111.295 178.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 530' ' ' TYR . . . . . 0.447 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.9 OUTLIER -81.61 -32.9 31.79 Favored 'General case' 0 N--CA 1.532 3.625 0 CA-C-N 120.439 1.472 . . . . 0.0 108.733 -179.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -61.6 -44.43 97.02 Favored 'General case' 0 N--CA 1.538 3.944 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 176.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 61.4 m-80 -91.56 -86.45 0.22 Allowed 'General case' 0 N--CA 1.517 2.878 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 177.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 150.72 52.41 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.855 0 C-N-CA 128.027 2.531 . . . . 0.0 107.818 178.179 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 534' ' ' LEU . . . . . 0.587 HD22 ' CD2' ' A' ' 96' ' ' LEU . 4.8 mt -111.08 10.65 22.02 Favored 'General case' 0 N--CA 1.528 3.429 0 C-N-CA 124.558 1.143 . . . . 0.0 110.831 -178.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 535' ' ' HIS . . . . . 0.611 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 39.9 p-80 -82.43 -0.32 45.67 Favored 'General case' 0 N--CA 1.517 2.888 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 174.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 536' ' ' LEU . . . . . 0.469 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 34.6 mt -93.96 -51.63 0.26 Allowed Pre-proline 0 N--CA 1.504 2.266 0 CA-C-O 116.728 -1.606 . . . . 0.0 108.952 -175.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 537' ' ' PRO . . . . . 0.469 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 6.3 Cg_exo -66.19 -33.86 38.43 Favored 'Trans proline' 0 C--N 1.394 2.941 0 C-N-CA 122.158 1.906 . . . . 0.0 107.235 171.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 538' ' ' LEU . . . . . 0.438 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 0.6 OUTLIER -64.07 -45.69 87.6 Favored 'General case' 0 N--CA 1.521 3.108 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 176.292 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . 0.262 2.2 pp -81.89 -2.86 52.67 Favored 'General case' 1 N--CA 1.542 4.161 0 CA-C-N 118.824 0.738 . . . . 0.0 111.9 178.392 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -81.51 -12.01 58.99 Favored 'General case' 0 N--CA 1.518 2.946 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 172.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 541' ' ' LEU . . . . . 0.629 HD13 ' N ' ' B' ' 542' ' ' MET . 0.0 OUTLIER -108.3 -45.05 3.99 Favored 'General case' 0 N--CA 1.512 2.635 0 C-N-CA 124.476 1.11 . . . . 0.0 109.639 -178.838 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 542' ' ' MET . . . . . 0.629 ' N ' HD13 ' B' ' 541' ' ' LEU . 12.2 ptp -84.51 -28.28 26.81 Favored 'General case' 1 N--CA 1.546 4.326 0 CA-C-O 117.61 -1.186 . . . . 0.0 111.988 -178.939 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 5.7 mp -107.35 -99.14 0.36 Allowed 'General case' 0 N--CA 1.527 3.392 0 CA-C-O 117.111 -1.423 . . . . 0.0 112.759 -176.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 544' ' ' THR . . . . . 0.428 HG23 ' HG3' ' B' ' 547' ' ' GLU . 3.1 t 153.77 147.48 0.0 OUTLIER Pre-proline 1 N--CA 1.574 5.774 0 C-N-CA 126.224 1.809 . . . . 0.0 109.023 -177.855 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -58.67 -34.33 98.84 Favored 'Trans proline' 0 N--CA 1.524 3.301 0 C-N-CA 123.32 2.68 . . . . 0.0 113.502 -179.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -57.79 -30.02 65.35 Favored 'General case' 1 N--CA 1.542 4.135 0 CA-C-N 118.508 0.594 . . . . 0.0 111.479 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 547' ' ' GLU . . . . . 0.428 ' HG3' HG23 ' B' ' 544' ' ' THR . 39.4 mt-10 -67.86 -38.5 83.19 Favored 'General case' 0 N--CA 1.526 3.33 0 CA-C-O 118.307 -0.854 . . . . 0.0 110.6 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 548' ' ' ARG . . . . . 0.439 ' HB2' ' HB2' ' A' ' 19' ' ' TRP . 4.2 ptt180 -76.44 -20.85 56.64 Favored 'General case' 0 N--CA 1.529 3.492 0 CA-C-O 118.135 -0.936 . . . . 0.0 111.289 178.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -65.57 -49.37 69.08 Favored 'General case' 0 N--CA 1.537 3.908 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 174.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -77.58 -13.88 59.8 Favored 'General case' 0 N--CA 1.511 2.598 0 CA-C-O 117.073 -1.441 . . . . 0.0 111.817 178.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 551' ' ' LEU . . . . . 0.663 HD22 ' CE3' ' A' ' 19' ' ' TRP . 11.7 tp -79.13 -30.39 43.66 Favored 'General case' 0 N--CA 1.53 3.529 0 CA-C-N 120.817 1.644 . . . . 0.0 107.73 175.028 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -71.15 -56.9 6.56 Favored Glycine 0 N--CA 1.498 2.783 0 N-CA-C 108.949 -1.661 . . . . 0.0 108.949 178.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 3.1 m -64.43 -31.29 72.44 Favored 'General case' 1 N--CA 1.541 4.092 0 CA-C-O 118.337 -0.839 . . . . 0.0 112.059 -179.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -65.5 -50.6 64.69 Favored 'General case' 1 N--CA 1.546 4.369 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 176.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 555' ' ' VAL . . . . . 0.44 HG23 ' O ' ' B' ' 551' ' ' LEU . 32.0 t -66.05 -15.98 19.87 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.849 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.03 177.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 18.6 mmt180 -79.82 -44.32 20.79 Favored 'General case' 0 N--CA 1.526 3.363 0 CA-C-O 117.327 -1.321 . . . . 0.0 111.319 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 557' ' ' ILE . . . . . 0.47 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -72.81 -24.58 21.41 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.186 0 CA-C-N 121.425 1.921 . . . . 0.0 110.406 -179.757 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 558' ' ' VAL . . . . . 0.47 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.0 OUTLIER -86.22 -53.47 10.3 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.073 0 CA-C-N 119.997 1.271 . . . . 0.0 107.635 -179.739 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -61.36 -22.04 64.58 Favored 'General case' 0 N--CA 1.532 3.636 0 CA-C-O 118.497 -0.763 . . . . 0.0 110.971 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -93.81 -24.78 17.65 Favored 'General case' 0 N--CA 1.523 3.183 0 CA-C-O 118.081 -0.961 . . . . 0.0 110.07 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 14.3 tp -71.01 -53.77 13.6 Favored 'General case' 0 N--CA 1.535 3.813 0 CA-C-N 119.708 1.14 . . . . 0.0 108.255 178.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 36.5 mt -48.62 -30.1 5.04 Favored 'General case' 1 N--CA 1.543 4.218 0 C-N-CA 124.157 0.983 . . . . 0.0 112.583 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 20.5 mmm180 -79.68 -49.89 11.44 Favored 'General case' 0 N--CA 1.53 3.546 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 72.11 89.19 0.13 Allowed Glycine 1 N--CA 1.52 4.274 0 CA-C-O 119.346 -0.697 . . . . 0.0 111.822 178.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -155.87 -55.82 0.09 Allowed 'General case' 0 N--CA 1.528 3.428 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 2.1 ptt? -147.84 66.34 1.11 Allowed 'General case' 0 N--CA 1.527 3.388 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 178.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 7.6 t -125.55 -15.41 6.09 Favored 'General case' 0 N--CA 1.519 3.001 0 CA-C-O 117.484 -1.246 . . . . 0.0 114.05 -176.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -98.81 -55.43 2.72 Favored 'General case' 0 N--CA 1.533 3.703 0 CA-C-N 120.803 1.638 . . . . 0.0 111.582 -178.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -107.49 -38.48 5.91 Favored 'General case' 0 N--CA 1.532 3.641 0 C-N-CA 123.433 0.693 . . . . 0.0 111.728 -177.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -81.52 -8.71 59.76 Favored 'General case' 0 N--CA 1.518 2.966 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -176.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 571' ' ' LEU . . . . . 0.93 HD23 HD11 ' B' ' 582' ' ' ILE . 26.1 tp -85.85 -48.6 8.61 Favored 'General case' 0 N--CA 1.535 3.783 0 CA-C-N 120.306 1.412 . . . . 0.0 112.973 -177.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -45.57 -29.54 1.22 Allowed 'General case' 1 N--CA 1.555 4.784 0 CA-C-N 120.23 1.377 . . . . 0.0 113.866 -177.517 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -67.09 -41.53 86.15 Favored 'General case' 1 N--CA 1.54 4.034 0 CA-C-N 118.819 0.736 . . . . 0.0 110.26 -179.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -48.41 -62.22 1.61 Allowed 'General case' 0 N--CA 1.529 3.5 0 C-N-CA 125.167 1.387 . . . . 0.0 113.157 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 575' ' ' LEU . . . . . 0.544 HD11 ' HB2' ' B' ' 577' ' ' ALA . 3.4 pp -119.09 -39.76 2.89 Favored 'General case' 0 N--CA 1.532 3.666 0 CA-C-N 118.736 0.698 . . . . 0.0 111.705 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 120.62 37.24 0.74 Allowed Glycine 1 N--CA 1.527 4.729 0 CA-C-O 118.572 -1.127 . . . . 0.0 111.953 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 577' ' ' ALA . . . . . 0.544 ' HB2' HD11 ' B' ' 575' ' ' LEU . . . -89.23 108.52 19.66 Favored 'General case' 0 N--CA 1.521 3.109 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 177.661 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -43.13 170.33 0.01 OUTLIER Glycine 1 N--CA 1.53 4.903 0 C-N-CA 125.095 1.331 . . . . 0.0 115.685 -177.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 579' ' ' ILE . . . . . 0.61 HG21 ' N6 ' ' E' ' 4' ' ' ' DA' . 0.5 OUTLIER -84.14 -15.57 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.642 0 CA-C-O 117.549 -1.215 . . . . 0.0 108.724 177.464 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 580' ' ' ALA . . . . . 0.822 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -70.09 -38.65 75.72 Favored 'General case' 0 N--CA 1.523 3.217 0 CA-C-N 120.213 1.37 . . . . 0.0 108.951 176.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -79.66 -36.3 37.93 Favored 'General case' 0 N--CA 1.539 3.996 0 CA-C-N 118.609 0.641 . . . . 0.0 112.247 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 582' ' ' ILE . . . . . 0.93 HD11 HD23 ' B' ' 571' ' ' LEU . 1.6 tt -71.01 -37.67 68.69 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.212 0 C-N-CA 122.9 0.48 . . . . 0.0 111.601 -175.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 65.0 p -98.25 -23.56 15.61 Favored 'General case' 0 N--CA 1.512 2.633 0 CA-C-O 117.968 -1.015 . . . . 0.0 111.746 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 13.8 ptt180 -79.7 -22.06 43.85 Favored 'General case' 0 N--CA 1.531 3.622 0 CA-C-N 120.164 1.347 . . . . 0.0 108.355 173.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -65.36 -33.63 87.14 Favored Glycine 1 N--CA 1.519 4.214 0 N-CA-C 108.975 -1.65 . . . . 0.0 108.975 175.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 83.0 p -64.1 -32.79 74.48 Favored 'General case' 0 N--CA 1.537 3.9 0 CA-C-N 118.224 1.012 . . . . 0.0 109.97 176.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -62.1 -31.53 71.99 Favored 'General case' 0 N--CA 1.538 3.962 0 C-N-CA 123.501 0.72 . . . . 0.0 110.826 178.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 50.3 m -63.17 -43.19 98.95 Favored 'General case' 1 N--CA 1.541 4.096 0 C-N-CA 123.379 0.672 . . . . 0.0 110.318 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 36.1 mt -54.86 -44.74 74.27 Favored 'General case' 0 N--CA 1.527 3.38 0 C-N-CA 124.015 0.926 . . . . 0.0 110.96 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -29.08 66.67 Favored 'General case' 0 N--CA 1.537 3.876 0 CA-C-O 118.76 -0.638 . . . . 0.0 111.135 178.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -64.84 -42.9 94.54 Favored 'General case' 0 N--CA 1.528 3.47 0 CA-C-N 118.737 0.699 . . . . 0.0 110.957 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -65.44 162.7 39.41 Favored Pre-proline 0 N--CA 1.534 3.767 0 CA-C-O 118.426 -0.797 . . . . 0.0 112.165 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 593' ' ' PRO . . . . . 0.43 ' O ' ' HB2' ' B' ' 597' ' ' ARG . 37.9 Cg_endo -79.23 179.77 6.13 Favored 'Trans proline' 0 C--N 1.38 2.185 0 C-N-CA 122.02 1.813 . . . . 0.0 111.081 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -94.27 -26.36 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.306 0 CA-C-O 118.01 -0.995 . . . . 0.0 111.495 -178.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -61.39 -45.1 95.77 Favored 'General case' 0 N--CA 1.517 2.898 0 CA-C-N 119.837 1.198 . . . . 0.0 109.47 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 596' ' ' LEU . . . . . 0.456 HD12 ' N ' ' B' ' 596' ' ' LEU . 6.9 mp -97.06 -9.09 28.78 Favored 'General case' 0 N--CA 1.508 2.466 0 C-N-CA 123.233 0.613 . . . . 0.0 111.843 179.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' B' ' 593' ' ' PRO . 0.0 OUTLIER -64.68 -39.18 93.22 Favored 'General case' 1 N--CA 1.548 4.464 0 N-CA-C 102.516 -3.142 . . . . 0.0 102.516 167.456 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -49.84 -36.77 27.96 Favored 'General case' 0 N--CA 1.519 2.985 0 C-N-CA 124.311 1.044 . . . . 0.0 111.676 174.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 599' ' ' TRP . . . . . 0.661 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 39.0 t90 -64.5 -40.67 96.09 Favored 'General case' 0 N--CA 1.528 3.468 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 178.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 10.6 mp -54.17 -32.83 56.55 Favored 'General case' 1 N--CA 1.544 4.228 0 CA-C-N 118.92 0.782 . . . . 0.0 109.226 176.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -74.96 -34.56 62.05 Favored 'General case' 0 N--CA 1.528 3.468 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 176.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 602' ' ' GLU . . . . . 0.452 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.5 OUTLIER -63.99 -22.77 67.07 Favored 'General case' 1 N--CA 1.549 4.501 0 C-N-CA 124.903 1.281 . . . . 0.0 111.405 175.969 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' B' B ' 603' ' ' VAL . . . . . 0.546 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.0 OUTLIER -108.8 -20.77 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.611 0 CA-C-O 118.01 -0.995 . . . . 0.0 112.231 -175.067 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 7.2 mp -88.78 -58.68 2.46 Favored 'General case' 0 N--CA 1.523 3.193 0 N-CA-C 105.499 -2.038 . . . . 0.0 105.499 175.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -76.3 -66.06 0.85 Allowed 'General case' 0 N--CA 1.528 3.457 0 C-N-CA 123.636 0.774 . . . . 0.0 110.658 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 82.5 mttt 89.48 -52.66 0.02 OUTLIER 'General case' 1 N--CA 1.544 4.248 0 C-N-CA 127.265 2.226 . . . . 0.0 109.061 -177.373 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 7.6 t . . . . . 0 N--CA 1.523 3.2 0 CA-C-O 118.013 -0.994 . . . . 0.0 109.795 179.852 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.166 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 998' ' ' TRP . . . . . 0.443 ' CZ3' HD11 ' B' ' 557' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.17 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.423 -9.543 3 O4'-C1'-N19 119.44 14.55 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.591 5 O4'-C1'-N19 119.902 15.128 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.42 -9.798 3 O4'-C1'-N19 119.732 14.914 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . 0.57 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 6 C3'--C2' 1.416 -10.242 3 O4'-C1'-N19 120.369 15.711 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' E' E ' 5' ' ' ' DC' . . . . . 0.505 ' H41' ' HA ' ' B' ' 580' ' ' ALA . . . . . . . . 5 O3'--C3' 1.564 10.193 3 C4'-C3'-C2' 117.188 13.988 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.406 -11.229 5 O4'-C1'-N19 119.787 14.984 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' E' E ' 7' ' ' ' DA' . . . . . 0.754 H2'' " H5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.4 -11.812 4 C4'-C3'-C2' 114.279 11.079 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' E' E ' 8' ' ' ' DG' . . . . . 0.754 " H5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 O3'--C3' 1.559 9.835 4 O4'-C1'-N19 117.886 12.607 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 O3'--C3' 1.579 11.356 5 O4'-C1'-N19 119.469 14.586 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.404 -11.394 6 O4'-C1'-N19 119.526 14.657 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.402 -11.566 4 O4'-C1'-N19 120.382 15.727 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.505 3 O4'-C1'-N19 120.383 15.728 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.594 4 O4'-C1'-N19 118.886 13.858 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' E' E ' 14' ' ' ' DT' . . . . . 0.777 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 O3'--C3' 1.567 10.489 4 C4'-C3'-C2' 117.012 13.812 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' E' E ' 15' ' ' ' DA' . . . . . 0.853 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.425 -9.347 5 O4'-C1'-N19 119.35 14.438 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.418 -10.002 3 O4'-C1'-N19 120.196 15.495 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.563 10.18 2 O4'-C1'-N19 119.424 14.53 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.604 4 O4'-C1'-N19 120.013 15.266 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.42 -9.784 4 O4'-C1'-N19 119.629 14.786 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.505 6.538 3 O4'-C1'-N19 119.577 14.721 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.179 2 O4'-C1'-N19 119.494 14.618 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.571 10.804 5 C4'-C3'-C2' 116.172 12.972 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -10.047 4 O4'-C1'-N19 120.195 15.493 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' F' F ' 4' ' ' ' DA' . . . . . 0.527 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.415 -10.314 2 O4'-C1'-N19 119.168 14.21 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' F' F ' 5' ' ' ' DC' . . . . . 0.575 ' H41' ' HA ' ' A' ' 80' ' ' ALA . . . . . . . . 6 O3'--C3' 1.574 11.032 5 O4'-C1'-N19 119.309 14.386 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.399 -11.851 5 O4'-C1'-N19 118.825 13.782 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' F' F ' 7' ' ' ' DA' . . . . . 0.873 H2'' H5'' ' F' ' 8' ' ' ' DG' . . . . . . . . 4 O3'--C3' 1.572 10.861 3 N19-C1'-C2' 136.11 13.694 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' F' F ' 8' ' ' ' DG' . . . . . 0.873 H5'' H2'' ' F' ' 7' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.41 -10.752 5 O4'-C1'-N19 120.358 15.698 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.416 -10.203 5 O4'-C1'-N19 119.987 15.233 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.405 -11.285 4 O4'-C1'-N19 119.29 14.363 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.415 -10.321 4 O4'-C1'-N19 121.153 16.692 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.146 2 O4'-C1'-N19 120.315 15.644 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.417 -10.096 5 O4'-C1'-N19 119.054 14.068 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' F' F ' 14' ' ' ' DT' . . . . . 0.599 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.41 -10.818 5 O4'-C1'-N19 119.289 14.361 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' F' F ' 15' ' ' ' DA' . . . . . 0.851 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.428 -9.026 3 O4'-C1'-N19 120.194 15.493 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' F' F ' 16' ' ' ' DG' . . . . . 0.455 ' O6 ' HG22 ' B' ' 579' ' ' ILE . . . . . . . . 5 C3'--C2' 1.419 -9.888 4 O4'-C1'-N19 119.026 14.033 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.249 5 O4'-C1'-N19 119.497 14.622 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.174 5 O4'-C1'-N19 120.264 15.579 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.574 5 O4'-C1'-N19 120.747 16.184 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.513 7.192 4 O4'-C1'-N19 120.125 15.407 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 . . . . . 0 N--CA 1.501 2.097 0 N-CA-C 110.693 -0.114 . . . . 0.0 110.693 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 88.9 p 52.7 103.8 0.03 OUTLIER Pre-proline 0 N--CA 1.532 3.633 0 C-N-CA 125.078 1.351 . . . . 0.0 112.888 178.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -82.29 141.6 11.55 Favored 'Trans proline' 0 C--N 1.389 2.691 0 C-N-CA 122.918 2.412 . . . . 0.0 110.668 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -106.12 -63.47 1.26 Allowed 'General case' 0 N--CA 1.521 3.092 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 178.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 7.2 t -136.94 119.61 16.11 Favored 'General case' 0 N--CA 1.522 3.148 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -145.5 -50.94 0.25 Allowed 'General case' 0 N--CA 1.52 3.062 0 CA-C-O 119.169 -0.443 . . . . 0.0 111.332 -178.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -100.45 -54.29 2.89 Favored 'General case' 0 N--CA 1.524 3.262 0 CA-C-O 119.262 -0.399 . . . . 0.0 111.348 -178.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 14.1 ttt 67.39 126.45 0.02 OUTLIER 'General case' 1 N--CA 1.54 4.064 0 C-N-CA 124.207 1.003 . . . . 0.0 109.858 -179.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -108.06 154.57 21.48 Favored 'General case' 0 N--CA 1.528 3.429 0 C-N-CA 123.162 0.585 . . . . 0.0 111.669 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -83.73 -51.19 7.45 Favored 'General case' 0 N--CA 1.523 3.213 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -108.67 144.26 36.67 Favored 'General case' 0 N--CA 1.53 3.556 0 C-N-CA 123.171 0.588 . . . . 0.0 110.578 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -116.59 126.78 53.77 Favored 'General case' 0 N--CA 1.521 3.087 0 C-N-CA 123.605 0.762 . . . . 0.0 109.314 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.2 t60 60.46 155.64 0.03 OUTLIER 'General case' 1 N--CA 1.54 4.046 0 C-N-CA 124.746 1.218 . . . . 0.0 112.311 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -92.02 149.86 21.29 Favored 'General case' 0 N--CA 1.537 3.908 0 C-N-CA 122.89 0.476 . . . . 0.0 110.762 -179.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -115.13 -90.39 0.54 Allowed 'General case' 0 N--CA 1.521 3.092 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.811 ' CE3' HD22 ' B' ' 551' ' ' LEU . 74.4 t-105 -50.62 -39.5 50.37 Favored 'General case' 0 N--CA 1.538 3.945 0 CA-C-N 119.572 1.078 . . . . 0.0 110.969 178.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.441 HD22 ' N ' ' A' ' 20' ' ' LEU . 2.2 mm? -81.18 -27.7 35.28 Favored 'General case' 0 N--CA 1.524 3.271 0 CA-C-O 117.792 -1.099 . . . . 0.0 112.387 -174.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.31 -28.12 66.51 Favored 'General case' 1 N--CA 1.54 4.072 0 N-CA-C 106.306 -1.738 . . . . 0.0 106.306 172.338 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.577 ' CG ' HD21 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -82.52 -37.46 25.21 Favored 'General case' 0 N--CA 1.503 2.215 0 CA-C-O 116.755 -1.593 . . . . 0.0 108.822 173.778 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.9 t -67.06 -25.37 34.01 Favored 'Isoleucine or valine' 1 N--CA 1.563 5.215 0 CA-C-N 121.283 1.856 . . . . 0.0 112.444 -176.255 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -78.03 -51.46 10.29 Favored 'General case' 0 N--CA 1.534 3.736 0 CA-C-N 119.901 1.228 . . . . 0.0 107.916 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.94 -19.83 65.79 Favored 'General case' 0 N--CA 1.537 3.889 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 176.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.36 -40.4 67.35 Favored 'General case' 0 N--CA 1.515 2.797 0 CA-C-O 117.873 -1.06 . . . . 0.0 108.153 177.465 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.444 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 20.2 mttt -59.77 -20.96 59.9 Favored 'General case' 0 N--CA 1.531 3.603 0 CA-C-O 118.3 -0.857 . . . . 0.0 111.42 176.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -73.6 -43.63 59.2 Favored 'General case' 0 N--CA 1.531 3.603 0 CA-C-N 119.273 0.942 . . . . 0.0 108.684 176.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.649 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -89.5 -1.53 58.07 Favored 'General case' 0 N--CA 1.511 2.6 0 CA-C-O 118.818 -0.61 . . . . 0.0 110.843 177.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.444 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -89.03 -34.64 16.73 Favored 'General case' 0 N--CA 1.533 3.683 0 CA-C-N 120.003 1.274 . . . . 0.0 108.594 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -65.04 -40.58 94.98 Favored 'General case' 0 N--CA 1.532 3.635 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 176.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 -89.99 -89.46 0.16 Allowed 'General case' 0 N--CA 1.513 2.709 0 N-CA-C 106.766 -1.568 . . . . 0.0 106.766 176.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 p30 153.11 44.64 0.0 OUTLIER 'General case' 1 N--CA 1.561 5.103 0 C-N-CA 127.504 2.322 . . . . 0.0 109.034 177.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.61 HD22 ' CD2' ' B' ' 596' ' ' LEU . 9.1 mt -103.08 15.14 30.16 Favored 'General case' 0 N--CA 1.524 3.268 0 C-N-CA 123.966 0.907 . . . . 0.0 110.901 -179.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.597 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 54.5 p-80 -84.91 5.5 28.71 Favored 'General case' 0 CA--C 1.594 2.648 0 C-N-CA 123.38 0.672 . . . . 0.0 109.22 174.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.519 HD23 HD12 ' A' ' 39' ' ' LEU . 18.9 mt -95.53 -49.58 0.25 Allowed Pre-proline 0 N--CA 1.508 2.466 0 C-N-CA 125.792 1.637 . . . . 0.0 109.031 -175.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.456 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 4.4 Cg_exo -67.21 -37.32 18.64 Favored 'Trans proline' 0 C--N 1.388 2.64 0 N-CA-C 106.053 -2.326 . . . . 0.0 106.053 169.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.597 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 1.9 tm? -60.64 -36.75 79.42 Favored 'General case' 0 N--CA 1.53 3.565 0 C-N-CA 124.058 0.943 . . . . 0.0 108.839 175.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.742 HD11 ' CE2' ' B' ' 519' ' ' TRP . 0.5 OUTLIER -59.18 -49.43 77.9 Favored 'General case' 1 N--CA 1.553 4.71 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 176.134 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.5 t30 -59.28 -15.59 16.63 Favored 'General case' 0 N--CA 1.536 3.832 0 CA-C-O 118.113 -0.946 . . . . 0.0 113.52 -178.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.457 HD23 ' HA ' ' A' ' 38' ' ' LEU . 0.7 OUTLIER -103.72 -46.77 4.42 Favored 'General case' 0 N--CA 1.522 3.133 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 -177.178 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.3 ptt? -122.04 14.87 10.71 Favored 'General case' 1 N--CA 1.554 4.748 0 CA-C-N 120.014 1.279 . . . . 0.0 113.016 -174.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.7 mp -123.06 -48.97 1.97 Allowed 'General case' 0 N--CA 1.494 1.725 0 CA-C-O 117.702 -1.142 . . . . 0.0 110.432 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.425 ' CG2' ' HB2' ' B' ' 998' ' ' TRP . 77.5 p 107.27 158.94 0.0 OUTLIER Pre-proline 1 N--CA 1.566 5.333 0 C-N-CA 127.642 2.377 . . . . 0.0 110.919 -179.171 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo -71.86 -32.14 11.8 Favored 'Trans proline' 0 C--N 1.391 2.789 0 C-N-CA 122.145 1.897 . . . . 0.0 107.371 172.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -69.03 -14.79 63.24 Favored 'General case' 0 N--CA 1.521 3.114 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.695 176.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -77.94 -40.74 38.54 Favored 'General case' 0 N--CA 1.514 2.744 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 177.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.9 ptt-85 -83.36 -11.5 57.56 Favored 'General case' 0 N--CA 1.532 3.662 0 CA-C-N 119.253 0.933 . . . . 0.0 109.933 175.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -74.12 -39.44 63.34 Favored 'General case' 0 N--CA 1.525 3.302 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 174.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.42 ' HB1' ' CZ ' ' A' ' 54' ' ' ARG . . . -84.24 -31.4 25.02 Favored 'General case' 0 N--CA 1.501 2.102 0 CA-C-O 117.432 -1.271 . . . . 0.0 110.357 -179.572 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.414 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 17.9 tp -70.35 -25.53 63.32 Favored 'General case' 1 N--CA 1.545 4.28 0 CA-C-N 120.961 1.71 . . . . 0.0 106.82 173.426 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.449 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -65.28 -73.45 0.59 Allowed Glycine 0 N--CA 1.507 3.382 0 C-N-CA 125.56 1.552 . . . . 0.0 111.295 176.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 m -69.66 -25.56 63.96 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-O 117.736 -1.126 . . . . 0.0 113.159 -177.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.42 ' CZ ' ' HB1' ' A' ' 50' ' ' ALA . 36.7 mtm180 -71.54 -48.34 49.29 Favored 'General case' 0 N--CA 1.53 3.529 0 CA-C-N 120.101 1.319 . . . . 0.0 107.849 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 51' ' ' LEU . 21.6 t -67.06 -18.07 23.64 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.042 0 CA-C-N 119.543 1.065 . . . . 0.0 109.684 175.206 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.82 -48.46 31.16 Favored 'General case' 0 N--CA 1.529 3.52 0 CA-C-N 119.828 1.195 . . . . 0.0 111.559 178.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.416 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -73.93 -24.84 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.555 0 CA-C-N 120.619 1.554 . . . . 0.0 111.378 -178.83 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.56 HG11 HD11 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -85.01 -49.33 15.79 Favored 'Isoleucine or valine' 1 N--CA 1.546 4.354 0 CA-C-N 120.419 1.463 . . . . 0.0 107.666 -179.228 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -62.04 -27.33 68.81 Favored 'General case' 0 N--CA 1.528 3.441 0 CA-C-O 118.917 -0.563 . . . . 0.0 109.961 178.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -91.21 -19.62 22.84 Favored 'General case' 0 N--CA 1.521 3.106 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.683 177.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.2 mt -76.68 -47.09 23.16 Favored 'General case' 0 N--CA 1.537 3.91 0 CA-C-N 119.71 1.141 . . . . 0.0 108.55 178.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 47.4 mt -52.6 -27.6 17.59 Favored 'General case' 0 N--CA 1.539 3.986 0 C-N-CA 124.366 1.066 . . . . 0.0 112.319 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 27.9 mmm180 -92.31 -48.61 6.58 Favored 'General case' 0 N--CA 1.526 3.333 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.4 79.3 0.46 Allowed Glycine 1 N--CA 1.52 4.241 0 CA-C-O 119.433 -0.648 . . . . 0.0 111.933 178.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -143.74 -59.44 0.4 Allowed 'General case' 0 N--CA 1.524 3.265 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 38.5 mtt -137.0 70.62 1.4 Allowed 'General case' 0 N--CA 1.522 3.149 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 178.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.418 ' HA ' HD22 ' A' ' 71' ' ' LEU . 9.7 t -128.77 -25.39 2.84 Favored 'General case' 0 N--CA 1.524 3.237 0 CA-C-O 117.573 -1.203 . . . . 0.0 113.634 -176.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -104.48 -59.89 1.67 Allowed 'General case' 0 N--CA 1.531 3.589 0 CA-C-N 120.166 1.348 . . . . 0.0 112.352 -176.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.79 -62.83 1.37 Allowed 'General case' 0 N--CA 1.527 3.421 0 C-N-CA 122.916 0.486 . . . . 0.0 111.741 -176.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -73.7 -3.54 28.91 Favored 'General case' 0 N--CA 1.52 3.033 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -176.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.59 HD23 HG21 ' A' ' 82' ' ' ILE . 46.2 tp -78.51 -51.38 10.06 Favored 'General case' 0 N--CA 1.525 3.308 0 CA-C-N 120.35 1.432 . . . . 0.0 112.683 -178.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -44.65 -31.29 1.11 Allowed 'General case' 1 N--CA 1.547 4.418 0 CA-C-N 119.612 1.096 . . . . 0.0 113.787 -176.538 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 25.2 t30 -71.67 -41.09 69.14 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-N 118.389 0.54 . . . . 0.0 110.459 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -62.97 -56.43 17.21 Favored 'General case' 0 N--CA 1.524 3.235 0 C-N-CA 124.076 0.95 . . . . 0.0 112.667 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.402 HD12 HD11 ' A' ' 71' ' ' LEU . 42.7 mt -99.54 -53.44 3.2 Favored 'General case' 0 N--CA 1.531 3.599 0 C-N-CA 123.013 0.525 . . . . 0.0 111.6 -177.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 117.23 25.49 3.22 Favored Glycine 1 N--CA 1.525 4.619 0 CA-C-O 118.392 -1.226 . . . . 0.0 111.186 -177.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -93.51 119.93 33.17 Favored 'General case' 0 N--CA 1.515 2.804 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 178.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -45.24 171.3 0.01 OUTLIER Glycine 1 N--CA 1.533 5.103 0 C-N-CA 124.253 0.93 . . . . 0.0 115.07 -178.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.527 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 0.6 OUTLIER -80.21 -17.1 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.907 0 CA-C-O 117.9 -1.047 . . . . 0.0 108.594 178.126 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.853 ' HB2' ' H62' ' E' ' 15' ' ' ' DA' . . . -69.33 -36.12 76.61 Favored 'General case' 0 N--CA 1.524 3.234 0 CA-C-N 119.584 1.083 . . . . 0.0 110.747 178.058 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.7 p -80.21 -42.16 23.82 Favored 'General case' 0 N--CA 1.536 3.864 0 CA-C-N 119.315 0.961 . . . . 0.0 111.526 -179.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.59 HG21 HD23 ' A' ' 71' ' ' LEU . 4.8 pt -71.68 -17.32 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.903 0 CA-C-O 117.597 -1.192 . . . . 0.0 113.632 -177.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 63.3 p -111.85 -28.89 7.88 Favored 'General case' 0 N--CA 1.515 2.821 0 CA-C-N 120.039 1.29 . . . . 0.0 110.833 178.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.6 ptt180 -76.4 -22.01 55.27 Favored 'General case' 0 N--CA 1.524 3.274 0 CA-C-N 119.605 1.093 . . . . 0.0 108.175 174.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -62.13 -36.07 92.42 Favored Glycine 1 N--CA 1.516 4.023 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 177.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 74.5 p -66.5 -33.09 74.92 Favored 'General case' 0 N--CA 1.535 3.783 0 CA-C-N 118.27 1.035 . . . . 0.0 109.971 176.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -61.21 -32.74 72.51 Favored 'General case' 1 N--CA 1.543 4.179 0 C-N-CA 123.474 0.71 . . . . 0.0 111.307 178.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.1 m -58.79 -38.51 78.72 Favored 'General case' 1 N--CA 1.545 4.321 0 C-N-CA 123.5 0.72 . . . . 0.0 111.179 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 12.8 mt -58.86 -41.49 87.12 Favored 'General case' 0 N--CA 1.532 3.647 0 C-N-CA 124.303 1.041 . . . . 0.0 111.084 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.7 -20.54 65.8 Favored 'General case' 1 N--CA 1.539 4.013 0 CA-C-O 118.439 -0.791 . . . . 0.0 112.416 -179.669 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -86.54 -43.7 12.51 Favored 'General case' 0 N--CA 1.514 2.735 0 CA-C-N 118.876 0.762 . . . . 0.0 110.196 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.11 163.9 9.37 Favored Pre-proline 1 N--CA 1.543 4.192 0 CA-C-O 118.09 -0.957 . . . . 0.0 112.508 179.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -84.41 166.74 12.18 Favored 'Trans proline' 0 C--N 1.381 2.268 0 C-N-CA 121.886 1.724 . . . . 0.0 111.131 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 t -91.59 -23.08 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.075 0 CA-C-O 117.663 -1.161 . . . . 0.0 111.374 -179.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -61.15 -42.82 99.24 Favored 'General case' 0 N--CA 1.518 2.955 0 CA-C-N 120.316 1.416 . . . . 0.0 109.894 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.578 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.2 mp -98.08 -13.17 21.15 Favored 'General case' 0 N--CA 1.512 2.647 0 C-N-CA 123.527 0.731 . . . . 0.0 111.851 178.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -32.35 73.68 Favored 'General case' 1 N--CA 1.541 4.081 0 N-CA-C 103.397 -2.816 . . . . 0.0 103.397 167.732 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -53.93 -38.53 65.0 Favored 'General case' 0 N--CA 1.515 2.818 0 C-N-CA 124.735 1.214 . . . . 0.0 110.384 174.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.612 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 48.6 t90 -65.32 -37.94 88.63 Favored 'General case' 0 N--CA 1.53 3.542 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 176.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.35 -36.2 52.95 Favored 'General case' 1 N--CA 1.541 4.125 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 176.402 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -70.69 -38.42 73.71 Favored 'General case' 0 N--CA 1.539 3.989 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 175.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.444 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 2.6 mt-10 -58.62 -22.77 57.4 Favored 'General case' 1 N--CA 1.544 4.226 0 C-N-CA 123.938 0.895 . . . . 0.0 110.926 175.473 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.512 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -110.16 -2.68 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.332 0 CA-C-O 117.968 -1.015 . . . . 0.0 113.482 -175.941 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 7.0 mp -114.04 -61.37 1.75 Allowed 'General case' 0 N--CA 1.523 3.188 0 N-CA-C 106.419 -1.697 . . . . 0.0 106.419 174.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.5 tt -47.52 -55.33 9.38 Favored 'General case' 1 N--CA 1.546 4.37 0 C-N-CA 125.056 1.343 . . . . 0.0 112.875 -178.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.72 -58.63 3.16 Favored 'General case' 0 N--CA 1.53 3.531 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 -179.516 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 5.6 t . . . . . 0 N--CA 1.525 3.305 0 CA-C-O 118.119 -0.944 . . . . 0.0 110.314 -179.961 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 19.4 mm100 . . . . . 0 N--CA 1.504 2.232 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 75.6 m -101.9 122.09 48.51 Favored Pre-proline 0 N--CA 1.522 3.161 0 CA-C-O 117.415 -1.278 . . . . 0.0 109.206 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -76.88 -53.42 0.07 OUTLIER 'Trans proline' 0 C--N 1.391 2.816 0 C-N-CA 122.587 2.191 . . . . 0.0 109.528 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -107.05 128.13 54.09 Favored 'General case' 0 N--CA 1.521 3.112 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 37.9 p -147.35 -49.74 0.18 Allowed 'General case' 0 N--CA 1.523 3.203 0 C-N-CA 122.695 0.398 . . . . 0.0 110.134 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . 66.02 136.64 0.02 OUTLIER 'General case' 0 N--CA 1.537 3.876 0 C-N-CA 124.369 1.068 . . . . 0.0 111.148 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -134.37 144.85 48.47 Favored 'General case' 0 N--CA 1.525 3.313 0 C-N-CA 123.231 0.612 . . . . 0.0 111.017 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 35.1 mtt 65.41 135.55 0.02 OUTLIER 'General case' 0 N--CA 1.539 3.997 0 C-N-CA 124.757 1.223 . . . . 0.0 111.255 179.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -140.94 -49.6 0.43 Allowed 'General case' 0 N--CA 1.522 3.166 0 C-N-CA 122.953 0.501 . . . . 0.0 110.564 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -128.9 131.52 47.6 Favored 'General case' 0 N--CA 1.525 3.317 0 C-N-CA 123.014 0.525 . . . . 0.0 110.051 -179.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 -86.11 125.7 33.66 Favored 'General case' 0 N--CA 1.523 3.211 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 178.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 4.9 ttp180 -148.83 143.85 26.57 Favored 'General case' 0 N--CA 1.529 3.501 0 CA-C-N 117.855 0.298 . . . . 0.0 111.223 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 62.1 102.85 0.03 OUTLIER 'General case' 0 N--CA 1.535 3.79 0 C-N-CA 124.538 1.135 . . . . 0.0 110.626 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 23.4 tt0 -115.47 -102.34 0.42 Allowed 'General case' 0 N--CA 1.517 2.91 0 CA-C-O 117.674 -1.155 . . . . 0.0 108.114 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -149.13 -62.88 0.23 Allowed 'General case' 0 N--CA 1.525 3.324 0 CA-C-N 120.481 1.492 . . . . 0.0 108.324 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 519' ' ' TRP . . . . . 0.742 ' CE2' HD11 ' A' ' 39' ' ' LEU . 63.4 t-105 -42.8 -27.58 0.19 Allowed 'General case' 1 N--CA 1.543 4.198 0 C-N-CA 124.213 1.005 . . . . 0.0 113.667 178.828 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 520' ' ' LEU . . . . . 0.53 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.3 mm? -91.83 -33.38 14.98 Favored 'General case' 0 N--CA 1.523 3.221 0 CA-C-O 117.613 -1.184 . . . . 0.0 113.738 -171.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 16.0 ttp180 -64.79 -23.08 67.13 Favored 'General case' 0 N--CA 1.531 3.594 0 N-CA-C 106.125 -1.806 . . . . 0.0 106.125 171.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . 0.565 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.1 m-85 -78.04 -37.88 45.84 Favored 'General case' 0 N--CA 1.512 2.665 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 173.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 523' ' ' VAL . . . . . 0.423 HG23 ' O ' ' B' ' 519' ' ' TRP . 44.9 t -67.2 -20.09 26.34 Favored 'Isoleucine or valine' 1 N--CA 1.559 4.992 0 CA-C-O 117.799 -1.096 . . . . 0.0 111.352 177.366 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -76.52 -53.2 8.42 Favored 'General case' 0 N--CA 1.531 3.621 0 CA-C-N 120.337 1.426 . . . . 0.0 108.058 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 6.2 mp -67.57 -21.5 65.44 Favored 'General case' 0 N--CA 1.533 3.685 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 175.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 526' ' ' LEU . . . . . 0.421 ' HB2' ' HA ' ' B' ' 523' ' ' VAL . 0.8 OUTLIER -69.78 -36.06 75.41 Favored 'General case' 0 N--CA 1.519 3.02 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 176.507 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 527' ' ' LYS . . . . . 0.408 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 9.6 tttt -67.31 -23.29 65.63 Favored 'General case' 0 N--CA 1.521 3.08 0 CA-C-O 118.409 -0.805 . . . . 0.0 110.905 176.692 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -72.21 -40.87 67.5 Favored 'General case' 0 N--CA 1.533 3.7 0 CA-C-N 119.151 0.887 . . . . 0.0 109.59 178.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 529' ' ' ALA . . . . . 0.612 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -86.79 -13.75 44.24 Favored 'General case' 0 N--CA 1.509 2.49 0 CA-C-O 118.719 -0.658 . . . . 0.0 110.517 178.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 530' ' ' TYR . . . . . 0.408 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.8 OUTLIER -74.99 -29.69 60.95 Favored 'General case' 0 N--CA 1.536 3.838 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 177.696 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -61.94 -49.62 75.39 Favored 'General case' 0 N--CA 1.532 3.659 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 177.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -91.95 -87.93 0.21 Allowed 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 177.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.6 p30 155.8 51.77 0.0 OUTLIER 'General case' 1 N--CA 1.556 4.84 0 C-N-CA 127.325 2.25 . . . . 0.0 107.54 177.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 534' ' ' LEU . . . . . 0.578 HD22 ' CD2' ' A' ' 96' ' ' LEU . 7.1 mt -109.95 11.33 24.12 Favored 'General case' 0 N--CA 1.529 3.523 0 C-N-CA 124.54 1.136 . . . . 0.0 110.988 -178.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 535' ' ' HIS . . . . . 0.555 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 40.7 p-80 -82.9 2.53 34.0 Favored 'General case' 0 N--CA 1.515 2.792 0 C-N-CA 123.419 0.688 . . . . 0.0 109.235 175.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 536' ' ' LEU . . . . . 0.445 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 36.4 mt -97.15 -50.69 0.23 Allowed Pre-proline 0 N--CA 1.509 2.507 0 CA-C-O 116.854 -1.546 . . . . 0.0 109.22 -175.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 537' ' ' PRO . . . . . 0.445 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 3.9 Cg_exo -68.68 -29.93 28.78 Favored 'Trans proline' 0 C--N 1.391 2.795 0 N-CA-C 106.79 -2.042 . . . . 0.0 106.79 171.086 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 538' ' ' LEU . . . . . 0.456 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 0.6 OUTLIER -65.28 -45.32 84.94 Favored 'General case' 0 N--CA 1.512 2.658 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 175.36 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 1.1 pp -76.52 -7.97 56.24 Favored 'General case' 0 N--CA 1.536 3.861 0 CA-C-N 118.992 0.814 . . . . 0.0 111.828 177.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -84.78 -0.69 54.66 Favored 'General case' 0 N--CA 1.525 3.303 0 CA-C-N 119.195 0.907 . . . . 0.0 109.635 175.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 541' ' ' LEU . . . . . 0.621 HD13 ' N ' ' B' ' 542' ' ' MET . 0.0 OUTLIER -118.72 -48.37 2.48 Favored 'General case' 0 N--CA 1.512 2.671 0 C-N-CA 125.039 1.336 . . . . 0.0 108.724 -178.731 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 542' ' ' MET . . . . . 0.621 ' N ' HD13 ' B' ' 541' ' ' LEU . 4.0 ptm -101.3 11.86 38.51 Favored 'General case' 0 N--CA 1.538 3.932 0 CA-C-O 118.584 -0.722 . . . . 0.0 112.83 -178.031 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 543' ' ' LEU . . . . . 0.489 ' O ' HG23 ' B' ' 544' ' ' THR . 0.2 OUTLIER -129.58 -86.24 0.54 Allowed 'General case' 0 N--CA 1.526 3.348 0 CA-C-O 117.322 -1.323 . . . . 0.0 112.182 -179.852 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 544' ' ' THR . . . . . 0.503 HG23 ' HB2' ' A' ' 898' ' ' TRP . 7.8 p 137.08 137.39 0.0 OUTLIER Pre-proline 1 N--CA 1.569 5.515 0 C-N-CA 127.8 2.44 . . . . 0.0 107.289 -178.777 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -62.55 -29.65 78.57 Favored 'Trans proline' 0 N--CA 1.516 2.835 0 C-N-CA 122.839 2.359 . . . . 0.0 112.964 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -62.8 -28.5 70.04 Favored 'General case' 1 N--CA 1.54 4.069 0 CA-C-N 118.744 0.702 . . . . 0.0 111.282 179.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -70.72 -41.87 71.32 Favored 'General case' 0 N--CA 1.525 3.322 0 CA-C-O 118.712 -0.661 . . . . 0.0 109.918 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 548' ' ' ARG . . . . . 0.428 ' HB2' ' HB2' ' A' ' 19' ' ' TRP . 28.8 ptt180 -72.9 -21.97 60.82 Favored 'General case' 0 N--CA 1.529 3.494 0 CA-C-O 118.273 -0.87 . . . . 0.0 111.276 177.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -66.36 -50.88 62.03 Favored 'General case' 1 N--CA 1.54 4.062 0 N-CA-C 106.614 -1.625 . . . . 0.0 106.614 175.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -76.55 -9.86 58.97 Favored 'General case' 0 N--CA 1.508 2.465 0 CA-C-O 117.363 -1.303 . . . . 0.0 111.026 177.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 551' ' ' LEU . . . . . 0.811 HD22 ' CE3' ' A' ' 19' ' ' TRP . 5.8 tp -79.88 -31.5 40.35 Favored 'General case' 0 N--CA 1.516 2.827 0 CA-C-N 120.158 1.344 . . . . 0.0 107.68 174.224 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -70.49 -56.17 7.88 Favored Glycine 0 N--CA 1.51 3.577 0 N-CA-C 108.68 -1.768 . . . . 0.0 108.68 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.5 m -64.88 -27.98 69.23 Favored 'General case' 0 N--CA 1.537 3.882 0 CA-C-O 118.043 -0.979 . . . . 0.0 112.042 -179.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 6.5 mtm180 -69.26 -49.84 52.48 Favored 'General case' 1 N--CA 1.543 4.188 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 176.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 555' ' ' VAL . . . . . 0.406 HG23 ' O ' ' B' ' 551' ' ' LEU . 23.6 t -65.71 -16.89 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.679 0 CA-C-O 118.067 -0.968 . . . . 0.0 109.532 176.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 11.7 mtt180 -78.16 -47.29 18.45 Favored 'General case' 0 N--CA 1.521 3.113 0 CA-C-O 117.43 -1.271 . . . . 0.0 111.257 178.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 557' ' ' ILE . . . . . 0.462 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -70.75 -22.66 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.527 0 CA-C-N 121.456 1.934 . . . . 0.0 110.918 -179.297 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 558' ' ' VAL . . . . . 0.462 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -85.8 -51.05 13.84 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.002 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 179.979 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -57.26 -26.17 60.37 Favored 'General case' 0 N--CA 1.536 3.835 0 CA-C-O 118.543 -0.742 . . . . 0.0 110.178 177.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -90.39 -28.35 18.73 Favored 'General case' 0 N--CA 1.529 3.512 0 CA-C-O 118.586 -0.721 . . . . 0.0 109.749 177.412 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 6.8 mt -66.37 -44.01 84.34 Favored 'General case' 1 N--CA 1.546 4.342 0 CA-C-N 118.96 0.8 . . . . 0.0 109.552 178.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 14.7 mt -60.7 -22.91 64.44 Favored 'General case' 0 N--CA 1.534 3.761 0 C-N-CA 124.159 0.984 . . . . 0.0 111.795 179.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -82.62 -48.36 11.03 Favored 'General case' 0 N--CA 1.525 3.307 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 66.4 79.56 0.2 Allowed Glycine 1 N--CA 1.526 4.641 0 CA-C-O 119.318 -0.712 . . . . 0.0 111.663 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -155.8 -51.57 0.08 Allowed 'General case' 0 N--CA 1.527 3.388 0 CA-C-N 117.463 0.632 . . . . 0.0 109.56 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 10.5 ptt? -152.99 63.33 0.78 Allowed 'General case' 0 N--CA 1.527 3.419 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 78.6 p -130.63 3.19 4.54 Favored 'General case' 0 N--CA 1.522 3.131 0 CA-C-N 115.166 -0.924 . . . . 0.0 113.257 -176.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 42.4 mm-40 -110.02 -55.16 2.48 Favored 'General case' 0 N--CA 1.522 3.157 0 CA-C-N 119.579 1.081 . . . . 0.0 111.873 -178.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.94 -58.87 1.8 Allowed 'General case' 0 N--CA 1.529 3.52 0 CA-C-N 118.125 0.42 . . . . 0.0 111.875 -177.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -73.64 0.44 12.76 Favored 'General case' 0 N--CA 1.517 2.904 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -176.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 571' ' ' LEU . . . . . 0.706 HD23 HD11 ' B' ' 582' ' ' ILE . 15.7 tp -77.67 -45.59 24.48 Favored 'General case' 0 N--CA 1.524 3.227 0 CA-C-N 120.299 1.409 . . . . 0.0 110.515 -179.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 572' ' ' LYS . . . . . 0.589 ' NZ ' HD13 ' B' ' 579' ' ' ILE . 0.7 OUTLIER -54.65 -37.01 65.17 Favored 'General case' 1 N--CA 1.544 4.233 0 CA-C-N 120.002 1.274 . . . . 0.0 110.889 178.303 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 31.0 t30 -61.71 -38.54 88.24 Favored 'General case' 0 N--CA 1.535 3.788 0 C-N-CA 123.154 0.581 . . . . 0.0 110.109 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -65.01 -64.01 0.97 Allowed 'General case' 0 N--CA 1.518 2.93 0 C-N-CA 124.078 0.951 . . . . 0.0 110.663 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 5.5 mp -97.81 -68.2 0.81 Allowed 'General case' 0 N--CA 1.522 3.13 0 C-N-CA 123.374 0.67 . . . . 0.0 111.044 -179.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 133.05 50.16 0.09 OUTLIER Glycine 1 N--CA 1.517 4.083 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 -178.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -111.18 114.72 28.16 Favored 'General case' 0 N--CA 1.52 3.067 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 178.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -41.88 167.34 0.01 OUTLIER Glycine 1 N--CA 1.535 5.267 0 C-N-CA 124.819 1.2 . . . . 0.0 115.914 -176.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 579' ' ' ILE . . . . . 0.589 HD13 ' NZ ' ' B' ' 572' ' ' LYS . 1.1 mp -81.86 -16.94 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.094 0 CA-C-O 117.643 -1.17 . . . . 0.0 108.438 176.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 580' ' ' ALA . . . . . 0.851 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -68.74 -37.92 79.78 Favored 'General case' 0 N--CA 1.526 3.371 0 CA-C-N 120.047 1.294 . . . . 0.0 108.87 176.058 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 581' ' ' THR . . . . . 0.455 HG21 ' OP2' ' F' ' 14' ' ' ' DT' . 1.1 p -79.7 -37.24 36.14 Favored 'General case' 0 N--CA 1.534 3.733 0 C-N-CA 123.191 0.597 . . . . 0.0 112.544 178.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 582' ' ' ILE . . . . . 0.706 HD11 HD23 ' B' ' 571' ' ' LEU . 0.4 OUTLIER -70.86 -37.73 69.62 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.35 0 C-N-CA 123.336 0.654 . . . . 0.0 111.343 -175.096 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 82.3 p -95.22 -28.78 14.85 Favored 'General case' 0 N--CA 1.513 2.699 0 CA-C-O 117.987 -1.006 . . . . 0.0 111.003 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 14.2 ptt180 -74.65 -21.58 59.35 Favored 'General case' 0 N--CA 1.528 3.469 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 173.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -69.11 -26.49 74.62 Favored Glycine 1 N--CA 1.517 4.071 0 N-CA-C 108.464 -1.854 . . . . 0.0 108.464 173.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 16.4 m -68.41 -36.78 79.58 Favored 'General case' 1 N--CA 1.539 4.01 0 CA-C-N 118.293 1.046 . . . . 0.0 108.862 176.365 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -62.19 -22.35 65.84 Favored 'General case' 0 N--CA 1.539 3.977 0 C-N-CA 123.182 0.593 . . . . 0.0 110.478 176.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 62.4 m -47.63 -47.54 29.05 Favored 'General case' 1 N--CA 1.544 4.226 0 C-N-CA 124.97 1.308 . . . . 0.0 111.091 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 28.0 mt -69.58 -41.14 76.19 Favored 'General case' 0 N--CA 1.519 2.986 0 C-N-CA 123.655 0.782 . . . . 0.0 109.974 178.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 12.1 mmpt? -55.3 -29.11 57.57 Favored 'General case' 1 N--CA 1.545 4.297 0 C-N-CA 123.684 0.794 . . . . 0.0 112.361 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -82.81 -44.8 15.1 Favored 'General case' 0 N--CA 1.515 2.792 0 C-N-CA 123.104 0.562 . . . . 0.0 110.586 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -70.08 158.9 86.26 Favored Pre-proline 0 N--CA 1.53 3.544 0 CA-C-O 118.518 -0.753 . . . . 0.0 112.496 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -81.2 176.29 8.94 Favored 'Trans proline' 0 C--N 1.379 2.142 0 C-N-CA 122.273 1.982 . . . . 0.0 111.064 178.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.1 t -89.81 -26.71 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.522 3.149 0 CA-C-O 117.708 -1.139 . . . . 0.0 111.609 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -62.75 -39.17 93.29 Favored 'General case' 0 N--CA 1.516 2.852 0 CA-C-N 120.159 1.345 . . . . 0.0 109.872 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 596' ' ' LEU . . . . . 0.61 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.7 mp -100.26 -11.04 20.7 Favored 'General case' 0 N--CA 1.514 2.74 0 C-N-CA 123.564 0.746 . . . . 0.0 112.103 177.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -33.3 75.36 Favored 'General case' 1 N--CA 1.543 4.207 0 N-CA-C 102.344 -3.206 . . . . 0.0 102.344 165.996 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -56.63 -36.57 69.64 Favored 'General case' 0 N--CA 1.52 3.043 0 C-N-CA 124.712 1.205 . . . . 0.0 110.465 174.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 599' ' ' TRP . . . . . 0.649 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 35.4 t90 -63.25 -37.06 85.75 Favored 'General case' 1 N--CA 1.54 4.053 0 N-CA-C 107.092 -1.447 . . . . 0.0 107.092 176.439 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.79 -35.89 57.35 Favored 'General case' 0 N--CA 1.538 3.957 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 176.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -71.28 -37.0 71.89 Favored 'General case' 1 N--CA 1.541 4.111 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 175.366 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -60.34 -22.87 63.74 Favored 'General case' 1 N--CA 1.544 4.247 0 C-N-CA 123.5 0.72 . . . . 0.0 109.861 174.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 603' ' ' VAL . . . . . 0.551 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.0 OUTLIER -115.48 1.65 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.407 0 CA-C-O 118.423 -0.798 . . . . 0.0 112.471 -177.356 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 42.8 mt -108.28 -64.85 1.18 Allowed 'General case' 0 N--CA 1.523 3.212 0 N-CA-C 104.666 -2.346 . . . . 0.0 104.666 174.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 6.4 tp -48.57 -34.9 12.34 Favored 'General case' 0 N--CA 1.537 3.875 0 C-N-CA 125.442 1.497 . . . . 0.0 111.912 178.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt 86.87 -36.84 0.03 OUTLIER 'General case' 1 N--CA 1.541 4.103 0 C-N-CA 125.999 1.72 . . . . 0.0 111.608 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 60.1 m . . . . . 1 N--CA 1.542 4.126 0 C-N-CA 124.573 1.149 . . . . 0.0 111.257 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 898' ' ' TRP . . . . . 0.503 ' HB2' HG23 ' B' ' 544' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.135 0 CA-C-O 118.27 -0.871 . . . . 0.0 109.581 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 998' ' ' TRP . . . . . 0.425 ' HB2' ' CG2' ' A' ' 44' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.188 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.559 9.869 2 O4'-C1'-N19 119.777 14.971 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.448 6 O4'-C1'-N19 119.285 14.356 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.79 2 C4'-C3'-C2' 117.359 14.159 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . 0.659 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 4 C3'--C2' 1.422 -9.616 5 O4'-C1'-N19 120.564 15.955 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' E' E ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.577 11.238 5 C4'-C3'-C2' 116.291 13.091 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.405 -11.292 4 O4'-C1'-N19 118.42 13.276 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' E' E ' 7' ' ' ' DA' . . . . . 0.666 H2'' " H5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.396 -12.219 5 C4'-C3'-C2' 111.87 8.67 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' E' E ' 8' ' ' ' DG' . . . . . 0.666 " H5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 O3'--C3' 1.578 11.289 4 O4'-C1'-N19 118.154 12.942 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.408 -10.95 5 O4'-C1'-N19 119.416 14.52 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.412 -10.563 4 O4'-C1'-N19 119.929 15.161 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.396 3 O4'-C1'-N19 119.764 14.954 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.283 4 O4'-C1'-N19 118.701 13.627 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.414 -10.4 5 O4'-C1'-N19 118.989 13.986 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' E' E ' 14' ' ' ' DT' . . . . . 0.735 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.415 -10.258 3 O4'-C1'-N19 119.109 14.136 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' E' E ' 15' ' ' ' DA' . . . . . 0.974 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 4 C3'--C2' 1.426 -9.155 5 O4'-C1'-N19 119.818 15.023 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.419 -9.886 5 O4'-C1'-N19 119.24 14.3 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.569 10.6 4 O4'-C1'-N19 120.038 15.297 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.616 5 O4'-C1'-N19 120.14 15.425 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.409 -10.91 4 O4'-C1'-N19 120.729 16.161 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.512 7.077 4 O4'-C1'-N19 118.908 13.885 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.568 10.516 3 C4'-C3'-C2' 116.521 13.321 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.412 -10.591 5 O4'-C1'-N19 119.282 14.353 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.554 4 O4'-C1'-N19 120.178 15.472 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' F' F ' 4' ' ' ' DA' . . . . . 0.568 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.419 -9.868 5 O4'-C1'-N19 119.438 14.547 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' F' F ' 5' ' ' ' DC' . . . . . 0.589 ' H41' ' HA ' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.417 -10.148 4 O4'-C1'-N19 119.639 14.799 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -10.979 5 O4'-C1'-N19 119.309 14.386 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.425 -10.328 3 C4'-C3'-C2' 113.65 10.45 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.422 -9.589 4 O4'-C1'-N19 119.476 14.595 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.594 5 O4'-C1'-N19 119.621 14.777 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.406 -11.17 4 O4'-C1'-N19 118.391 13.239 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.421 -9.746 4 O4'-C1'-N19 120.803 16.254 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.564 10.225 2 O4'-C1'-N19 120.384 15.73 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.403 -11.525 5 O4'-C1'-N19 118.092 12.865 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' F' F ' 14' ' ' ' DT' . . . . . 0.669 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 7 C3'--C2' 1.413 -10.525 3 O4'-C1'-N19 118.676 13.595 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' F' F ' 15' ' ' ' DA' . . . . . 0.675 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.415 -10.34 6 O4'-C1'-N19 119.99 15.237 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' F' F ' 16' ' ' ' DG' . . . . . 0.426 ' O6 ' ' HB ' ' B' ' 579' ' ' ILE . . . . . . . . 5 C3'--C2' 1.419 -9.938 5 O4'-C1'-N19 120.089 15.362 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.421 -9.73 3 O4'-C1'-N19 119.422 14.527 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.568 4 O4'-C1'-N19 119.347 14.434 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.778 5 O4'-C1'-N19 119.916 15.145 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.514 7.244 3 O4'-C1'-N19 119.669 14.836 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 . . . . . 0 N--CA 1.502 2.15 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.5 t -116.3 145.71 35.69 Favored Pre-proline 0 N--CA 1.527 3.422 0 CA-C-O 118.061 -0.971 . . . . 0.0 111.33 -179.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -68.29 136.35 36.9 Favored 'Trans proline' 0 C--N 1.394 2.955 0 C-N-CA 122.759 2.306 . . . . 0.0 112.306 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -122.87 -55.67 1.79 Allowed 'General case' 0 N--CA 1.517 2.887 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 72.5 m -131.56 121.8 25.02 Favored 'General case' 0 N--CA 1.518 2.938 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 178.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -106.06 125.14 50.64 Favored 'General case' 0 N--CA 1.518 2.97 0 C-N-CA 122.831 0.453 . . . . 0.0 109.868 -178.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -162.69 129.73 3.63 Favored 'General case' 0 N--CA 1.527 3.391 0 C-N-CA 122.808 0.443 . . . . 0.0 110.442 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 72.3 mtp -107.94 -68.56 0.9 Allowed 'General case' 0 N--CA 1.523 3.198 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -164.51 144.58 7.66 Favored 'General case' 0 N--CA 1.53 3.529 0 CA-C-N 118.444 0.565 . . . . 0.0 111.832 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -127.15 -60.55 1.2 Allowed 'General case' 0 N--CA 1.519 3.011 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 178.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -140.9 114.45 8.82 Favored 'General case' 0 N--CA 1.523 3.197 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 178.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.7 mmt180 -134.92 -53.4 0.8 Allowed 'General case' 0 N--CA 1.523 3.215 0 CA-C-O 119.178 -0.439 . . . . 0.0 110.045 -178.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -110.8 130.05 55.68 Favored 'General case' 0 N--CA 1.528 3.427 0 C-N-CA 123.054 0.541 . . . . 0.0 109.58 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -106.34 119.29 38.87 Favored 'General case' 0 N--CA 1.519 3.005 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -126.81 -82.06 0.61 Allowed 'General case' 0 N--CA 1.52 3.064 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.625 ' CZ3' HD22 ' B' ' 551' ' ' LEU . 76.4 t-105 -51.03 -42.35 60.41 Favored 'General case' 0 N--CA 1.532 3.625 0 C-N-CA 123.359 0.664 . . . . 0.0 110.085 176.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.432 HD22 ' N ' ' A' ' 20' ' ' LEU . 2.9 mm? -77.77 -28.18 50.49 Favored 'General case' 0 N--CA 1.516 2.833 0 O-C-N 124.925 1.391 . . . . 0.0 112.112 -176.019 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 27.7 tpt180 -57.9 -27.76 63.6 Favored 'General case' 1 N--CA 1.539 4.005 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 173.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.516 ' CG ' HD21 ' B' ' 551' ' ' LEU . 0.1 OUTLIER -81.6 -39.56 24.33 Favored 'General case' 0 N--CA 1.509 2.495 0 CA-C-O 117.092 -1.432 . . . . 0.0 108.829 172.876 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 26.3 t -66.97 -38.67 81.83 Favored 'Isoleucine or valine' 1 N--CA 1.561 5.085 0 CA-C-N 120.207 1.367 . . . . 0.0 113.478 -174.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -67.79 -50.87 54.61 Favored 'General case' 1 N--CA 1.542 4.135 0 CA-C-N 120.027 1.285 . . . . 0.0 109.349 -178.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.1 mp -69.86 -17.47 63.37 Favored 'General case' 0 N--CA 1.533 3.709 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 175.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.08 -37.82 84.64 Favored 'General case' 0 N--CA 1.519 3.004 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 175.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.443 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 23.9 ttmt -63.44 -23.48 67.42 Favored 'General case' 0 N--CA 1.526 3.348 0 CA-C-O 118.303 -0.856 . . . . 0.0 111.385 177.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -70.88 -41.89 70.74 Favored 'General case' 0 N--CA 1.534 3.751 0 CA-C-N 119.221 0.919 . . . . 0.0 108.525 176.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.65 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -89.24 -3.28 58.61 Favored 'General case' 0 CA--C 1.581 2.153 0 CA-C-O 118.446 -0.788 . . . . 0.0 110.672 177.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.443 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -86.5 -36.72 18.84 Favored 'General case' 0 N--CA 1.534 3.739 0 CA-C-N 120.513 1.506 . . . . 0.0 108.832 179.991 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -59.78 -44.33 93.97 Favored 'General case' 0 N--CA 1.536 3.853 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 177.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -87.44 -86.47 0.16 Allowed 'General case' 0 N--CA 1.514 2.741 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 176.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 p30 149.31 45.15 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.912 0 C-N-CA 127.656 2.382 . . . . 0.0 109.109 177.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.51 HD22 ' CD2' ' B' ' 596' ' ' LEU . 5.7 mt -104.79 15.33 28.07 Favored 'General case' 0 N--CA 1.528 3.436 0 C-N-CA 124.177 0.991 . . . . 0.0 110.25 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.556 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 48.9 p-80 -84.7 6.64 23.42 Favored 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 175.115 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.675 ' HA ' HD23 ' A' ' 39' ' ' LEU . 26.7 mt -95.58 -52.29 0.23 Allowed Pre-proline 0 N--CA 1.501 2.097 0 CA-C-O 116.942 -1.504 . . . . 0.0 108.633 -175.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.496 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 4.3 Cg_exo -67.16 -33.5 31.06 Favored 'Trans proline' 0 C--N 1.39 2.726 0 N-CA-C 106.64 -2.1 . . . . 0.0 106.64 170.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.556 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.6 OUTLIER -63.45 -40.64 97.68 Favored 'General case' 0 N--CA 1.517 2.884 0 CA-C-O 118.01 -0.995 . . . . 0.0 109.203 176.887 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.675 HD23 ' HA ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -75.91 -18.45 59.37 Favored 'General case' 1 N--CA 1.544 4.231 0 CA-C-N 119.921 1.237 . . . . 0.0 110.46 177.333 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -80.09 -7.39 58.86 Favored 'General case' 0 N--CA 1.525 3.325 0 CA-C-N 119.45 1.023 . . . . 0.0 110.062 175.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.549 HD13 ' N ' ' A' ' 42' ' ' MET . 0.8 OUTLIER -106.46 -60.26 1.68 Allowed 'General case' 0 N--CA 1.521 3.112 0 C-N-CA 124.019 0.927 . . . . 0.0 111.58 -178.487 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.549 ' N ' HD13 ' A' ' 41' ' ' LEU . 13.5 ptt? -93.47 3.76 55.05 Favored 'General case' 1 N--CA 1.546 4.353 0 CA-C-N 119.442 1.019 . . . . 0.0 113.504 -177.056 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.532 HD11 HD11 ' B' ' 551' ' ' LEU . 5.1 mp -120.73 -94.63 0.5 Allowed 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 178.139 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.685 HG23 ' HB2' ' B' ' 998' ' ' TRP . 0.7 OUTLIER 156.55 169.82 0.01 OUTLIER Pre-proline 1 N--CA 1.575 5.801 0 C-N-CA 125.747 1.619 . . . . 0.0 109.685 179.706 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -68.29 -37.37 14.02 Favored 'Trans proline' 0 C--N 1.392 2.841 0 C-N-CA 121.918 1.745 . . . . 0.0 108.099 174.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -64.25 -22.33 66.91 Favored 'General case' 0 N--CA 1.527 3.404 0 C-N-CA 123.518 0.727 . . . . 0.0 110.418 176.174 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -70.22 -38.45 75.25 Favored 'General case' 0 N--CA 1.524 3.257 0 CA-C-O 117.438 -1.267 . . . . 0.0 109.867 178.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 26.1 ptt180 -80.91 -17.34 50.92 Favored 'General case' 0 N--CA 1.539 3.986 0 CA-C-N 119.992 1.269 . . . . 0.0 108.32 173.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -74.47 -18.63 60.6 Favored 'General case' 0 N--CA 1.52 3.045 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 172.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 54' ' ' ARG . . . -90.14 -46.81 8.21 Favored 'General case' 0 N--CA 1.504 2.264 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 178.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.494 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 23.6 tp -66.81 -21.12 66.04 Favored 'General case' 1 N--CA 1.546 4.357 0 CA-C-N 120.613 1.551 . . . . 0.0 108.005 173.966 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.454 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -71.04 -72.21 0.93 Allowed Glycine 0 N--CA 1.502 3.089 0 C-N-CA 125.707 1.623 . . . . 0.0 111.421 177.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.9 m -70.18 -25.21 63.32 Favored 'General case' 0 N--CA 1.532 3.659 0 CA-C-O 117.639 -1.172 . . . . 0.0 112.526 -177.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 2.5 mpt_? -73.61 -51.8 15.59 Favored 'General case' 0 N--CA 1.53 3.539 0 CA-C-N 120.213 1.37 . . . . 0.0 107.545 177.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.2 t -62.23 -18.41 19.97 Favored 'Isoleucine or valine' 1 N--CA 1.545 4.309 0 CA-C-N 119.472 1.033 . . . . 0.0 109.853 175.067 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.6 mmm180 -75.86 -48.48 21.3 Favored 'General case' 0 N--CA 1.517 2.897 0 CA-C-O 117.343 -1.313 . . . . 0.0 111.903 178.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -71.32 -21.63 21.89 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.439 0 CA-C-N 121.171 1.805 . . . . 0.0 111.303 -178.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -87.69 -52.01 11.97 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.011 0 CA-C-N 119.96 1.255 . . . . 0.0 107.869 -178.91 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -62.73 -21.6 65.92 Favored 'General case' 0 N--CA 1.528 3.474 0 CA-C-O 118.58 -0.724 . . . . 0.0 110.202 177.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -91.86 -23.96 19.49 Favored 'General case' 0 N--CA 1.526 3.338 0 CA-C-O 118.082 -0.961 . . . . 0.0 110.273 177.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.6 mt -77.62 -61.86 1.85 Allowed 'General case' 0 N--CA 1.535 3.801 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 178.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.3 tt -43.4 -37.85 2.51 Favored 'General case' 1 N--CA 1.545 4.321 0 C-N-CA 125.98 1.712 . . . . 0.0 112.798 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -87.99 -62.64 1.45 Allowed 'General case' 0 N--CA 1.524 3.269 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.17 83.29 1.43 Allowed Glycine 0 N--CA 1.513 3.821 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 179.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -131.21 -58.3 1.0 Allowed 'General case' 0 N--CA 1.521 3.12 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 15.1 ptt? -154.4 82.32 1.12 Allowed 'General case' 0 N--CA 1.522 3.159 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 178.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.4 ' HA ' HD22 ' A' ' 71' ' ' LEU . 3.8 t -130.0 -9.52 4.35 Favored 'General case' 0 N--CA 1.523 3.214 0 CA-C-O 117.993 -1.003 . . . . 0.0 113.464 -176.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -106.75 -65.27 1.1 Allowed 'General case' 0 N--CA 1.533 3.71 0 CA-C-N 120.437 1.472 . . . . 0.0 111.54 -177.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.4 mtt180 -104.71 -45.88 4.48 Favored 'General case' 0 N--CA 1.53 3.533 0 C-N-CA 123.148 0.579 . . . . 0.0 109.843 -178.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -66.82 -10.35 46.96 Favored 'General case' 0 N--CA 1.52 3.062 0 CA-C-O 118.376 -0.821 . . . . 0.0 112.962 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.644 HD23 HG21 ' A' ' 82' ' ' ILE . 28.6 tp -88.73 -55.44 3.71 Favored 'General case' 0 N--CA 1.524 3.234 0 CA-C-N 119.748 1.158 . . . . 0.0 113.186 -177.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -37.99 -37.47 0.26 Allowed 'General case' 1 N--CA 1.552 4.664 0 N-CA-C 114.217 1.192 . . . . 0.0 114.217 -177.118 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -73.72 -44.11 57.3 Favored 'General case' 0 N--CA 1.533 3.687 0 CA-C-N 118.158 0.435 . . . . 0.0 110.411 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -46.57 -49.51 18.69 Favored 'General case' 0 N--CA 1.533 3.692 0 C-N-CA 124.888 1.275 . . . . 0.0 113.49 -179.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.4 pp -132.34 -43.0 0.95 Allowed 'General case' 0 N--CA 1.532 3.656 0 CA-C-O 118.803 -0.618 . . . . 0.0 111.974 -178.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 111.62 74.88 0.74 Allowed Glycine 1 N--CA 1.525 4.61 0 N-CA-C 110.588 -1.005 . . . . 0.0 110.588 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.68 -37.48 5.9 Favored 'General case' 0 N--CA 1.526 3.334 0 C-N-CA 123.409 0.684 . . . . 0.0 110.528 179.047 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 100.16 163.8 28.66 Favored Glycine 1 N--CA 1.523 4.459 0 N-CA-C 109.429 -1.468 . . . . 0.0 109.429 -177.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.568 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 3.0 mt -86.57 -11.49 11.1 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.664 0 CA-C-N 119.403 1.602 . . . . 0.0 109.296 178.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.974 ' HB2' ' H62' ' E' ' 15' ' ' ' DA' . . . -72.34 -36.93 68.95 Favored 'General case' 0 N--CA 1.526 3.326 0 CA-C-N 119.93 1.241 . . . . 0.0 110.49 176.732 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.468 HG21 ' OP2' ' E' ' 14' ' ' ' DT' . 2.2 p -83.93 -39.18 20.1 Favored 'General case' 1 N--CA 1.541 4.081 0 CA-C-N 119.517 1.053 . . . . 0.0 112.227 -179.02 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.644 HG21 HD23 ' A' ' 71' ' ' LEU . 1.8 pt -73.28 -14.79 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.718 0 CA-C-O 117.85 -1.071 . . . . 0.0 112.938 -177.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 50.3 p -112.6 -33.18 6.22 Favored 'General case' 0 N--CA 1.514 2.755 0 CA-C-N 119.951 1.251 . . . . 0.0 110.184 178.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 13.8 ptt180 -72.81 -21.46 60.97 Favored 'General case' 0 N--CA 1.532 3.659 0 CA-C-N 119.464 1.029 . . . . 0.0 108.426 174.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -64.73 -33.49 87.37 Favored Glycine 1 N--CA 1.52 4.249 0 N-CA-C 109.313 -1.515 . . . . 0.0 109.313 175.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.6 t -63.96 -33.18 75.15 Favored 'General case' 1 N--CA 1.539 4.021 0 CA-C-N 118.282 1.041 . . . . 0.0 109.748 176.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -55.65 -33.8 64.39 Favored 'General case' 1 N--CA 1.547 4.376 0 C-N-CA 123.335 0.654 . . . . 0.0 111.285 177.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.7 m -62.15 -34.71 76.91 Favored 'General case' 1 N--CA 1.54 4.043 0 C-N-CA 123.728 0.811 . . . . 0.0 112.114 -179.56 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.3 mt -56.13 -42.32 76.73 Favored 'General case' 0 N--CA 1.536 3.831 0 C-N-CA 123.892 0.877 . . . . 0.0 111.166 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -21.53 61.49 Favored 'General case' 0 N--CA 1.534 3.739 0 CA-C-O 118.244 -0.884 . . . . 0.0 112.116 -179.401 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.76 -41.65 26.17 Favored 'General case' 0 N--CA 1.517 2.892 0 CA-C-N 119.157 0.889 . . . . 0.0 111.669 -179.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.17 159.9 13.56 Favored Pre-proline 1 N--CA 1.543 4.203 0 CA-C-O 118.471 -0.776 . . . . 0.0 113.079 -178.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -85.1 157.22 11.32 Favored 'Trans proline' 0 C--N 1.379 2.183 0 C-N-CA 122.285 1.99 . . . . 0.0 110.261 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 t -78.54 -27.71 14.22 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.114 0 CA-C-O 117.873 -1.061 . . . . 0.0 111.102 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -58.82 -44.21 90.79 Favored 'General case' 0 N--CA 1.518 2.932 0 CA-C-N 120.173 1.351 . . . . 0.0 109.949 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.769 HD21 HD22 ' B' ' 534' ' ' LEU . 7.7 mp -100.18 -7.46 24.73 Favored 'General case' 0 N--CA 1.512 2.667 0 CA-C-O 118.362 -0.827 . . . . 0.0 112.71 177.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -35.86 81.9 Favored 'General case' 0 N--CA 1.539 3.979 0 N-CA-C 102.361 -3.2 . . . . 0.0 102.361 168.048 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.59 -40.39 65.64 Favored 'General case' 0 N--CA 1.515 2.794 0 C-N-CA 124.492 1.117 . . . . 0.0 111.332 174.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.67 ' CH2' ' HB2' ' B' ' 529' ' ' ALA . 51.5 t90 -64.47 -35.59 81.44 Favored 'General case' 1 N--CA 1.541 4.09 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 177.601 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.57 -37.69 63.17 Favored 'General case' 0 N--CA 1.533 3.681 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 176.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -69.0 -37.24 78.6 Favored 'General case' 1 N--CA 1.539 4.016 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 175.5 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.15 -25.31 61.32 Favored 'General case' 1 N--CA 1.542 4.156 0 C-N-CA 123.089 0.556 . . . . 0.0 110.067 175.575 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.524 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.3 OUTLIER -120.37 5.51 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.482 0 C-N-CA 123.592 0.757 . . . . 0.0 112.792 -176.845 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -125.45 -56.85 1.5 Allowed 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 178.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 4.1 tt -46.99 -66.99 0.32 Allowed 'General case' 1 N--CA 1.544 4.273 0 C-N-CA 124.914 1.286 . . . . 0.0 113.524 -179.136 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 72.0 tttt -106.61 -66.99 0.97 Allowed 'General case' 0 N--CA 1.526 3.375 0 CA-C-N 118.649 0.659 . . . . 0.0 111.525 -177.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 49.1 p . . . . . 0 N--CA 1.532 3.643 0 CA-C-O 118.104 -0.95 . . . . 0.0 111.41 -178.078 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 . . . . . 0 N--CA 1.501 2.102 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 5.3 t -114.24 127.95 26.31 Favored Pre-proline 0 N--CA 1.523 3.211 0 CA-C-O 117.411 -1.281 . . . . 0.0 108.97 179.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -63.73 117.97 4.93 Favored 'Trans proline' 0 C--N 1.395 3.022 0 C-N-CA 122.748 2.299 . . . . 0.0 111.922 -179.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -153.65 119.8 5.43 Favored 'General case' 0 N--CA 1.521 3.087 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 73.4 m -124.47 130.52 52.62 Favored 'General case' 0 N--CA 1.52 3.067 0 C-N-CA 122.933 0.493 . . . . 0.0 110.007 -178.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -106.12 -44.69 4.51 Favored 'General case' 0 N--CA 1.519 2.994 0 C-N-CA 123.093 0.557 . . . . 0.0 109.886 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -113.88 128.61 56.48 Favored 'General case' 0 N--CA 1.518 2.931 0 C-N-CA 123.217 0.607 . . . . 0.0 110.338 -179.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 46.9 ttm -147.31 -55.96 0.24 Allowed 'General case' 0 N--CA 1.522 3.172 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -113.82 -45.44 3.09 Favored 'General case' 0 N--CA 1.518 2.956 0 C-N-CA 123.728 0.811 . . . . 0.0 109.076 178.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -106.82 128.37 54.2 Favored 'General case' 0 N--CA 1.523 3.178 0 C-N-CA 123.257 0.623 . . . . 0.0 109.772 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -110.3 -56.62 2.31 Favored 'General case' 0 N--CA 1.518 2.957 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -145.85 124.53 12.56 Favored 'General case' 0 N--CA 1.532 3.638 0 C-N-CA 123.262 0.625 . . . . 0.0 109.835 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 33.8 p-80 -78.01 131.03 37.18 Favored 'General case' 0 N--CA 1.533 3.709 0 C-N-CA 122.654 0.382 . . . . 0.0 110.59 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 -102.45 127.68 49.38 Favored 'General case' 0 N--CA 1.523 3.207 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -149.66 -78.4 0.14 Allowed 'General case' 0 N--CA 1.523 3.212 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 519' ' ' TRP . . . . . 0.664 ' CE2' HD22 ' A' ' 39' ' ' LEU . 71.7 t-105 -43.07 -28.66 0.29 Allowed 'General case' 1 N--CA 1.55 4.555 0 C-N-CA 124.279 1.032 . . . . 0.0 113.424 179.855 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 520' ' ' LEU . . . . . 0.587 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.3 mm? -95.76 -31.43 13.2 Favored 'General case' 0 N--CA 1.526 3.373 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.693 -173.262 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.11 -22.92 65.1 Favored 'General case' 0 N--CA 1.539 3.994 0 N-CA-C 106.904 -1.517 . . . . 0.0 106.904 171.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . 0.515 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.6 m-85 -81.82 -40.16 22.94 Favored 'General case' 0 N--CA 1.509 2.494 0 N-CA-C 107.208 -1.404 . . . . 0.0 107.208 174.167 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 20.4 t -58.88 -44.81 91.56 Favored 'Isoleucine or valine' 1 N--CA 1.565 5.313 0 CA-C-O 117.603 -1.189 . . . . 0.0 113.292 -179.059 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -61.05 -46.11 92.01 Favored 'General case' 1 N--CA 1.548 4.462 0 CA-C-N 120.641 1.564 . . . . 0.0 110.038 -178.484 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 1.7 tp -67.38 -26.52 66.5 Favored 'General case' 0 N--CA 1.536 3.829 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 176.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 526' ' ' LEU . . . . . 0.441 HD23 ' O ' ' B' ' 522' ' ' PHE . 1.6 mm? -68.06 -31.78 71.67 Favored 'General case' 0 N--CA 1.522 3.141 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 176.745 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 527' ' ' LYS . . . . . 0.484 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 15.2 tttt -67.79 -23.3 65.19 Favored 'General case' 0 N--CA 1.521 3.118 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.833 177.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -71.99 -41.27 67.83 Favored 'General case' 0 N--CA 1.534 3.744 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 176.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 529' ' ' ALA . . . . . 0.67 ' HB2' ' CH2' ' A' ' 99' ' ' TRP . . . -88.6 -7.34 56.59 Favored 'General case' 0 N--CA 1.503 2.219 0 CA-C-O 118.427 -0.797 . . . . 0.0 110.569 177.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 530' ' ' TYR . . . . . 0.484 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.5 OUTLIER -82.07 -35.68 28.44 Favored 'General case' 0 N--CA 1.532 3.671 0 CA-C-N 120.309 1.413 . . . . 0.0 108.737 179.798 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -60.7 -45.07 95.6 Favored 'General case' 0 N--CA 1.538 3.932 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -90.67 -84.0 0.25 Allowed 'General case' 0 N--CA 1.515 2.805 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 177.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.0 p30 149.31 47.34 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.88 0 C-N-CA 128.105 2.562 . . . . 0.0 108.104 178.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 534' ' ' LEU . . . . . 0.769 HD22 HD21 ' A' ' 96' ' ' LEU . 7.3 mt -102.89 9.13 39.0 Favored 'General case' 0 N--CA 1.529 3.523 0 C-N-CA 124.095 0.958 . . . . 0.0 111.606 -178.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 535' ' ' HIS . . . . . 0.623 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 49.2 p-80 -80.76 0.38 34.95 Favored 'General case' 0 N--CA 1.512 2.657 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 175.006 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 536' ' ' LEU . . . . . 0.441 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 33.8 mt -94.01 -51.43 0.26 Allowed Pre-proline 0 N--CA 1.505 2.303 0 CA-C-O 116.343 -1.789 . . . . 0.0 109.067 -175.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 537' ' ' PRO . . . . . 0.441 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 3.7 Cg_exo -64.57 -37.42 37.71 Favored 'Trans proline' 0 C--N 1.396 3.048 0 N-CA-C 107.071 -1.934 . . . . 0.0 107.071 170.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 538' ' ' LEU . . . . . 0.437 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 1.2 tm? -60.28 -41.53 93.51 Favored 'General case' 0 N--CA 1.527 3.387 0 C-N-CA 124.332 1.053 . . . . 0.0 108.736 175.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 11.0 mt -71.78 -25.04 61.86 Favored 'General case' 0 N--CA 1.536 3.836 0 CA-C-O 118.247 -0.883 . . . . 0.0 111.452 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -77.88 -8.05 57.54 Favored 'General case' 0 N--CA 1.53 3.526 0 CA-C-N 119.31 0.959 . . . . 0.0 110.187 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 541' ' ' LEU . . . . . 0.497 ' O ' HD22 ' B' ' 541' ' ' LEU . 0.0 OUTLIER -103.6 -42.17 5.74 Favored 'General case' 0 N--CA 1.512 2.656 0 C-N-CA 124.033 0.933 . . . . 0.0 109.779 -179.388 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 542' ' ' MET . . . . . 0.48 ' N ' HD13 ' B' ' 541' ' ' LEU . 15.1 ptp -85.2 -28.08 25.69 Favored 'General case' 0 N--CA 1.534 3.764 0 CA-C-O 117.439 -1.267 . . . . 0.0 113.252 -177.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 1.8 tt -131.54 -110.27 0.25 Allowed 'General case' 0 N--CA 1.533 3.691 0 CA-C-O 116.967 -1.492 . . . . 0.0 112.886 -177.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 24.3 p -163.75 162.81 16.57 Favored Pre-proline 1 N--CA 1.542 4.168 0 CA-C-N 120.754 1.615 . . . . 0.0 111.823 -177.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -76.43 -32.09 4.06 Favored 'Trans proline' 0 CA--C 1.578 2.677 0 C-N-CA 122.792 2.328 . . . . 0.0 109.551 174.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -55.63 -36.41 66.97 Favored 'General case' 1 N--CA 1.546 4.338 0 C-N-CA 123.876 0.87 . . . . 0.0 111.523 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -71.66 -32.57 68.03 Favored 'General case' 0 N--CA 1.523 3.191 0 CA-C-O 117.637 -1.173 . . . . 0.0 110.778 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 20.5 ptt180 -74.16 -21.21 59.94 Favored 'General case' 0 N--CA 1.534 3.731 0 CA-C-N 120.027 1.285 . . . . 0.0 109.618 175.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -65.19 -44.43 88.41 Favored 'General case' 0 N--CA 1.536 3.832 0 N-CA-C 106.184 -1.784 . . . . 0.0 106.184 173.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -72.22 -20.29 61.59 Favored 'General case' 0 N--CA 1.517 2.915 0 CA-C-O 117.198 -1.382 . . . . 0.0 110.764 176.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 551' ' ' LEU . . . . . 0.625 HD22 ' CZ3' ' A' ' 19' ' ' TRP . 12.3 tp -80.42 -20.26 44.32 Favored 'General case' 0 N--CA 1.524 3.238 0 CA-C-N 120.582 1.537 . . . . 0.0 109.168 175.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -77.35 -52.18 5.73 Favored Glycine 0 N--CA 1.507 3.401 0 N-CA-C 108.333 -1.907 . . . . 0.0 108.333 177.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.5 m -70.32 -32.54 70.33 Favored 'General case' 0 N--CA 1.535 3.825 0 CA-C-O 118.703 -0.665 . . . . 0.0 110.842 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -63.9 -54.64 31.56 Favored 'General case' 1 N--CA 1.539 4.007 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 176.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 555' ' ' VAL . . . . . . . . . . . . . 38.9 t -66.28 -14.9 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.531 0 CA-C-O 117.759 -1.115 . . . . 0.0 110.995 177.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.77 -44.39 20.77 Favored 'General case' 0 N--CA 1.526 3.374 0 CA-C-N 120.168 1.349 . . . . 0.0 111.539 178.359 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 557' ' ' ILE . . . . . 0.451 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -71.94 -22.49 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.278 0 CA-C-N 120.724 1.602 . . . . 0.0 110.213 -179.669 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 558' ' ' VAL . . . . . 0.451 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -88.44 -52.49 11.09 Favored 'Isoleucine or valine' 1 N--CA 1.543 4.181 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 -179.789 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -57.72 -24.28 56.12 Favored 'General case' 0 N--CA 1.536 3.826 0 CA-C-O 118.895 -0.574 . . . . 0.0 110.487 177.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -98.07 -22.81 16.04 Favored 'General case' 0 N--CA 1.527 3.377 0 CA-C-O 118.059 -0.972 . . . . 0.0 111.363 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 16.6 tp -78.72 -63.17 1.47 Allowed 'General case' 0 N--CA 1.537 3.878 0 CA-C-N 119.637 1.108 . . . . 0.0 108.473 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 25.9 mt -41.82 -31.38 0.31 Allowed 'General case' 1 N--CA 1.547 4.422 0 C-N-CA 125.303 1.441 . . . . 0.0 113.513 -178.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 11.4 mmm180 -75.75 -51.01 13.61 Favored 'General case' 0 N--CA 1.527 3.398 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 80.67 93.47 0.44 Allowed Glycine 1 N--CA 1.516 4.02 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 177.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -161.54 -53.34 0.05 OUTLIER 'General case' 0 N--CA 1.529 3.508 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 48.1 mtt -153.31 77.8 1.14 Allowed 'General case' 0 N--CA 1.522 3.151 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 95.1 p -136.34 4.59 2.92 Favored 'General case' 0 N--CA 1.519 2.979 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -175.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -110.99 -69.69 0.85 Allowed 'General case' 0 N--CA 1.529 3.491 0 CA-C-N 120.153 1.342 . . . . 0.0 111.592 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.98 -45.4 6.94 Favored 'General case' 0 N--CA 1.53 3.559 0 CA-C-N 118.538 0.608 . . . . 0.0 111.806 -176.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -80.05 -5.13 55.28 Favored 'General case' 0 N--CA 1.522 3.172 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 -177.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 571' ' ' LEU . . . . . 0.815 HD23 HD11 ' B' ' 582' ' ' ILE . 27.9 tp -83.42 -48.49 10.3 Favored 'General case' 0 N--CA 1.531 3.594 0 CA-C-N 120.165 1.348 . . . . 0.0 112.555 -177.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -47.06 -30.61 2.81 Favored 'General case' 1 N--CA 1.552 4.628 0 CA-C-N 119.855 1.207 . . . . 0.0 113.82 -178.682 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -68.84 -38.08 79.56 Favored 'General case' 0 N--CA 1.537 3.92 0 CA-C-N 118.724 0.693 . . . . 0.0 110.881 -178.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -49.96 -61.25 2.25 Favored 'General case' 0 N--CA 1.53 3.549 0 C-N-CA 124.769 1.228 . . . . 0.0 113.0 -179.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.0 -36.56 3.25 Favored 'General case' 0 N--CA 1.534 3.747 0 CA-C-O 118.511 -0.756 . . . . 0.0 111.905 -178.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 115.25 57.71 0.35 Allowed Glycine 1 N--CA 1.525 4.57 0 CA-C-N 119.144 0.883 . . . . 0.0 111.039 179.577 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -114.54 103.16 10.75 Favored 'General case' 0 N--CA 1.52 3.069 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 177.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -39.0 164.28 0.01 OUTLIER Glycine 1 N--CA 1.544 5.834 0 C-N-CA 125.441 1.496 . . . . 0.0 115.311 -176.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 579' ' ' ILE . . . . . 0.659 HG21 ' N6 ' ' E' ' 4' ' ' ' DA' 0.262 10.9 mt -81.89 -12.24 12.4 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.333 0 CA-C-N 118.888 1.344 . . . . 0.0 109.341 178.383 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 580' ' ' ALA . . . . . 0.675 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -70.05 -41.64 73.94 Favored 'General case' 0 N--CA 1.531 3.577 0 CA-C-N 120.363 1.438 . . . . 0.0 109.285 175.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -77.4 -37.71 51.37 Favored 'General case' 1 N--CA 1.54 4.03 0 CA-C-N 118.909 0.777 . . . . 0.0 111.877 179.144 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 582' ' ' ILE . . . . . 0.815 HD11 HD23 ' B' ' 571' ' ' LEU . 1.0 OUTLIER -66.57 -40.04 85.35 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.375 0 C-N-CA 123.421 0.688 . . . . 0.0 111.722 -176.101 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 583' ' ' THR . . . . . 0.537 HG23 ' CG2' ' B' ' 582' ' ' ILE . 44.2 p -99.89 -18.36 17.15 Favored 'General case' 0 N--CA 1.506 2.368 0 CA-C-O 117.744 -1.122 . . . . 0.0 112.057 -178.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -81.64 -20.95 38.58 Favored 'General case' 0 N--CA 1.528 3.475 0 CA-C-N 120.265 1.393 . . . . 0.0 107.909 173.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -66.33 -35.49 90.32 Favored Glycine 1 N--CA 1.518 4.116 0 N-CA-C 108.785 -1.726 . . . . 0.0 108.785 176.084 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 88.8 p -66.55 -32.6 74.04 Favored 'General case' 0 N--CA 1.534 3.769 0 CA-C-N 117.803 0.802 . . . . 0.0 111.188 177.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -64.14 -31.32 72.47 Favored 'General case' 0 N--CA 1.53 3.544 0 C-N-CA 123.566 0.747 . . . . 0.0 110.778 178.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 52.9 m -62.95 -41.07 99.39 Favored 'General case' 1 N--CA 1.54 4.047 0 C-N-CA 123.5 0.72 . . . . 0.0 110.77 178.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 57.2 mt -52.78 -48.49 66.79 Favored 'General case' 0 N--CA 1.531 3.578 0 C-N-CA 124.46 1.104 . . . . 0.0 111.956 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -61.03 -29.81 69.94 Favored 'General case' 1 N--CA 1.54 4.049 0 CA-C-O 118.691 -0.671 . . . . 0.0 112.349 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -71.39 -41.61 69.43 Favored 'General case' 0 N--CA 1.52 3.03 0 CA-C-N 118.391 0.541 . . . . 0.0 110.806 179.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -57.72 162.52 4.91 Favored Pre-proline 1 N--CA 1.542 4.15 0 CA-C-O 118.194 -0.908 . . . . 0.0 112.132 179.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -78.97 -177.98 4.31 Favored 'Trans proline' 0 C--N 1.379 2.134 0 C-N-CA 121.439 1.426 . . . . 0.0 110.514 178.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.1 t -99.36 -29.2 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.098 0 CA-C-O 117.757 -1.116 . . . . 0.0 111.286 -179.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -63.4 -41.32 98.75 Favored 'General case' 0 N--CA 1.517 2.882 0 CA-C-N 119.761 1.164 . . . . 0.0 110.535 -178.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 596' ' ' LEU . . . . . 0.51 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.7 mp -99.52 -15.88 18.5 Favored 'General case' 0 N--CA 1.511 2.582 0 C-N-CA 123.331 0.653 . . . . 0.0 111.762 179.099 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . 0.408 ' HA ' HD13 ' B' ' 600' ' ' LEU . 0.1 OUTLIER -67.48 -29.68 69.19 Favored 'General case' 0 N--CA 1.531 3.617 0 N-CA-C 103.119 -2.919 . . . . 0.0 103.119 167.851 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -56.36 -36.91 69.33 Favored 'General case' 0 N--CA 1.521 3.094 0 C-N-CA 124.302 1.041 . . . . 0.0 110.388 173.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 599' ' ' TRP . . . . . 0.65 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 50.4 t90 -63.59 -35.61 81.07 Favored 'General case' 0 N--CA 1.53 3.558 0 CA-C-O 117.657 -1.164 . . . . 0.0 108.112 178.288 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 600' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' B' ' 597' ' ' ARG . 6.2 mp -54.93 -37.03 65.9 Favored 'General case' 1 N--CA 1.544 4.245 0 CA-C-N 119.37 0.986 . . . . 0.0 108.429 176.501 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -70.81 -34.18 71.47 Favored 'General case' 0 N--CA 1.532 3.634 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 176.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 602' ' ' GLU . . . . . 0.406 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.5 OUTLIER -62.2 -24.4 67.2 Favored 'General case' 1 N--CA 1.546 4.363 0 C-N-CA 123.491 0.716 . . . . 0.0 109.88 174.868 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' B' B ' 603' ' ' VAL . . . . . 0.564 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.5 OUTLIER -121.46 13.73 6.06 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.448 0 C-N-CA 123.851 0.861 . . . . 0.0 111.888 -177.565 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 45.0 mt -126.6 -61.95 1.16 Allowed 'General case' 0 N--CA 1.528 3.426 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 176.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.29 -48.67 68.15 Favored 'General case' 0 N--CA 1.539 3.989 0 C-N-CA 124.573 1.149 . . . . 0.0 111.295 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 42.4 mtpt 70.85 96.45 0.07 Allowed 'General case' 0 N--CA 1.531 3.6 0 C-N-CA 124.768 1.227 . . . . 0.0 109.479 -179.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 75.6 m . . . . . 0 N--CA 1.522 3.129 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.961 -179.46 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.128 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 998' ' ' TRP . . . . . 0.685 ' HB2' HG23 ' A' ' 44' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.193 0 CA-C-O 118.523 -0.751 . . . . 0.0 109.283 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.413 -10.547 4 O4'-C1'-N19 120.014 15.267 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.275 4 O4'-C1'-N19 119.178 14.223 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.419 -9.943 4 O4'-C1'-N19 119.397 14.496 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . 0.568 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 6 C3'--C2' 1.416 -10.225 3 O4'-C1'-N19 120.242 15.553 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' E' E ' 5' ' ' ' DC' . . . . . 0.568 ' H41' ' HA ' ' B' ' 580' ' ' ALA . . . . . . . . 6 O3'--C3' 1.576 11.172 3 C4'-C3'-C2' 116.52 13.32 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.405 -11.335 4 O4'-C1'-N19 118.556 13.445 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' E' E ' 7' ' ' ' DA' . . . . . 0.714 H2'' " H5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.389 -12.904 4 C4'-C3'-C2' 111.952 8.752 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' E' E ' 8' ' ' ' DG' . . . . . 0.714 " H5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 O3'--C3' 1.563 10.176 4 O4'-C1'-N19 119.827 15.033 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.574 11.029 4 O4'-C1'-N19 118.632 13.541 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.414 -10.403 3 O4'-C1'-N19 119.483 14.604 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.409 -10.938 5 O4'-C1'-N19 119.599 14.749 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.407 -11.081 2 O4'-C1'-N19 120.06 15.325 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.411 -10.696 4 O4'-C1'-N19 119.276 14.345 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' E' E ' 14' ' ' ' DT' . . . . . 0.733 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 7 C3'--C2' 1.413 -10.497 3 C4'-C3'-C2' 117.125 13.925 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' E' E ' 15' ' ' ' DA' . . . . . 0.91 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.418 -10.002 6 O4'-C1'-N19 119.523 14.653 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.418 -10.008 6 O4'-C1'-N19 119.683 14.854 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.573 10.946 4 O4'-C1'-N19 119.53 14.663 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.407 -11.105 5 O4'-C1'-N19 120.257 15.572 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.107 2 O4'-C1'-N19 120.019 15.274 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.507 6.686 5 O4'-C1'-N19 118.922 13.902 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.564 10.223 3 C4'-C3'-C2' 116.992 13.792 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.411 -10.747 3 O4'-C1'-N19 119.76 14.95 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.407 -11.082 5 O4'-C1'-N19 120.312 15.64 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' F' F ' 4' ' ' ' DA' . . . . . 0.673 ' H62' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.416 -10.164 2 O4'-C1'-N19 119.184 14.23 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' F' F ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.134 5 C4'-C3'-C2' 116.028 12.828 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -11.001 4 O4'-C1'-N19 118.357 13.196 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C4'--C3' 1.402 -12.608 4 N19-C1'-C2' 129.924 9.827 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.416 -10.232 5 O4'-C1'-N19 119.348 14.435 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.566 10.358 3 O4'-C1'-N19 118.846 13.807 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.616 4 O4'-C1'-N19 118.575 13.469 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.414 -10.401 4 O4'-C1'-N19 121.153 16.691 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -11.013 5 O4'-C1'-N19 120.102 15.378 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.409 -10.891 3 O4'-C1'-N19 119.806 15.008 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' F' F ' 14' ' ' ' DT' . . . . . 0.915 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.417 -10.138 5 O4'-C1'-N19 118.62 13.524 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' F' F ' 15' ' ' ' DA' . . . . . 0.968 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.43 -8.788 4 O4'-C1'-N19 119.401 14.501 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.416 -10.16 4 O4'-C1'-N19 119.772 14.965 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.362 5 O4'-C1'-N19 119.098 14.122 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -10.027 3 O4'-C1'-N19 120.096 15.37 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.423 -9.505 3 O4'-C1'-N19 120.407 15.759 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 O4'--C1' 1.51 6.947 4 O4'-C1'-N19 118.791 13.739 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 . . . . . 0 N--CA 1.499 2.002 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 55.6 m -135.13 138.2 28.67 Favored Pre-proline 0 N--CA 1.521 3.124 0 CA-C-O 117.785 -1.102 . . . . 0.0 110.34 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -69.1 -52.53 0.37 Allowed 'Trans proline' 0 C--N 1.387 2.575 0 C-N-CA 122.809 2.339 . . . . 0.0 112.907 -178.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -92.18 -33.43 14.71 Favored 'General case' 0 N--CA 1.532 3.643 0 CA-C-O 118.281 -0.866 . . . . 0.0 112.369 -177.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 21.3 m -66.23 -34.73 78.67 Favored 'General case' 1 N--CA 1.539 4.024 0 CA-C-N 119.172 0.897 . . . . 0.0 112.242 -177.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -143.56 128.77 18.76 Favored 'General case' 0 N--CA 1.52 3.056 0 CA-C-N 118.609 0.641 . . . . 0.0 110.782 -179.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -130.67 -53.5 1.07 Allowed 'General case' 0 N--CA 1.52 3.06 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 179.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 19.3 ptm -155.28 125.22 6.58 Favored 'General case' 0 N--CA 1.526 3.347 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 178.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.98 144.1 48.98 Favored 'General case' 0 N--CA 1.534 3.74 0 C-N-CA 122.705 0.402 . . . . 0.0 111.892 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -121.0 117.58 27.65 Favored 'General case' 0 N--CA 1.52 3.067 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -161.98 124.87 2.99 Favored 'General case' 0 N--CA 1.533 3.713 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -179.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.0 ttt180 -153.82 144.84 22.78 Favored 'General case' 0 N--CA 1.524 3.243 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -177.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 38.8 m-70 -119.26 129.4 54.9 Favored 'General case' 0 N--CA 1.521 3.12 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 178.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -83.07 100.74 10.69 Favored 'General case' 0 N--CA 1.526 3.334 0 CA-C-O 121.295 0.569 . . . . 0.0 111.683 -177.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -148.54 -67.36 0.23 Allowed 'General case' 0 N--CA 1.534 3.737 0 N-CA-C 105.777 -1.935 . . . . 0.0 105.777 177.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.423 ' CE3' HD23 ' B' ' 551' ' ' LEU . 59.1 t-105 -51.03 -37.18 43.7 Favored 'General case' 1 N--CA 1.543 4.192 0 C-N-CA 124.253 1.021 . . . . 0.0 109.182 174.125 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.507 HD22 ' N ' ' A' ' 20' ' ' LEU . 2.9 mm? -90.34 -25.95 20.2 Favored 'General case' 0 N--CA 1.526 3.345 0 CA-C-O 117.852 -1.07 . . . . 0.0 111.089 -178.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.2 mtt-85 -53.69 -28.34 33.16 Favored 'General case' 1 N--CA 1.539 4.002 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 173.223 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.614 ' HB2' HG21 ' B' ' 555' ' ' VAL . 47.7 t80 -87.11 -39.04 15.92 Favored 'General case' 0 N--CA 1.501 2.125 0 CA-C-O 115.907 -1.997 . . . . 0.0 109.276 172.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 91.1 t -66.15 -58.26 7.36 Favored 'Isoleucine or valine' 1 N--CA 1.577 5.905 0 CA-C-N 122.462 2.392 . . . . 0.0 112.704 -177.182 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -55.7 -45.84 77.79 Favored 'General case' 1 N--CA 1.548 4.451 0 CA-C-N 119.957 1.253 . . . . 0.0 110.914 -177.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.7 mp -71.71 -24.34 61.79 Favored 'General case' 0 N--CA 1.531 3.603 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.23 177.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.501 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -66.85 -33.5 75.75 Favored 'General case' 0 N--CA 1.519 3.016 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 176.172 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -65.33 -26.91 68.25 Favored 'General case' 0 N--CA 1.518 2.956 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.679 177.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -69.7 -39.71 76.74 Favored 'General case' 0 N--CA 1.53 3.54 0 CA-C-N 119.167 0.894 . . . . 0.0 109.031 177.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.582 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -84.41 -8.9 58.83 Favored 'General case' 0 N--CA 1.504 2.232 0 CA-C-O 118.489 -0.767 . . . . 0.0 110.633 177.485 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -80.63 -32.79 36.17 Favored 'General case' 0 N--CA 1.529 3.522 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 176.293 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -56.02 -46.49 78.78 Favored 'General case' 0 N--CA 1.533 3.679 0 C-N-CA 124.2 1.0 . . . . 0.0 108.591 176.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -96.26 -83.48 0.37 Allowed 'General case' 0 N--CA 1.517 2.922 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 178.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p30 150.32 49.7 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.888 0 C-N-CA 127.875 2.47 . . . . 0.0 108.045 177.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.581 HD22 ' CD2' ' B' ' 596' ' ' LEU . 11.5 mt -103.16 9.49 38.28 Favored 'General case' 0 N--CA 1.526 3.326 0 C-N-CA 124.099 0.96 . . . . 0.0 111.156 -178.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.483 ' HA ' ' HB2' ' A' ' 38' ' ' LEU . 48.5 p-80 -81.17 3.86 22.18 Favored 'General case' 0 N--CA 1.513 2.711 0 C-N-CA 123.224 0.61 . . . . 0.0 109.558 174.547 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.513 HD23 HD12 ' A' ' 39' ' ' LEU . 17.7 mt -95.84 -49.94 0.24 Allowed Pre-proline 0 N--CA 1.512 2.649 0 C-N-CA 125.374 1.47 . . . . 0.0 109.373 -175.327 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.433 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 7.0 Cg_exo -62.87 -37.97 51.14 Favored 'Trans proline' 0 N--CA 1.513 2.638 0 N-CA-C 105.703 -2.46 . . . . 0.0 105.703 169.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.483 ' HB2' ' HA ' ' A' ' 35' ' ' HIS . 0.9 OUTLIER -54.44 -44.36 72.41 Favored 'General case' 0 N--CA 1.536 3.874 0 C-N-CA 124.442 1.097 . . . . 0.0 109.38 174.151 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.739 HD11 ' CE2' ' B' ' 519' ' ' TRP . 0.4 OUTLIER -54.79 -52.77 61.61 Favored 'General case' 1 N--CA 1.561 5.087 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.626 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -58.48 -17.1 18.38 Favored 'General case' 1 N--CA 1.543 4.194 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -179.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.639 HD22 ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -107.27 -35.23 6.87 Favored 'General case' 0 N--CA 1.529 3.496 0 CA-C-O 117.738 -1.125 . . . . 0.0 112.971 -176.611 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.423 ' N ' HD13 ' A' ' 41' ' ' LEU . 18.0 ptp -125.48 21.87 7.77 Favored 'General case' 1 N--CA 1.549 4.485 0 CA-C-N 120.505 1.502 . . . . 0.0 112.641 -177.958 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -137.76 -68.75 0.46 Allowed 'General case' 0 N--CA 1.515 2.804 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.295 177.174 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.4 p 122.82 157.25 0.0 OUTLIER Pre-proline 1 N--CA 1.568 5.439 0 C-N-CA 128.528 2.731 . . . . 0.0 109.534 -179.526 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -67.28 -30.49 37.14 Favored 'Trans proline' 0 C--N 1.393 2.875 0 C-N-CA 122.316 2.011 . . . . 0.0 109.429 175.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -68.35 -27.07 65.93 Favored 'General case' 0 N--CA 1.531 3.575 0 CA-C-O 118.208 -0.901 . . . . 0.0 109.55 176.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -70.65 -30.47 67.1 Favored 'General case' 0 N--CA 1.52 3.069 0 CA-C-O 117.588 -1.196 . . . . 0.0 109.935 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 -85.76 -18.0 34.25 Favored 'General case' 0 N--CA 1.537 3.88 0 CA-C-N 119.617 1.098 . . . . 0.0 108.394 174.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -75.86 -22.91 55.72 Favored 'General case' 0 N--CA 1.523 3.179 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 172.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.79 -35.24 15.81 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 117.729 -1.129 . . . . 0.0 109.252 179.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.481 ' O ' HG23 ' A' ' 55' ' ' VAL . 31.2 tp -74.16 -20.0 60.37 Favored 'General case' 0 N--CA 1.534 3.741 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 172.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.405 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -67.95 -70.51 1.12 Allowed Glycine 0 N--CA 1.496 2.687 0 C-N-CA 125.161 1.363 . . . . 0.0 110.627 177.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.6 m -73.54 -25.43 60.39 Favored 'General case' 0 N--CA 1.531 3.607 0 CA-C-O 117.759 -1.115 . . . . 0.0 112.46 -178.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -69.62 -51.4 35.37 Favored 'General case' 0 N--CA 1.536 3.866 0 CA-C-N 120.269 1.395 . . . . 0.0 107.914 177.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.551 HG22 ' HE2' ' B' ' 542' ' ' MET . 21.5 t -61.82 -20.22 23.08 Favored 'Isoleucine or valine' 1 N--CA 1.543 4.199 0 O-C-N 120.977 -1.077 . . . . 0.0 109.402 175.13 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.5 mmm180 -74.55 -44.08 52.76 Favored 'General case' 0 N--CA 1.522 3.147 0 CA-C-O 117.098 -1.429 . . . . 0.0 112.082 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.417 HD13 ' N ' ' A' ' 58' ' ' VAL . 0.0 OUTLIER -74.15 -23.87 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.507 0 CA-C-N 121.942 2.155 . . . . 0.0 111.161 -179.866 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.417 ' N ' HD13 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -88.36 -50.56 13.4 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.107 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 -178.153 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -62.26 -25.46 67.85 Favored 'General case' 0 N--CA 1.532 3.653 0 CA-C-O 118.818 -0.611 . . . . 0.0 109.976 178.296 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -95.05 -21.39 18.6 Favored 'General case' 0 N--CA 1.524 3.258 0 CA-C-O 117.828 -1.082 . . . . 0.0 111.113 178.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -78.08 -46.14 21.61 Favored 'General case' 0 N--CA 1.533 3.678 0 CA-C-N 120.011 1.278 . . . . 0.0 108.026 178.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 30.9 mt -51.84 -26.32 9.7 Favored 'General case' 0 N--CA 1.539 3.987 0 C-N-CA 124.546 1.139 . . . . 0.0 112.203 178.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -90.23 -52.08 5.12 Favored 'General case' 0 N--CA 1.521 3.075 0 N-CA-C 107.397 -1.335 . . . . 0.0 107.397 178.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.1 94.41 0.26 Allowed Glycine 0 N--CA 1.514 3.854 0 CA-C-O 119.442 -0.643 . . . . 0.0 112.424 177.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -160.23 -59.05 0.06 Allowed 'General case' 0 N--CA 1.529 3.504 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 177.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 59.0 mtt -140.19 74.1 1.45 Allowed 'General case' 0 N--CA 1.526 3.351 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 178.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 8.4 t -136.08 -14.59 1.79 Allowed 'General case' 0 N--CA 1.525 3.296 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -176.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -106.7 -56.49 2.18 Favored 'General case' 0 N--CA 1.529 3.492 0 CA-C-N 120.284 1.402 . . . . 0.0 112.122 -176.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 1.9 ttm180 -102.57 -54.03 2.75 Favored 'General case' 0 N--CA 1.53 3.535 0 C-N-CA 123.294 0.638 . . . . 0.0 111.469 -176.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.39 -8.54 56.29 Favored 'General case' 0 N--CA 1.518 2.947 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -176.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.56 HD23 HG21 ' A' ' 82' ' ' ILE . 37.0 tp -80.91 -51.33 8.68 Favored 'General case' 0 N--CA 1.528 3.45 0 CA-C-O 117.6 -1.19 . . . . 0.0 113.061 -178.017 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.06 -31.85 0.14 Allowed 'General case' 1 N--CA 1.552 4.669 0 N-CA-C 115.038 1.496 . . . . 0.0 115.038 -176.937 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -72.78 -44.24 61.81 Favored 'General case' 0 N--CA 1.536 3.847 0 CA-C-N 119.18 0.9 . . . . 0.0 110.048 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -53.26 -50.14 65.44 Favored 'General case' 0 N--CA 1.529 3.504 0 C-N-CA 124.631 1.172 . . . . 0.0 112.903 -179.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 56.7 mt -110.54 -51.33 2.88 Favored 'General case' 0 N--CA 1.526 3.365 0 C-N-CA 122.973 0.509 . . . . 0.0 111.646 -177.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 117.59 17.94 5.44 Favored Glycine 1 N--CA 1.527 4.724 0 CA-C-O 118.095 -1.392 . . . . 0.0 111.867 -178.089 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -89.21 112.74 23.84 Favored 'General case' 0 N--CA 1.512 2.643 0 CA-C-N 119.594 1.697 . . . . 0.0 106.508 178.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -42.67 173.95 0.01 OUTLIER Glycine 1 N--CA 1.535 5.299 0 C-N-CA 125.25 1.405 . . . . 0.0 115.253 -177.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.673 HG21 ' H62' ' F' ' 4' ' ' ' DA' . 3.8 mt -80.06 -17.29 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.707 0 CA-C-N 118.5 1.15 . . . . 0.0 107.984 177.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.91 ' HB2' ' H62' ' E' ' 15' ' ' ' DA' . . . -71.86 -6.63 43.12 Favored 'General case' 0 N--CA 1.521 3.121 0 CA-C-O 117.403 -1.284 . . . . 0.0 111.223 174.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.505 HG22 ' CZ2' ' A' ' 898' ' ' TRP . 0.8 OUTLIER -104.17 -44.28 5.02 Favored 'General case' 0 N--CA 1.53 3.539 0 CA-C-N 120.77 1.623 . . . . 0.0 110.26 177.292 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.56 HG21 HD23 ' A' ' 71' ' ' LEU . 0.1 OUTLIER -72.23 -38.71 62.92 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.652 0 CA-C-N 119.307 0.958 . . . . 0.0 111.202 -177.771 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 44.3 p -82.15 -25.65 34.17 Favored 'General case' 0 N--CA 1.521 3.104 0 CA-C-O 118.865 -0.588 . . . . 0.0 109.917 178.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.9 ttp180 -67.71 -35.54 78.97 Favored 'General case' 1 N--CA 1.54 4.044 0 N-CA-C 107.319 -1.363 . . . . 0.0 107.319 173.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -69.94 -26.24 74.59 Favored Glycine 1 N--CA 1.516 4.025 0 CA-C-O 118.094 -1.392 . . . . 0.0 111.916 178.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 89.7 p -66.14 -25.5 67.0 Favored 'General case' 1 N--CA 1.543 4.222 0 CA-C-N 119.537 1.669 . . . . 0.0 110.754 178.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -54.81 -25.28 27.3 Favored 'General case' 1 N--CA 1.545 4.287 0 C-N-CA 123.281 0.632 . . . . 0.0 110.752 176.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.9 m -49.88 -42.85 48.74 Favored 'General case' 1 N--CA 1.547 4.382 0 C-N-CA 124.837 1.255 . . . . 0.0 111.467 178.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 37.8 mt -65.02 -41.98 94.8 Favored 'General case' 0 N--CA 1.519 2.99 0 C-N-CA 123.324 0.65 . . . . 0.0 110.259 178.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.11 0.06 55.88 Favored 'General case' 0 N--CA 1.532 3.643 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -179.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -113.18 -64.0 1.37 Allowed 'General case' 0 N--CA 1.518 2.958 0 CA-C-N 120.047 1.294 . . . . 0.0 111.741 -179.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -49.73 159.31 0.74 Allowed Pre-proline 1 N--CA 1.548 4.461 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -178.528 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.407 ' O ' ' HB2' ' A' ' 97' ' ' ARG . 39.8 Cg_endo -78.01 -179.31 5.33 Favored 'Trans proline' 0 C--N 1.384 2.427 0 C-N-CA 121.735 1.623 . . . . 0.0 110.248 177.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.1 t -98.75 -27.15 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.117 0 CA-C-O 117.545 -1.217 . . . . 0.0 111.69 -178.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -61.9 -43.51 98.69 Favored 'General case' 0 N--CA 1.518 2.936 0 CA-C-N 120.189 1.359 . . . . 0.0 110.459 -178.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.423 ' CD2' HD22 ' B' ' 534' ' ' LEU . 6.9 mp -98.57 -16.07 19.26 Favored 'General case' 0 N--CA 1.509 2.52 0 CA-C-O 118.676 -0.678 . . . . 0.0 112.149 179.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -67.76 -29.65 68.91 Favored 'General case' 0 N--CA 1.538 3.948 0 N-CA-C 103.591 -2.744 . . . . 0.0 103.591 168.51 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -55.24 -39.1 69.34 Favored 'General case' 0 N--CA 1.518 2.971 0 C-N-CA 123.892 0.877 . . . . 0.0 110.259 174.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.632 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 54.9 t90 -66.22 -34.67 78.53 Favored 'General case' 0 N--CA 1.528 3.462 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 177.246 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.1 -35.29 59.46 Favored 'General case' 0 N--CA 1.537 3.916 0 CA-C-N 118.923 0.783 . . . . 0.0 108.905 175.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -71.76 -37.12 70.56 Favored 'General case' 1 N--CA 1.539 4.002 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 175.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.451 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 3.0 mt-10 -60.51 -22.27 63.38 Favored 'General case' 1 N--CA 1.544 4.251 0 C-N-CA 123.607 0.763 . . . . 0.0 110.636 175.047 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.517 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -118.05 6.46 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.514 0 CA-C-O 118.744 -0.646 . . . . 0.0 112.215 -177.017 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.2 mt -111.67 -62.05 1.61 Allowed 'General case' 0 N--CA 1.525 3.281 0 N-CA-C 105.793 -1.929 . . . . 0.0 105.793 175.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.0 tt -46.42 -48.69 18.72 Favored 'General case' 1 N--CA 1.54 4.049 0 C-N-CA 125.572 1.549 . . . . 0.0 112.287 -179.113 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -94.37 -58.45 2.21 Favored 'General case' 0 N--CA 1.524 3.241 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 89.7 p . . . . . 0 N--CA 1.534 3.764 0 C-N-CA 125.35 1.46 . . . . 0.0 112.724 179.956 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 . . . . . 0 N--CA 1.499 2.01 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 8.4 t -140.63 125.93 11.2 Favored Pre-proline 0 N--CA 1.521 3.095 0 CA-C-O 117.389 -1.291 . . . . 0.0 109.489 179.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -75.18 -47.3 0.2 Allowed 'Trans proline' 0 C--N 1.388 2.635 0 C-N-CA 122.58 2.187 . . . . 0.0 110.411 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -89.78 155.63 19.05 Favored 'General case' 0 N--CA 1.533 3.709 0 C-N-CA 122.969 0.507 . . . . 0.0 111.149 -178.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 62.5 m -80.5 133.82 35.88 Favored 'General case' 0 N--CA 1.525 3.306 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.984 -179.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -100.41 -41.08 7.16 Favored 'General case' 0 N--CA 1.523 3.225 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . 64.22 142.66 0.02 OUTLIER 'General case' 0 N--CA 1.534 3.763 0 C-N-CA 124.722 1.209 . . . . 0.0 112.487 178.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 5.4 tpt -82.9 -44.4 15.42 Favored 'General case' 0 N--CA 1.521 3.084 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -113.4 137.62 51.27 Favored 'General case' 0 N--CA 1.525 3.284 0 C-N-CA 123.582 0.753 . . . . 0.0 110.544 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -117.08 -42.27 2.94 Favored 'General case' 0 N--CA 1.527 3.378 0 C-N-CA 123.305 0.642 . . . . 0.0 110.589 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 76.87 -98.82 0.02 OUTLIER 'General case' 0 N--CA 1.533 3.715 0 CA-C-O 117.612 -1.185 . . . . 0.0 108.597 -178.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -144.55 -66.03 0.34 Allowed 'General case' 0 N--CA 1.531 3.579 0 CA-C-N 120.921 1.691 . . . . 0.0 109.518 179.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 9.3 m170 -157.17 160.45 38.77 Favored 'General case' 0 N--CA 1.53 3.54 0 CA-C-N 118.422 0.556 . . . . 0.0 111.953 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -108.71 126.17 52.71 Favored 'General case' 0 N--CA 1.52 3.07 0 C-N-CA 123.404 0.682 . . . . 0.0 109.607 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -104.02 -67.55 0.89 Allowed 'General case' 0 N--CA 1.521 3.091 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 519' ' ' TRP . . . . . 0.739 ' CE2' HD11 ' A' ' 39' ' ' LEU . 64.2 t-105 -42.43 -29.54 0.28 Allowed 'General case' 1 N--CA 1.549 4.482 0 C-N-CA 123.954 0.901 . . . . 0.0 113.335 179.166 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 520' ' ' LEU . . . . . 0.55 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.2 mm? -93.98 -31.64 14.18 Favored 'General case' 0 N--CA 1.524 3.274 0 CA-C-O 117.696 -1.145 . . . . 0.0 113.879 -172.197 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 54.3 mtt-85 -61.7 -25.76 67.62 Favored 'General case' 1 N--CA 1.546 4.361 0 N-CA-C 105.729 -1.952 . . . . 0.0 105.729 171.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . 0.53 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 2.0 m-85 -76.24 -43.24 42.97 Favored 'General case' 0 N--CA 1.511 2.602 0 CA-C-O 117.287 -1.34 . . . . 0.0 107.401 173.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 523' ' ' VAL . . . . . 0.451 HG23 ' O ' ' B' ' 519' ' ' TRP . 54.1 t -65.82 -17.29 21.95 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.24 0 CA-C-O 117.717 -1.135 . . . . 0.0 112.246 179.549 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -77.62 -52.59 8.77 Favored 'General case' 0 N--CA 1.527 3.419 0 CA-C-N 120.396 1.453 . . . . 0.0 107.885 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . 0.509 HD23 ' HB ' ' A' ' 103' ' ' VAL . 5.1 mp -75.35 -14.6 60.49 Favored 'General case' 0 N--CA 1.53 3.547 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 175.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.23 -35.92 68.97 Favored 'General case' 0 N--CA 1.521 3.102 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 174.153 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 30.7 ttmt -68.73 -21.96 64.36 Favored 'General case' 0 N--CA 1.512 2.644 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.633 176.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -67.55 -40.17 84.96 Favored 'General case' 0 N--CA 1.535 3.82 0 CA-C-N 119.365 0.984 . . . . 0.0 108.465 176.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 529' ' ' ALA . . . . . 0.632 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -90.22 -13.46 35.41 Favored 'General case' 0 N--CA 1.504 2.24 0 CA-C-O 117.968 -1.015 . . . . 0.0 111.637 178.71 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.29 -28.64 42.25 Favored 'General case' 0 N--CA 1.537 3.908 0 CA-C-N 120.787 1.63 . . . . 0.0 107.461 177.478 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -61.7 -47.77 83.81 Favored 'General case' 0 N--CA 1.527 3.415 0 C-N-CA 124.421 1.089 . . . . 0.0 108.425 176.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -91.4 -85.33 0.24 Allowed 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 177.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.8 p30 152.58 51.76 0.0 OUTLIER 'General case' 1 N--CA 1.555 4.825 0 C-N-CA 127.339 2.256 . . . . 0.0 108.263 176.456 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 534' ' ' LEU . . . . . 0.423 HD22 ' CD2' ' A' ' 96' ' ' LEU . 7.0 mt -109.89 12.16 23.95 Favored 'General case' 0 N--CA 1.519 2.997 0 C-N-CA 125.249 1.42 . . . . 0.0 109.924 -179.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 535' ' ' HIS . . . . . 0.493 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 24.6 p-80 -86.38 9.09 19.08 Favored 'General case' 0 N--CA 1.516 2.871 0 C-N-CA 124.146 0.979 . . . . 0.0 108.873 175.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 536' ' ' LEU . . . . . 0.526 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 20.3 mt -97.05 -52.04 0.22 Allowed Pre-proline 0 N--CA 1.502 2.173 0 CA-C-O 116.589 -1.672 . . . . 0.0 107.794 -176.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 537' ' ' PRO . . . . . 0.526 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 2.7 Cg_exo -65.8 -34.1 41.22 Favored 'Trans proline' 0 C--N 1.401 3.308 0 N-CA-C 106.693 -2.08 . . . . 0.0 106.693 170.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.47 -51.68 68.83 Favored 'General case' 0 N--CA 1.523 3.211 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 174.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 40.1 mt -77.45 -6.81 54.79 Favored 'General case' 0 N--CA 1.535 3.811 0 CA-C-O 118.441 -0.79 . . . . 0.0 112.599 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -75.36 -22.67 57.36 Favored 'General case' 0 N--CA 1.518 2.963 0 CA-C-O 117.601 -1.19 . . . . 0.0 111.576 179.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 541' ' ' LEU . . . . . 0.408 HD13 ' O ' ' B' ' 541' ' ' LEU . 0.2 OUTLIER -127.58 -27.47 2.86 Favored 'General case' 0 N--CA 1.524 3.256 0 CA-C-O 117.214 -1.374 . . . . 0.0 113.648 -179.839 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 542' ' ' MET . . . . . 0.551 ' HE2' HG22 ' A' ' 55' ' ' VAL . 2.2 ptp -79.77 9.68 4.92 Favored 'General case' 1 N--CA 1.543 4.221 0 CA-C-N 121.663 2.028 . . . . 0.0 110.583 177.42 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 1.6 tp -132.78 -89.36 0.42 Allowed 'General case' 0 N--CA 1.519 2.985 0 CA-C-N 120.183 1.356 . . . . 0.0 111.823 178.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 544' ' ' THR . . . . . 0.626 HG23 ' HB2' ' A' ' 898' ' ' TRP . 0.1 OUTLIER 162.56 175.45 0.04 OUTLIER Pre-proline 1 N--CA 1.578 5.967 0 C-N-CA 125.12 1.368 . . . . 0.0 109.971 -177.682 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -64.73 -21.45 64.93 Favored 'Trans proline' 0 N--CA 1.527 3.475 0 C-N-CA 122.25 1.967 . . . . 0.0 109.834 173.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -72.29 8.87 1.17 Allowed 'General case' 0 N--CA 1.517 2.908 0 C-N-CA 123.38 0.672 . . . . 0.0 110.728 175.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.6 -57.91 3.96 Favored 'General case' 0 N--CA 1.51 2.568 0 CA-C-O 117.493 -1.241 . . . . 0.0 108.326 178.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 -93.65 -5.98 47.42 Favored 'General case' 0 N--CA 1.527 3.422 0 CA-C-N 120.303 1.41 . . . . 0.0 111.507 175.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -74.35 -45.89 44.2 Favored 'General case' 0 N--CA 1.535 3.777 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 173.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -90.34 -23.33 21.16 Favored 'General case' 0 N--CA 1.521 3.108 0 CA-C-O 117.652 -1.166 . . . . 0.0 112.363 179.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 551' ' ' LEU . . . . . 0.423 HD23 ' CE3' ' A' ' 19' ' ' TRP . 17.4 tp -80.86 -33.28 34.6 Favored 'General case' 1 N--CA 1.54 4.071 0 CA-C-N 120.657 1.571 . . . . 0.0 107.707 176.539 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -73.49 -52.76 8.11 Favored Glycine 0 N--CA 1.496 2.676 0 N-CA-C 109.905 -1.278 . . . . 0.0 109.905 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 1.8 m -71.97 -33.8 68.45 Favored 'General case' 0 N--CA 1.536 3.873 0 CA-C-N 118.415 1.108 . . . . 0.0 112.574 -177.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -67.23 -52.64 38.54 Favored 'General case' 1 N--CA 1.54 4.052 0 N-CA-C 106.916 -1.512 . . . . 0.0 106.916 176.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 555' ' ' VAL . . . . . 0.614 HG21 ' HB2' ' A' ' 22' ' ' PHE . 42.8 t -61.25 -18.43 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.66 0 CA-C-O 117.938 -1.03 . . . . 0.0 110.485 177.406 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 -79.25 -42.21 26.41 Favored 'General case' 0 N--CA 1.525 3.291 0 CA-C-O 116.869 -1.539 . . . . 0.0 111.152 177.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 557' ' ' ILE . . . . . 0.537 ' HB ' HG22 ' B' ' 582' ' ' ILE . 0.0 OUTLIER -71.83 -22.04 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.946 0 CA-C-N 122.178 2.263 . . . . 0.0 110.742 179.911 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 558' ' ' VAL . . . . . 0.542 ' CG1' HD21 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -87.14 -52.1 12.06 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.746 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 -178.784 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -67.1 -17.0 64.68 Favored 'General case' 0 N--CA 1.523 3.188 0 CA-C-O 118.599 -0.715 . . . . 0.0 110.975 178.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -96.97 -23.9 16.07 Favored 'General case' 0 N--CA 1.528 3.445 0 CA-C-O 118.277 -0.868 . . . . 0.0 109.946 176.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 21.2 tp -78.47 -56.66 4.27 Favored 'General case' 0 N--CA 1.534 3.742 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 178.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 6.7 tp -45.18 -30.11 1.1 Allowed 'General case' 0 N--CA 1.537 3.914 0 C-N-CA 125.196 1.398 . . . . 0.0 112.82 -179.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.14 -50.22 7.59 Favored 'General case' 0 N--CA 1.527 3.392 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 177.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 77.7 94.55 0.24 Allowed Glycine 0 N--CA 1.514 3.862 0 CA-C-O 119.616 -0.547 . . . . 0.0 113.51 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -165.86 -57.95 0.03 OUTLIER 'General case' 0 N--CA 1.531 3.608 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 177.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 47.4 mtt -131.18 69.9 1.47 Allowed 'General case' 0 N--CA 1.519 3.0 0 N-CA-C 106.564 -1.643 . . . . 0.0 106.564 178.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 567' ' ' SER . . . . . 0.43 ' HA ' HD22 ' B' ' 571' ' ' LEU . 6.1 t -126.25 -8.52 6.44 Favored 'General case' 0 N--CA 1.523 3.209 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -177.071 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -113.47 -70.67 0.79 Allowed 'General case' 0 N--CA 1.526 3.366 0 CA-C-N 120.042 1.292 . . . . 0.0 111.843 -178.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 24.0 mtt180 -91.43 -52.37 4.82 Favored 'General case' 0 N--CA 1.53 3.532 0 CA-C-N 118.853 0.751 . . . . 0.0 110.38 -178.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -68.68 -12.16 61.05 Favored 'General case' 0 N--CA 1.519 3.0 0 CA-C-O 118.183 -0.913 . . . . 0.0 112.613 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 571' ' ' LEU . . . . . 0.598 HD23 HG21 ' B' ' 582' ' ' ILE . 24.2 tp -80.72 -54.72 5.38 Favored 'General case' 0 N--CA 1.517 2.912 0 CA-C-N 119.554 1.07 . . . . 0.0 109.798 179.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -45.88 -32.35 2.6 Favored 'General case' 1 N--CA 1.545 4.281 0 CA-C-N 119.229 0.922 . . . . 0.0 112.507 -179.716 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -72.65 -42.12 64.72 Favored 'General case' 0 N--CA 1.534 3.757 0 C-N-CA 122.988 0.515 . . . . 0.0 110.61 -179.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -43.97 -56.57 3.86 Favored 'General case' 1 N--CA 1.539 4.002 0 C-N-CA 125.137 1.375 . . . . 0.0 113.568 -179.165 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -137.43 -41.74 0.56 Allowed 'General case' 0 N--CA 1.528 3.447 0 CA-C-O 118.814 -0.612 . . . . 0.0 111.579 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 125.66 98.78 1.15 Allowed Glycine 1 N--CA 1.517 4.047 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -126.72 -47.34 1.54 Allowed 'General case' 0 N--CA 1.525 3.311 0 C-N-CA 123.529 0.732 . . . . 0.0 109.44 178.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 108.14 161.05 20.65 Favored Glycine 1 N--CA 1.519 4.22 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -178.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 579' ' ' ILE . . . . . 0.568 HG21 ' N6 ' ' E' ' 4' ' ' ' DA' . 0.9 OUTLIER -84.01 -18.0 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.861 0 CA-C-N 119.219 1.51 . . . . 0.0 108.062 177.93 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 580' ' ' ALA . . . . . 0.968 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -71.01 -38.33 72.63 Favored 'General case' 0 N--CA 1.522 3.149 0 CA-C-N 119.843 1.201 . . . . 0.0 110.301 177.318 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 4.2 p -78.07 -46.86 19.7 Favored 'General case' 0 N--CA 1.536 3.855 0 CA-C-N 119.689 1.131 . . . . 0.0 111.659 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 582' ' ' ILE . . . . . 0.598 HG21 HD23 ' B' ' 571' ' ' LEU . 1.4 pt -68.49 -22.36 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.932 0 CA-C-O 117.854 -1.07 . . . . 0.0 113.289 -177.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 31.0 p -108.74 -21.55 12.63 Favored 'General case' 0 N--CA 1.521 3.095 0 CA-C-N 119.728 1.149 . . . . 0.0 111.95 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 11.3 ptt180 -82.75 -21.55 34.65 Favored 'General case' 0 N--CA 1.531 3.592 0 CA-C-N 119.98 1.264 . . . . 0.0 107.875 173.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -67.66 -31.87 77.09 Favored Glycine 0 N--CA 1.514 3.853 0 N-CA-C 109.703 -1.359 . . . . 0.0 109.703 176.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 88.2 p -65.92 -34.83 79.01 Favored 'General case' 1 N--CA 1.54 4.044 0 CA-C-N 118.537 1.168 . . . . 0.0 110.053 177.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -58.06 -29.04 65.08 Favored 'General case' 1 N--CA 1.539 4.01 0 C-N-CA 123.888 0.875 . . . . 0.0 111.306 178.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.31 -35.43 80.99 Favored 'General case' 0 N--CA 1.537 3.917 0 C-N-CA 123.26 0.624 . . . . 0.0 110.507 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 23.6 mt -73.14 -45.76 54.86 Favored 'General case' 0 N--CA 1.518 2.954 0 C-N-CA 123.651 0.78 . . . . 0.0 110.699 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.46 -30.71 31.19 Favored 'General case' 1 N--CA 1.552 4.631 0 C-N-CA 123.672 0.789 . . . . 0.0 112.351 -179.608 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -96.61 -35.22 11.13 Favored 'General case' 0 N--CA 1.519 3.013 0 C-N-CA 123.301 0.64 . . . . 0.0 111.259 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . 0.403 ' HB1' ' HD2' ' B' ' 593' ' ' PRO . . . -51.72 164.32 0.55 Allowed Pre-proline 1 N--CA 1.543 4.191 0 CA-C-O 118.197 -0.906 . . . . 0.0 112.941 -179.818 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 593' ' ' PRO . . . . . 0.403 ' HD2' ' HB1' ' B' ' 592' ' ' ALA . 38.4 Cg_endo -76.09 147.64 30.27 Favored 'Trans proline' 0 C--N 1.38 2.212 0 C-N-CA 121.873 1.715 . . . . 0.0 110.028 178.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.7 t -84.6 -26.24 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.745 0 CA-C-O 117.442 -1.266 . . . . 0.0 112.016 -178.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -65.17 -35.6 81.6 Favored 'General case' 0 N--CA 1.518 2.925 0 CA-C-N 120.282 1.401 . . . . 0.0 110.596 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 596' ' ' LEU . . . . . 0.581 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.8 mp -97.75 -21.23 17.09 Favored 'General case' 0 N--CA 1.517 2.879 0 C-N-CA 123.929 0.892 . . . . 0.0 110.423 178.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.51 -35.36 77.49 Favored 'General case' 1 N--CA 1.55 4.527 0 N-CA-C 103.764 -2.68 . . . . 0.0 103.764 168.503 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -57.36 -40.46 78.13 Favored 'General case' 0 N--CA 1.52 3.046 0 C-N-CA 125.358 1.463 . . . . 0.0 111.278 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 599' ' ' TRP . . . . . 0.582 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 57.5 t90 -57.97 -34.44 69.94 Favored 'General case' 1 N--CA 1.54 4.064 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 179.387 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 54.1 mt -53.68 -42.38 67.88 Favored 'General case' 0 N--CA 1.538 3.962 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 176.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -68.07 -33.76 75.16 Favored 'General case' 0 N--CA 1.53 3.545 0 O-C-N 123.802 0.689 . . . . 0.0 109.42 176.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 602' ' ' GLU . . . . . 0.418 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 0.6 OUTLIER -61.29 -25.02 66.83 Favored 'General case' 1 N--CA 1.542 4.149 0 C-N-CA 123.362 0.665 . . . . 0.0 110.148 175.27 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' B' B ' 603' ' ' VAL . . . . . 0.546 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.2 OUTLIER -120.59 7.61 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.463 0 C-N-CA 123.747 0.819 . . . . 0.0 112.772 -177.003 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.73 -57.06 1.92 Allowed 'General case' 0 N--CA 1.512 2.643 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 178.075 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.7 -65.33 0.65 Allowed 'General case' 0 N--CA 1.533 3.677 0 C-N-CA 124.869 1.268 . . . . 0.0 113.51 -177.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -96.16 -32.14 12.63 Favored 'General case' 0 N--CA 1.534 3.753 0 CA-C-O 118.678 -0.677 . . . . 0.0 112.11 -177.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 14.7 m . . . . . 1 N--CA 1.542 4.165 0 CA-C-N 119.106 0.866 . . . . 0.0 110.617 -179.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 898' ' ' TRP . . . . . 0.626 ' HB2' HG23 ' B' ' 544' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.133 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.102 0 CA-C-O 117.841 -1.076 . . . . 0.0 109.604 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.419 -9.949 3 O4'-C1'-N19 118.788 13.735 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.594 4 O4'-C1'-N19 119.81 15.012 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.423 -9.505 3 O4'-C1'-N19 119.632 14.791 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . 0.488 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 6 C3'--C2' 1.412 -10.587 5 O4'-C1'-N19 119.375 14.468 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' E' E ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.578 11.272 4 O4'-C1'-N19 118.648 13.56 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.408 -11.024 4 C4'-C3'-C2' 116.282 13.082 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' E' E ' 7' ' ' ' DA' . . . . . 0.69 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.391 -12.723 4 C4'-C3'-C2' 112.204 9.004 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' E' E ' 8' ' ' ' DG' . . . . . 0.69 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.413 -10.505 3 O4'-C1'-N19 120.458 15.823 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.573 10.925 5 O4'-C1'-N19 118.927 13.909 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.403 -11.464 5 O4'-C1'-N19 119.383 14.478 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.569 10.585 3 O4'-C1'-N19 121.876 17.595 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.678 6 O4'-C1'-N19 118.961 13.951 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 4 O3'--C3' 1.551 9.257 4 O4'-C1'-N19 119.604 14.755 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' E' E ' 14' ' ' ' DT' . . . . . 0.815 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.413 -10.517 6 O4'-C1'-N19 118.897 13.871 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' E' E ' 15' ' ' ' DA' . . . . . 0.893 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.429 -8.938 4 O4'-C1'-N19 119.354 14.442 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.415 -10.276 4 O4'-C1'-N19 120.445 15.806 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.572 10.838 4 O4'-C1'-N19 119.269 14.336 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.565 4 O4'-C1'-N19 119.949 15.186 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.427 -9.081 3 O4'-C1'-N19 119.261 14.326 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.51 6.939 4 O4'-C1'-N19 119.904 15.13 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.564 10.215 2 O4'-C1'-N19 118.641 13.551 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.412 -10.576 3 O4'-C1'-N19 119.025 14.031 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.408 -11.033 5 O4'-C1'-N19 120.531 15.913 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' F' F ' 4' ' ' ' DA' . . . . . 0.491 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.418 -9.964 3 O4'-C1'-N19 120.488 15.86 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' F' F ' 5' ' ' ' DC' . . . . . 0.544 ' H41' ' HA ' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.407 -11.052 5 O4'-C1'-N19 119.642 14.802 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.708 3 O4'-C1'-N19 119.731 14.914 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' F' F ' 7' ' ' ' DA' . . . . . 0.806 H2'' H5'' ' F' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.398 -12.019 5 N19-C1'-C2' 131.947 11.092 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' F' F ' 8' ' ' ' DG' . . . . . 0.806 H5'' H2'' ' F' ' 7' ' ' ' DA' . . . . . . . . 5 C3'--C2' 1.41 -10.784 4 O4'-C1'-N19 119.244 14.305 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' F' F ' 9' ' ' ' DT' . . . . . 0.504 " H4'" ' OP1' ' F' ' 10' ' ' ' DT' . . . . . . . . 6 O3'--C3' 1.572 10.823 4 O4'-C1'-N19 119.284 14.355 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' F' F ' 10' ' ' ' DT' . . . . . 0.504 ' OP1' " H4'" ' F' ' 9' ' ' ' DT' . . . . . . . . 6 O3'--C3' 1.568 10.56 3 O4'-C1'-N19 118.981 13.977 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.411 -10.658 5 O4'-C1'-N19 120.374 15.717 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.416 -10.175 5 O4'-C1'-N19 118.879 13.849 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' F' F ' 13' ' ' ' DC' . . . . . 0.423 " H4'" ' OP1' ' F' ' 14' ' ' ' DT' . . . . . . . . 6 O3'--C3' 1.565 10.346 3 O4'-C1'-N19 120.251 15.564 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' F' F ' 14' ' ' ' DT' . . . . . 0.52 ' C7 ' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.408 -11.045 3 O4'-C1'-N19 118.773 13.717 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' F' F ' 15' ' ' ' DA' . . . . . 0.776 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.417 -10.079 5 O4'-C1'-N19 119.565 14.706 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.413 -10.493 5 O4'-C1'-N19 119.831 15.039 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.492 5 O4'-C1'-N19 119.44 14.551 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.288 5 O4'-C1'-N19 120.306 15.632 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.418 5 O4'-C1'-N19 120.033 15.291 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 O4'--C1' 1.512 7.041 4 O4'-C1'-N19 120.37 15.712 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 . . . . . 0 N--CA 1.514 2.772 0 N-CA-C 110.83 -0.063 . . . . 0.0 110.83 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 57.8 m -109.99 119.28 47.8 Favored Pre-proline 0 N--CA 1.518 2.96 0 CA-C-O 117.683 -1.151 . . . . 0.0 109.025 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -66.15 137.9 49.75 Favored 'Trans proline' 0 C--N 1.396 3.074 0 C-N-CA 122.717 2.278 . . . . 0.0 111.417 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -127.85 126.45 41.64 Favored 'General case' 0 N--CA 1.527 3.382 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 75.5 m -139.9 -51.02 0.5 Allowed 'General case' 0 N--CA 1.521 3.124 0 C-N-CA 122.692 0.397 . . . . 0.0 109.974 -179.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 70.88 115.38 0.05 OUTLIER 'General case' 0 N--CA 1.531 3.584 0 C-N-CA 124.208 1.003 . . . . 0.0 110.32 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -148.79 125.98 11.44 Favored 'General case' 0 N--CA 1.523 3.218 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 43.3 mtp 66.86 130.24 0.02 OUTLIER 'General case' 1 N--CA 1.541 4.124 0 C-N-CA 124.51 1.124 . . . . 0.0 110.033 -178.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.73 155.09 28.12 Favored 'General case' 0 N--CA 1.53 3.543 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -86.16 140.32 30.28 Favored 'General case' 0 N--CA 1.53 3.569 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 59.5 mm-40 -94.6 139.15 31.58 Favored 'General case' 0 N--CA 1.533 3.695 0 C-N-CA 122.881 0.473 . . . . 0.0 111.469 -178.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.7 mmt180 -110.15 -54.1 2.61 Favored 'General case' 0 N--CA 1.525 3.309 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 74.5 m80 -140.74 122.76 15.58 Favored 'General case' 0 N--CA 1.526 3.327 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -111.44 -94.0 0.44 Allowed 'General case' 0 N--CA 1.524 3.229 0 CA-C-O 117.971 -1.014 . . . . 0.0 111.066 -177.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -136.41 -72.89 0.44 Allowed 'General case' 0 N--CA 1.526 3.375 0 CA-C-N 120.271 1.396 . . . . 0.0 108.098 -179.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.683 ' CZ3' HD22 ' B' ' 551' ' ' LEU . 76.7 t-105 -51.35 -39.96 58.14 Favored 'General case' 1 N--CA 1.541 4.085 0 C-N-CA 123.034 0.534 . . . . 0.0 109.664 176.376 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.482 HD22 ' N ' ' A' ' 20' ' ' LEU . 2.6 mm? -81.5 -26.91 34.77 Favored 'General case' 0 N--CA 1.519 2.987 0 O-C-N 124.699 1.249 . . . . 0.0 111.633 -176.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.0 ttm180 -56.27 -29.17 60.75 Favored 'General case' 0 N--CA 1.539 3.982 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 173.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.561 ' CG ' HD21 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -86.03 -36.47 19.71 Favored 'General case' 0 N--CA 1.508 2.441 0 CA-C-O 116.218 -1.849 . . . . 0.0 108.784 173.6 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.5 t -68.73 -26.0 31.89 Favored 'Isoleucine or valine' 1 N--CA 1.571 5.606 0 CA-C-N 121.364 1.893 . . . . 0.0 112.645 -176.332 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -76.1 -50.32 15.0 Favored 'General case' 0 N--CA 1.534 3.737 0 CA-C-N 120.017 1.281 . . . . 0.0 107.588 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.7 mp -70.79 -16.46 62.74 Favored 'General case' 0 N--CA 1.527 3.386 0 O-C-N 123.428 0.455 . . . . 0.0 110.013 175.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -72.16 -36.7 69.37 Favored 'General case' 0 N--CA 1.519 2.997 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 175.762 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.451 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 22.1 tttt -66.02 -20.87 66.33 Favored 'General case' 0 N--CA 1.518 2.939 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.658 176.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -71.75 -40.97 68.99 Favored 'General case' 0 N--CA 1.529 3.485 0 CA-C-N 119.275 0.943 . . . . 0.0 108.722 176.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.604 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -87.89 -8.75 55.36 Favored 'General case' 0 N--CA 1.507 2.382 0 CA-C-O 118.566 -0.73 . . . . 0.0 110.699 177.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.451 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -83.02 -28.51 29.59 Favored 'General case' 0 N--CA 1.532 3.64 0 CA-C-N 120.017 1.28 . . . . 0.0 107.768 177.994 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -64.13 -45.59 87.88 Favored 'General case' 0 N--CA 1.525 3.298 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 176.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -93.31 -89.64 0.2 Allowed 'General case' 0 N--CA 1.513 2.677 0 N-CA-C 106.434 -1.691 . . . . 0.0 106.434 176.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 p30 156.36 51.27 0.0 OUTLIER 'General case' 1 N--CA 1.557 4.918 0 C-N-CA 126.825 2.05 . . . . 0.0 107.877 177.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.574 HD22 ' CD2' ' B' ' 596' ' ' LEU . 8.8 mt -109.88 12.44 23.87 Favored 'General case' 0 N--CA 1.525 3.289 0 C-N-CA 124.388 1.075 . . . . 0.0 110.669 -178.501 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.52 ' HA ' ' HB3' ' A' ' 38' ' ' LEU . 39.2 p-80 -81.86 2.59 29.65 Favored 'General case' 0 N--CA 1.516 2.841 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 174.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.479 HD23 HD12 ' A' ' 39' ' ' LEU . 22.6 mt -95.84 -51.11 0.24 Allowed Pre-proline 0 N--CA 1.508 2.43 0 CA-C-O 117.212 -1.375 . . . . 0.0 109.638 -175.538 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.445 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 4.8 Cg_exo -65.82 -35.23 36.87 Favored 'Trans proline' 0 CA--C 1.574 2.485 0 N-CA-C 105.975 -2.356 . . . . 0.0 105.975 170.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.52 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 1.9 tm? -59.64 -38.34 81.14 Favored 'General case' 0 N--CA 1.521 3.109 0 C-N-CA 124.149 0.98 . . . . 0.0 108.946 175.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.698 HD21 ' CZ2' ' B' ' 519' ' ' TRP . 2.1 mt -59.95 -44.67 94.26 Favored 'General case' 1 N--CA 1.559 5.005 0 CA-C-N 119.236 0.926 . . . . 0.0 108.903 177.108 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -61.71 -17.75 56.95 Favored 'General case' 1 N--CA 1.542 4.148 0 CA-C-O 118.642 -0.694 . . . . 0.0 112.834 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.496 HD11 HG11 ' B' ' 558' ' ' VAL . 0.7 OUTLIER -97.61 -50.52 4.46 Favored 'General case' 0 N--CA 1.525 3.289 0 CA-C-O 118.067 -0.968 . . . . 0.0 113.115 -177.335 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.415 ' N ' HD13 ' A' ' 41' ' ' LEU . 2.9 ptt? -115.36 18.68 15.95 Favored 'General case' 1 N--CA 1.556 4.851 0 CA-C-N 119.829 1.195 . . . . 0.0 113.792 -175.935 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.495 ' O ' HG23 ' A' ' 44' ' ' THR . 4.8 tp -130.44 -80.78 0.54 Allowed 'General case' 0 N--CA 1.52 3.071 0 CA-C-O 117.481 -1.247 . . . . 0.0 110.233 176.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.534 HG23 ' HB2' ' B' ' 998' ' ' TRP . 4.6 p 140.73 156.47 0.0 OUTLIER Pre-proline 1 N--CA 1.57 5.538 0 C-N-CA 127.178 2.191 . . . . 0.0 109.271 179.583 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -67.13 -37.84 17.54 Favored 'Trans proline' 0 N--CA 1.517 2.893 0 C-N-CA 123.167 2.578 . . . . 0.0 110.627 177.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -64.02 -21.98 66.73 Favored 'General case' 0 N--CA 1.532 3.651 0 CA-C-O 118.666 -0.683 . . . . 0.0 110.755 178.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -73.39 -28.97 62.3 Favored 'General case' 0 N--CA 1.52 3.045 0 CA-C-O 117.368 -1.301 . . . . 0.0 110.513 179.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 24.1 ptt180 -83.34 -24.55 32.05 Favored 'General case' 0 N--CA 1.537 3.907 0 CA-C-N 120.175 1.352 . . . . 0.0 107.703 174.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -67.58 -26.41 66.27 Favored 'General case' 1 N--CA 1.542 4.17 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 172.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -92.53 -28.74 16.59 Favored 'General case' 0 N--CA 1.511 2.592 0 C-N-CA 124.809 1.244 . . . . 0.0 111.316 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.457 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 34.8 tp -78.08 -20.05 53.03 Favored 'General case' 0 N--CA 1.537 3.894 0 N-CA-C 105.501 -2.037 . . . . 0.0 105.501 172.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.431 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -69.97 -70.96 1.07 Allowed Glycine 0 C--N 1.374 2.686 0 C-N-CA 125.311 1.434 . . . . 0.0 109.557 177.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.6 m -66.18 -25.35 66.9 Favored 'General case' 0 N--CA 1.531 3.607 0 CA-C-O 117.744 -1.122 . . . . 0.0 112.85 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -70.77 -52.07 23.02 Favored 'General case' 0 N--CA 1.534 3.754 0 CA-C-N 120.063 1.302 . . . . 0.0 108.417 177.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 23.0 t -64.42 -16.19 18.85 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.171 0 O-C-N 120.871 -1.143 . . . . 0.0 109.61 175.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -76.75 -46.46 25.17 Favored 'General case' 0 N--CA 1.523 3.199 0 CA-C-N 120.001 1.273 . . . . 0.0 111.793 178.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.451 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -72.58 -23.26 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.41 0 CA-C-N 120.843 1.656 . . . . 0.0 111.297 -179.216 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -88.69 -52.53 10.94 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.846 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -58.02 -24.67 59.22 Favored 'General case' 1 N--CA 1.54 4.034 0 CA-C-O 118.871 -0.585 . . . . 0.0 110.138 178.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -88.35 -32.25 18.5 Favored 'General case' 0 N--CA 1.519 3.009 0 CA-C-O 118.345 -0.836 . . . . 0.0 109.555 177.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 16.8 tp -64.09 -58.24 7.24 Favored 'General case' 0 N--CA 1.539 4.0 0 CA-C-N 119.3 0.955 . . . . 0.0 110.463 -179.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 33.1 mt -49.17 -26.7 3.0 Favored 'General case' 1 N--CA 1.542 4.132 0 C-N-CA 123.72 0.808 . . . . 0.0 112.891 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 26.9 mmm180 -88.01 -42.32 12.52 Favored 'General case' 0 N--CA 1.527 3.421 0 CA-C-N 118.474 0.579 . . . . 0.0 110.216 -179.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 67.17 88.09 0.07 OUTLIER Glycine 1 N--CA 1.525 4.602 0 CA-C-O 119.134 -0.814 . . . . 0.0 111.703 178.687 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -160.45 -54.24 0.05 Allowed 'General case' 0 N--CA 1.53 3.563 0 CA-C-N 117.714 0.757 . . . . 0.0 110.468 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 9.0 ptt? -142.32 73.76 1.42 Allowed 'General case' 0 N--CA 1.531 3.622 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.434 ' HA ' HD22 ' A' ' 71' ' ' LEU . 18.1 m -133.38 -13.94 2.62 Favored 'General case' 0 N--CA 1.522 3.126 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 -173.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -111.98 -67.82 0.97 Allowed 'General case' 0 N--CA 1.529 3.482 0 CA-C-N 120.179 1.354 . . . . 0.0 112.776 -177.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 11.0 mtt180 -94.94 -47.1 6.57 Favored 'General case' 0 N--CA 1.532 3.642 0 CA-C-N 118.83 0.741 . . . . 0.0 111.097 -177.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -72.95 -12.17 60.85 Favored 'General case' 0 N--CA 1.517 2.906 0 CA-C-O 118.438 -0.792 . . . . 0.0 112.759 -179.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.608 HD23 HG21 ' A' ' 82' ' ' ILE . 26.0 tp -80.21 -54.54 5.65 Favored 'General case' 0 N--CA 1.527 3.401 0 CA-C-O 117.735 -1.126 . . . . 0.0 113.429 -177.287 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -40.11 -48.7 2.53 Favored 'General case' 1 N--CA 1.558 4.94 0 CA-C-N 119.943 1.247 . . . . 0.0 114.162 -177.39 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -68.88 -34.88 76.16 Favored 'General case' 0 N--CA 1.535 3.782 0 CA-C-O 118.967 -0.54 . . . . 0.0 112.154 -177.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -53.12 -52.67 57.94 Favored 'General case' 0 N--CA 1.534 3.753 0 C-N-CA 124.196 0.998 . . . . 0.0 113.023 -178.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.9 pp -121.6 -41.45 2.48 Favored 'General case' 0 N--CA 1.534 3.733 0 CA-C-O 118.895 -0.574 . . . . 0.0 111.326 -178.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 122.25 64.55 0.22 Allowed Glycine 1 N--CA 1.523 4.463 0 N-CA-C 110.81 -0.916 . . . . 0.0 110.81 179.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -133.3 109.6 9.49 Favored 'General case' 0 N--CA 1.518 2.957 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 178.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -45.14 171.61 0.01 OUTLIER Glycine 1 N--CA 1.546 5.983 0 C-N-CA 124.448 1.023 . . . . 0.0 114.388 -177.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.491 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 1.6 mt -82.13 -14.35 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.666 0 CA-C-N 118.69 1.245 . . . . 0.0 108.9 178.468 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.893 ' HB2' ' H62' ' E' ' 15' ' ' ' DA' . . . -70.03 -31.72 69.49 Favored 'General case' 0 N--CA 1.523 3.188 0 CA-C-N 119.821 1.191 . . . . 0.0 110.675 176.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.493 HG21 ' OP2' ' E' ' 14' ' ' ' DT' . 1.3 p -83.51 -42.61 16.67 Favored 'General case' 1 N--CA 1.541 4.115 0 CA-C-N 119.926 1.239 . . . . 0.0 111.636 -179.702 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.608 HG21 HD23 ' A' ' 71' ' ' LEU . 0.7 OUTLIER -70.61 -23.42 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.873 0 CA-C-O 118.043 -0.98 . . . . 0.0 112.587 -178.18 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 70.8 p -105.5 -25.32 12.37 Favored 'General case' 0 N--CA 1.517 2.901 0 CA-C-N 119.605 1.093 . . . . 0.0 111.321 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.9 ptt180 -79.11 -22.51 45.1 Favored 'General case' 0 N--CA 1.535 3.811 0 CA-C-N 120.105 1.321 . . . . 0.0 108.116 174.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.49 -32.29 82.91 Favored Glycine 1 N--CA 1.516 4.005 0 N-CA-C 110.009 -1.237 . . . . 0.0 110.009 176.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 60.2 p -68.07 -32.3 72.54 Favored 'General case' 0 N--CA 1.537 3.91 0 CA-C-N 118.577 1.189 . . . . 0.0 110.031 177.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -60.15 -30.66 69.45 Favored 'General case' 1 N--CA 1.541 4.093 0 C-N-CA 123.726 0.81 . . . . 0.0 111.132 178.224 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.432 ' HB3' ' HA ' ' B' ' 541' ' ' LEU . 18.4 m -61.04 -42.0 97.65 Favored 'General case' 0 N--CA 1.537 3.909 0 C-N-CA 123.813 0.845 . . . . 0.0 111.578 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 22.1 mt -57.54 -39.72 77.24 Favored 'General case' 0 N--CA 1.531 3.585 0 C-N-CA 124.064 0.946 . . . . 0.0 111.42 -179.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 12.1 mmpt? -59.3 -20.82 57.58 Favored 'General case' 1 N--CA 1.542 4.131 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -178.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -95.88 -48.15 5.85 Favored 'General case' 0 N--CA 1.52 3.044 0 CA-C-N 119.083 0.856 . . . . 0.0 111.864 -178.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.35 160.7 0.35 Allowed Pre-proline 1 N--CA 1.553 4.716 0 CA-C-O 118.14 -0.933 . . . . 0.0 113.486 -178.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -79.68 174.62 11.52 Favored 'Trans proline' 0 C--N 1.381 2.286 0 C-N-CA 121.661 1.574 . . . . 0.0 110.444 179.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -98.82 -28.65 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.972 0 CA-C-O 117.484 -1.246 . . . . 0.0 111.779 -178.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -63.64 -40.61 97.31 Favored 'General case' 0 N--CA 1.515 2.804 0 CA-C-N 119.966 1.257 . . . . 0.0 110.468 -178.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.467 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.5 mp -98.13 -18.29 18.58 Favored 'General case' 0 N--CA 1.512 2.641 0 C-N-CA 123.337 0.655 . . . . 0.0 111.517 178.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.53 -29.18 69.21 Favored 'General case' 1 N--CA 1.547 4.397 0 N-CA-C 103.293 -2.854 . . . . 0.0 103.293 169.029 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -57.36 -39.72 76.58 Favored 'General case' 0 N--CA 1.515 2.797 0 C-N-CA 124.29 1.036 . . . . 0.0 110.335 174.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.63 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 53.0 t90 -64.03 -34.98 79.25 Favored 'General case' 0 N--CA 1.533 3.701 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 177.018 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.78 -38.25 60.8 Favored 'General case' 1 N--CA 1.54 4.056 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 176.408 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -68.03 -38.69 82.85 Favored 'General case' 1 N--CA 1.54 4.062 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 175.772 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -61.58 -22.33 65.11 Favored 'General case' 1 N--CA 1.544 4.263 0 C-N-CA 123.45 0.7 . . . . 0.0 110.983 176.6 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.507 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -118.97 6.32 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.543 0 CA-C-N 118.481 0.582 . . . . 0.0 112.192 -177.785 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -108.27 -56.28 2.27 Favored 'General case' 0 N--CA 1.514 2.757 0 N-CA-C 106.028 -1.842 . . . . 0.0 106.028 176.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 35.2 mt -47.11 -53.74 12.13 Favored 'General case' 1 N--CA 1.544 4.248 0 C-N-CA 125.708 1.603 . . . . 0.0 111.712 179.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 47.1 mttp -104.33 55.42 0.72 Allowed 'General case' 0 N--CA 1.516 2.842 0 CA-C-O 122.046 0.927 . . . . 0.0 108.54 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.6 t . . . . . 0 N--CA 1.517 2.9 0 CA-C-O 118.041 -0.98 . . . . 0.0 109.36 179.568 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 . . . . . 0 N--CA 1.502 2.156 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 37.7 p -143.02 136.57 14.21 Favored Pre-proline 0 N--CA 1.528 3.436 0 CA-C-O 117.429 -1.272 . . . . 0.0 110.284 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -76.62 133.69 14.47 Favored 'Trans proline' 0 C--N 1.387 2.585 0 C-N-CA 122.362 2.041 . . . . 0.0 111.16 -179.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -93.18 -48.7 6.33 Favored 'General case' 0 N--CA 1.523 3.22 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 178.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 23.8 m -107.43 -57.53 2.07 Favored 'General case' 0 N--CA 1.514 2.762 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 178.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -170.69 136.51 1.22 Allowed 'General case' 0 N--CA 1.535 3.78 0 C-N-CA 122.999 0.52 . . . . 0.0 111.134 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -141.77 133.08 26.5 Favored 'General case' 0 N--CA 1.525 3.306 0 C-N-CA 122.896 0.478 . . . . 0.0 110.371 179.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 12.1 tpt -92.49 102.95 15.41 Favored 'General case' 0 N--CA 1.521 3.111 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 179.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -165.43 133.75 3.17 Favored 'General case' 0 N--CA 1.529 3.517 0 C-N-CA 122.69 0.396 . . . . 0.0 110.979 -178.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -127.67 108.21 10.56 Favored 'General case' 0 N--CA 1.519 2.992 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 178.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -127.01 -26.8 3.09 Favored 'General case' 0 N--CA 1.53 3.537 0 CA-C-O 118.28 -0.867 . . . . 0.0 112.104 -177.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 55.0 mtt-85 -90.39 176.21 6.8 Favored 'General case' 0 N--CA 1.537 3.884 0 CA-C-N 119.286 0.948 . . . . 0.0 112.277 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 79.6 m80 62.72 122.04 0.01 OUTLIER 'General case' 0 N--CA 1.528 3.461 0 C-N-CA 125.256 1.423 . . . . 0.0 112.134 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -114.0 151.91 31.71 Favored 'General case' 0 N--CA 1.531 3.584 0 C-N-CA 123.684 0.794 . . . . 0.0 110.097 178.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -94.69 -72.53 0.62 Allowed 'General case' 0 N--CA 1.525 3.295 0 CA-C-O 118.947 -0.549 . . . . 0.0 109.749 179.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 519' ' ' TRP . . . . . 0.698 ' CZ2' HD21 ' A' ' 39' ' ' LEU . 64.6 t-105 -40.64 -32.47 0.21 Allowed 'General case' 1 N--CA 1.548 4.449 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -179.297 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 520' ' ' LEU . . . . . 0.534 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.3 mm? -90.12 -31.06 17.26 Favored 'General case' 0 N--CA 1.525 3.298 0 CA-C-O 117.867 -1.063 . . . . 0.0 113.418 -172.601 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 31.6 ttt180 -61.51 -23.09 65.67 Favored 'General case' 1 N--CA 1.544 4.269 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 171.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . 0.546 ' O ' HD23 ' B' ' 526' ' ' LEU . 1.1 m-85 -82.02 -39.36 23.65 Favored 'General case' 0 N--CA 1.513 2.722 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 174.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 41.2 t -64.99 -22.45 31.46 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.228 0 CA-C-O 117.911 -1.042 . . . . 0.0 112.08 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -76.62 -52.8 9.01 Favored 'General case' 0 N--CA 1.534 3.761 0 CA-C-N 120.116 1.326 . . . . 0.0 107.963 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 7.4 mp -66.74 -21.64 66.06 Favored 'General case' 0 N--CA 1.533 3.722 0 CA-C-O 119.401 -0.333 . . . . 0.0 110.273 176.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 526' ' ' LEU . . . . . 0.546 HD23 ' O ' ' B' ' 522' ' ' PHE . 1.8 mm? -70.06 -37.16 75.44 Favored 'General case' 0 N--CA 1.52 3.036 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 176.419 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 10.3 ttmt -66.68 -24.56 66.28 Favored 'General case' 0 N--CA 1.517 2.888 0 CA-C-O 118.153 -0.927 . . . . 0.0 110.695 176.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -69.21 -38.2 78.46 Favored 'General case' 1 N--CA 1.541 4.08 0 CA-C-N 119.544 1.065 . . . . 0.0 109.017 176.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 529' ' ' ALA . . . . . 0.63 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -91.68 -9.02 45.4 Favored 'General case' 0 N--CA 1.499 1.983 0 CA-C-O 118.019 -0.991 . . . . 0.0 111.242 178.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -81.72 -30.79 32.39 Favored 'General case' 0 N--CA 1.53 3.549 0 CA-C-N 120.73 1.605 . . . . 0.0 108.595 179.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -61.53 -42.87 99.45 Favored 'General case' 0 N--CA 1.538 3.928 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 176.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -95.71 -86.72 0.3 Allowed 'General case' 0 N--CA 1.518 2.969 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 177.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.8 p30 151.26 52.87 0.0 OUTLIER 'General case' 1 N--CA 1.558 4.94 0 C-N-CA 127.755 2.422 . . . . 0.0 107.59 177.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 534' ' ' LEU . . . . . 0.467 HD22 ' CD2' ' A' ' 96' ' ' LEU . 6.2 mt -111.11 8.02 21.59 Favored 'General case' 0 N--CA 1.532 3.675 0 C-N-CA 124.161 0.985 . . . . 0.0 111.703 -178.226 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 535' ' ' HIS . . . . . 0.607 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 53.3 p-80 -81.98 -1.82 49.45 Favored 'General case' 0 N--CA 1.513 2.712 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 175.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 536' ' ' LEU . . . . . 0.442 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 46.3 mt -91.87 -50.32 0.31 Allowed Pre-proline 0 N--CA 1.507 2.388 0 CA-C-O 116.346 -1.787 . . . . 0.0 109.092 -176.446 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 537' ' ' PRO . . . . . 0.442 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 3.3 Cg_exo -64.48 -37.13 40.06 Favored 'Trans proline' 0 C--N 1.394 2.959 0 N-CA-C 107.225 -1.875 . . . . 0.0 107.225 171.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 538' ' ' LEU . . . . . 0.4 ' C ' HD13 ' B' ' 538' ' ' LEU . 0.2 OUTLIER -61.94 -41.3 97.8 Favored 'General case' 0 N--CA 1.527 3.394 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 175.39 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 8.1 mt -70.15 -24.11 63.11 Favored 'General case' 0 N--CA 1.536 3.84 0 CA-C-O 118.045 -0.979 . . . . 0.0 111.448 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -78.34 -6.76 56.07 Favored 'General case' 0 N--CA 1.526 3.365 0 CA-C-N 119.405 1.002 . . . . 0.0 110.645 178.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 541' ' ' LEU . . . . . 0.608 HD13 ' N ' ' B' ' 542' ' ' MET . 0.0 OUTLIER -106.67 -43.22 4.77 Favored 'General case' 0 N--CA 1.513 2.718 0 C-N-CA 124.159 0.984 . . . . 0.0 109.212 -179.587 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 542' ' ' MET . . . . . 0.608 ' N ' HD13 ' B' ' 541' ' ' LEU . 7.8 ptt? -94.84 -3.44 48.89 Favored 'General case' 0 N--CA 1.53 3.571 0 CA-C-O 117.78 -1.105 . . . . 0.0 112.728 -179.286 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.67 -108.17 0.3 Allowed 'General case' 0 N--CA 1.526 3.34 0 CA-C-N 120.386 1.448 . . . . 0.0 112.236 -177.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 3.9 t 157.07 140.2 0.0 OUTLIER Pre-proline 1 N--CA 1.567 5.406 0 C-N-CA 126.654 1.982 . . . . 0.0 108.332 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -52.27 -29.57 38.79 Favored 'Trans proline' 0 N--CA 1.524 3.276 0 C-N-CA 123.818 3.012 . . . . 0.0 115.891 -176.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -58.85 -31.48 68.56 Favored 'General case' 1 N--CA 1.545 4.285 0 CA-C-N 118.898 0.772 . . . . 0.0 112.514 -177.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.72 -31.28 63.3 Favored 'General case' 0 N--CA 1.524 3.239 0 CA-C-O 117.947 -1.025 . . . . 0.0 110.782 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -79.57 -20.18 47.62 Favored 'General case' 0 N--CA 1.527 3.41 0 CA-C-N 119.574 1.079 . . . . 0.0 110.633 177.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -70.07 -47.44 61.9 Favored 'General case' 0 N--CA 1.534 3.768 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 174.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -77.5 -11.67 59.88 Favored 'General case' 0 N--CA 1.512 2.664 0 CA-C-O 117.295 -1.335 . . . . 0.0 111.288 176.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 551' ' ' LEU . . . . . 0.683 HD22 ' CZ3' ' A' ' 19' ' ' TRP . 13.3 tp -81.5 -33.95 31.58 Favored 'General case' 0 N--CA 1.527 3.4 0 CA-C-N 120.722 1.601 . . . . 0.0 107.486 175.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -68.47 -52.45 26.1 Favored Glycine 0 N--CA 1.509 3.518 0 N-CA-C 108.732 -1.747 . . . . 0.0 108.732 178.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 2.9 m -67.34 -30.61 70.48 Favored 'General case' 0 N--CA 1.532 3.628 0 CA-C-O 118.205 -0.902 . . . . 0.0 111.891 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 11.5 mtm180 -67.49 -46.74 72.06 Favored 'General case' 1 N--CA 1.545 4.32 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 176.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 555' ' ' VAL . . . . . 0.411 HG23 ' O ' ' B' ' 551' ' ' LEU . 19.6 t -69.81 -15.64 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.681 0 CA-C-O 118.158 -0.925 . . . . 0.0 109.5 176.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 6.8 mtm-85 -80.04 -40.82 26.94 Favored 'General case' 0 N--CA 1.523 3.217 0 CA-C-O 117.583 -1.199 . . . . 0.0 111.202 178.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 557' ' ' ILE . . . . . 0.459 ' HB ' HG22 ' B' ' 582' ' ' ILE . 0.0 OUTLIER -74.36 -25.1 19.27 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.557 0 CA-C-N 121.115 1.78 . . . . 0.0 110.236 -179.547 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 558' ' ' VAL . . . . . 0.496 HG11 HD11 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -85.56 -50.92 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.928 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 179.74 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -58.8 -26.6 64.24 Favored 'General case' 0 N--CA 1.537 3.879 0 CA-C-O 118.985 -0.531 . . . . 0.0 110.377 178.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -95.03 -21.87 18.29 Favored 'General case' 0 N--CA 1.525 3.31 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.854 178.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 27.7 tp -71.44 -47.36 56.35 Favored 'General case' 0 N--CA 1.537 3.914 0 CA-C-N 119.751 1.16 . . . . 0.0 108.617 178.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 51.7 mt -59.26 -18.5 37.94 Favored 'General case' 0 N--CA 1.536 3.839 0 CA-C-O 118.143 -0.932 . . . . 0.0 113.157 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -94.21 -46.53 7.04 Favored 'General case' 0 N--CA 1.526 3.369 0 CA-C-N 119.359 0.982 . . . . 0.0 108.971 179.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 68.42 66.75 2.19 Favored Glycine 1 N--CA 1.52 4.262 0 CA-C-O 119.374 -0.681 . . . . 0.0 112.364 178.583 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -118.31 -59.56 1.88 Allowed 'General case' 0 N--CA 1.525 3.316 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 178.177 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 75.1 mtm -152.65 80.64 1.22 Allowed 'General case' 0 N--CA 1.522 3.138 0 N-CA-C 105.25 -2.13 . . . . 0.0 105.25 178.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 567' ' ' SER . . . . . 0.425 ' HA ' ' HB2' ' B' ' 571' ' ' LEU . 50.0 m -131.63 -9.0 3.62 Favored 'General case' 0 N--CA 1.524 3.248 0 N-CA-C 114.049 1.129 . . . . 0.0 114.049 -173.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -117.27 -56.15 2.26 Favored 'General case' 0 N--CA 1.526 3.325 0 CA-C-N 119.852 1.205 . . . . 0.0 110.989 -179.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -89.74 -62.8 1.39 Allowed 'General case' 0 N--CA 1.526 3.375 0 C-N-CA 122.661 0.385 . . . . 0.0 111.538 -178.071 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -80.59 -0.45 37.93 Favored 'General case' 0 N--CA 1.521 3.076 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -176.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 571' ' ' LEU . . . . . 0.601 HD23 HG21 ' B' ' 582' ' ' ILE . 21.4 tp -78.84 -45.81 20.01 Favored 'General case' 0 N--CA 1.526 3.337 0 CA-C-N 120.207 1.367 . . . . 0.0 110.398 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -45.81 -28.75 1.14 Allowed 'General case' 0 N--CA 1.534 3.771 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 -177.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -73.25 -41.33 63.82 Favored 'General case' 0 N--CA 1.532 3.666 0 CA-C-N 118.283 0.492 . . . . 0.0 111.358 -178.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -47.29 -51.58 18.73 Favored 'General case' 0 N--CA 1.536 3.836 0 C-N-CA 124.591 1.157 . . . . 0.0 113.672 -178.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -130.07 -39.75 1.36 Allowed 'General case' 0 N--CA 1.535 3.811 0 CA-C-O 118.662 -0.685 . . . . 0.0 111.857 -179.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 107.31 76.02 0.96 Allowed Glycine 1 N--CA 1.52 4.262 0 N-CA-C 110.331 -1.107 . . . . 0.0 110.331 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -114.23 -1.88 13.51 Favored 'General case' 0 N--CA 1.526 3.374 0 C-N-CA 123.463 0.705 . . . . 0.0 111.47 178.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 578' ' ' GLY . . . . . 0.4 ' HA3' " H2'" ' F' ' 14' ' ' ' DT' . . . 72.49 169.24 12.95 Favored Glycine 1 N--CA 1.52 4.272 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -178.859 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 579' ' ' ILE . . . . . 0.488 HG21 ' N6 ' ' E' ' 4' ' ' ' DA' . 1.0 OUTLIER -90.4 -13.18 9.31 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.812 0 CA-C-N 118.554 1.177 . . . . 0.0 108.966 177.937 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 580' ' ' ALA . . . . . 0.776 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -64.98 -37.65 88.35 Favored 'General case' 0 N--CA 1.526 3.346 0 CA-C-N 120.154 1.343 . . . . 0.0 111.583 178.618 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 2.8 p -82.97 -41.98 18.13 Favored 'General case' 1 N--CA 1.542 4.145 0 CA-C-N 120.1 1.318 . . . . 0.0 111.839 -179.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 582' ' ' ILE . . . . . 0.601 HG21 HD23 ' B' ' 571' ' ' LEU . 17.2 pt -70.25 -18.11 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.959 0 CA-C-O 117.685 -1.15 . . . . 0.0 113.385 -177.371 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 80.0 p -112.76 -27.49 8.13 Favored 'General case' 0 N--CA 1.514 2.774 0 CA-C-N 119.962 1.255 . . . . 0.0 111.038 177.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -75.57 -20.31 58.71 Favored 'General case' 0 N--CA 1.535 3.775 0 CA-C-N 120.049 1.295 . . . . 0.0 108.491 174.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -65.12 -36.59 93.12 Favored Glycine 1 N--CA 1.517 4.037 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 176.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 68.4 p -64.95 -33.85 77.02 Favored 'General case' 1 N--CA 1.541 4.119 0 CA-C-N 118.399 1.099 . . . . 0.0 110.325 177.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -56.52 -35.06 67.62 Favored 'General case' 1 N--CA 1.545 4.289 0 C-N-CA 123.819 0.848 . . . . 0.0 111.134 178.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 28.5 m -57.55 -42.84 83.79 Favored 'General case' 1 N--CA 1.541 4.096 0 C-N-CA 123.651 0.78 . . . . 0.0 111.153 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 19.8 mt -56.46 -44.82 80.9 Favored 'General case' 0 N--CA 1.528 3.447 0 C-N-CA 124.03 0.932 . . . . 0.0 111.63 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 20.9 mmmt -57.46 -26.47 61.27 Favored 'General case' 1 N--CA 1.544 4.229 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -86.86 -39.98 15.33 Favored 'General case' 0 N--CA 1.515 2.801 0 CA-C-N 118.493 0.588 . . . . 0.0 110.728 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.6 162.3 28.42 Favored Pre-proline 1 N--CA 1.542 4.136 0 CA-C-O 118.346 -0.835 . . . . 0.0 111.974 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -84.98 172.07 8.92 Favored 'Trans proline' 0 C--N 1.377 2.068 0 C-N-CA 122.045 1.83 . . . . 0.0 111.309 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 3.2 t -92.31 -24.64 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.118 0 CA-C-O 117.818 -1.087 . . . . 0.0 111.497 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -62.9 -40.66 98.24 Favored 'General case' 0 N--CA 1.516 2.866 0 CA-C-N 120.004 1.275 . . . . 0.0 110.437 -179.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 596' ' ' LEU . . . . . 0.574 ' CD2' HD22 ' A' ' 34' ' ' LEU . 7.1 mp -102.14 -12.54 17.99 Favored 'General case' 0 N--CA 1.511 2.59 0 C-N-CA 123.388 0.675 . . . . 0.0 112.188 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -31.46 71.46 Favored 'General case' 1 N--CA 1.544 4.241 0 N-CA-C 102.572 -3.122 . . . . 0.0 102.572 167.055 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.47 -38.29 68.91 Favored 'General case' 0 N--CA 1.52 3.054 0 C-N-CA 124.937 1.295 . . . . 0.0 110.289 174.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 599' ' ' TRP . . . . . 0.604 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 53.2 t90 -64.72 -35.84 82.37 Favored 'General case' 0 N--CA 1.538 3.946 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 176.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.37 -37.44 62.41 Favored 'General case' 0 N--CA 1.535 3.822 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 176.282 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -68.91 -37.53 79.02 Favored 'General case' 1 N--CA 1.544 4.248 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 175.273 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 602' ' ' GLU . . . . . 0.409 ' HB2' ' HA ' ' B' ' 599' ' ' TRP . 3.1 mm-40 -60.88 -21.75 63.6 Favored 'General case' 1 N--CA 1.543 4.192 0 C-N-CA 123.362 0.665 . . . . 0.0 110.494 175.867 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 603' ' ' VAL . . . . . 0.546 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.2 OUTLIER -123.9 6.99 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.536 0 C-N-CA 123.269 0.628 . . . . 0.0 112.439 -177.618 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -111.11 -59.43 1.97 Allowed 'General case' 0 N--CA 1.514 2.74 0 N-CA-C 105.385 -2.08 . . . . 0.0 105.385 176.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 12.6 tp -48.99 -31.57 7.7 Favored 'General case' 0 N--CA 1.537 3.917 0 C-N-CA 125.085 1.354 . . . . 0.0 111.546 177.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -82.75 -63.68 1.32 Allowed 'General case' 0 N--CA 1.52 3.038 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 -179.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 41.3 p . . . . . 0 N--CA 1.527 3.388 0 CA-C-O 118.568 -0.73 . . . . 0.0 110.249 -179.281 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.153 0 CA-C-O 118.286 -0.864 . . . . 0.0 108.718 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 998' ' ' TRP . . . . . 0.534 ' HB2' HG23 ' A' ' 44' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.106 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.425 -9.258 3 O4'-C1'-N19 119.513 14.641 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear nobuild full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.411 -10.709 5 O4'-C1'-N19 120.418 15.772 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear nobuild full ' E' E ' 3' ' ' ' DT' . . . . . 0.429 " H1'" ' C8 ' ' E' ' 4' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.416 -10.241 3 O4'-C1'-N19 120.228 15.535 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . 0.553 ' N6 ' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 4 C3'--C2' 1.42 -9.775 4 O4'-C1'-N19 120.422 15.778 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' E' E ' 5' ' ' ' DC' . . . . . 0.561 ' H41' ' HA ' ' B' ' 580' ' ' ALA . . . . . . . . 6 O3'--C3' 1.575 11.081 5 O4'-C1'-N19 118.612 13.515 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.404 -11.351 5 O4'-C1'-N19 120.328 15.66 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear nobuild full ' E' E ' 7' ' ' ' DA' . . . . . 0.615 H2'' " C5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.399 -11.923 3 C4'-C3'-C2' 113.495 10.295 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' E' E ' 8' ' ' ' DG' . . . . . 0.615 " C5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 O3'--C3' 1.575 11.109 4 O4'-C1'-N19 119.784 14.98 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.576 11.185 5 O4'-C1'-N19 118.848 13.811 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear nobuild full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.411 -10.695 3 O4'-C1'-N19 118.966 13.958 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.412 -10.593 5 O4'-C1'-N19 119.614 14.768 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear nobuild full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.311 2 O4'-C1'-N19 119.406 14.507 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear nobuild full ' E' E ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.41 -10.782 5 O4'-C1'-N19 118.942 13.928 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear nobuild full ' E' E ' 14' ' ' ' DT' . . . . . 0.941 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.413 -10.503 5 O4'-C1'-N19 118.73 13.662 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' E' E ' 15' ' ' ' DA' . . . . . 0.913 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.433 -8.523 4 O4'-C1'-N19 119.35 14.437 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.417 -10.064 4 O4'-C1'-N19 119.961 15.201 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear nobuild full ' E' E ' 17' ' ' ' DT' . . . . . 0.408 H2'' H5'' ' E' ' 18' ' ' ' DA' . . . . . . . . 6 O3'--C3' 1.573 10.959 3 O4'-C1'-N19 120.19 15.487 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' E' E ' 18' ' ' ' DA' . . . . . 0.408 H5'' H2'' ' E' ' 17' ' ' ' DT' . . . . . . . . 6 C3'--C2' 1.412 -10.608 5 O4'-C1'-N19 119.905 15.131 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.419 -9.945 5 O4'-C1'-N19 119.558 14.698 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear nobuild full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.51 6.944 4 O4'-C1'-N19 120.051 15.313 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear nobuild full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.412 -10.556 3 O4'-C1'-N19 118.939 13.923 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear nobuild full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.415 -10.312 3 O4'-C1'-N19 118.865 13.831 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear nobuild full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.406 -11.177 5 O4'-C1'-N19 120.12 15.399 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear nobuild full ' F' F ' 4' ' ' ' DA' . . . . . 0.541 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 6 C3'--C2' 1.419 -9.92 4 O4'-C1'-N19 119.548 14.685 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' F' F ' 5' ' ' ' DC' . . . . . 0.421 ' H41' ' HA ' ' A' ' 80' ' ' ALA . . . . . . . . 6 O3'--C3' 1.574 11.007 4 C4'-C3'-C2' 116.069 12.869 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.41 -10.81 4 O4'-C1'-N19 118.815 13.769 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear nobuild full ' F' F ' 7' ' ' ' DA' . . . . . 0.838 H2'' H5'' ' F' ' 8' ' ' ' DG' . . . . . . . . 4 C3'--C2' 1.382 -13.637 5 N19-C1'-C2' 129.539 9.587 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' F' F ' 8' ' ' ' DG' . . . . . 0.838 H5'' H2'' ' F' ' 7' ' ' ' DA' . . . . . . . . 6 C3'--C2' 1.41 -10.767 4 O4'-C1'-N19 118.116 12.895 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' F' F ' 9' ' ' ' DT' . . . . . 0.428 H2'' H5'' ' F' ' 10' ' ' ' DT' . . . . . . . . 6 C3'--C2' 1.411 -10.744 3 O4'-C1'-N19 119.821 15.026 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' F' F ' 10' ' ' ' DT' . . . . . 0.428 H5'' H2'' ' F' ' 9' ' ' ' DT' . . . . . . . . 6 C3'--C2' 1.413 -10.459 3 O4'-C1'-N19 119.094 14.117 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.407 -11.119 3 O4'-C1'-N19 120.192 15.489 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear nobuild full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.435 4 O4'-C1'-N19 119.026 14.032 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear nobuild full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.574 11.033 5 O4'-C1'-N19 119.54 14.675 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear nobuild full ' F' F ' 14' ' ' ' DT' . . . . . 0.663 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.413 -10.478 3 O4'-C1'-N19 118.931 13.913 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' F' F ' 15' ' ' ' DA' . . . . . 0.877 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 6 C3'--C2' 1.425 -9.255 5 O4'-C1'-N19 119.808 15.01 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' F' F ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.286 5 O4'-C1'-N19 119.619 14.774 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear nobuild full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.421 -9.678 3 O4'-C1'-N19 119.443 14.554 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear nobuild full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.418 -9.952 4 O4'-C1'-N19 119.83 15.038 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -11.013 4 O4'-C1'-N19 120.252 15.565 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear nobuild full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.513 7.119 5 O4'-C1'-N19 119.895 15.119 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 17.0 tt0 . . . . . 0 N--CA 1.501 2.099 0 CA-C-O 119.139 -0.458 . . . . 0.0 110.083 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.5 t -155.65 135.3 8.11 Favored Pre-proline 0 N--CA 1.524 3.252 0 CA-C-O 117.353 -1.308 . . . . 0.0 111.143 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -76.04 156.76 38.51 Favored 'Trans proline' 0 C--N 1.386 2.54 0 C-N-CA 122.685 2.257 . . . . 0.0 110.816 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -122.76 -56.74 1.76 Allowed 'General case' 0 N--CA 1.525 3.321 0 CA-C-O 118.96 -0.543 . . . . 0.0 110.405 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 59.8 p -146.77 151.35 37.01 Favored 'General case' 0 N--CA 1.528 3.431 0 N-CA-C 113.045 0.758 . . . . 0.0 113.045 -177.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -105.18 -49.22 3.51 Favored 'General case' 0 N--CA 1.515 2.82 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 60.73 157.58 0.04 OUTLIER 'General case' 0 N--CA 1.537 3.893 0 C-N-CA 124.381 1.072 . . . . 0.0 112.923 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.5 ttt -117.64 -56.76 2.18 Favored 'General case' 0 N--CA 1.514 2.746 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -158.22 125.34 4.97 Favored 'General case' 0 N--CA 1.52 3.03 0 O-C-N 123.037 0.211 . . . . 0.0 110.996 179.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -127.48 -51.89 1.38 Allowed 'General case' 0 N--CA 1.521 3.111 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 179.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 65.52 106.13 0.04 OUTLIER 'General case' 0 N--CA 1.526 3.374 0 C-N-CA 124.674 1.189 . . . . 0.0 111.926 178.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -120.89 -36.12 3.21 Favored 'General case' 0 N--CA 1.527 3.411 0 C-N-CA 123.788 0.835 . . . . 0.0 109.732 178.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 69.36 119.66 0.03 OUTLIER 'General case' 0 N--CA 1.531 3.609 0 C-N-CA 125.283 1.433 . . . . 0.0 111.414 178.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -113.65 102.62 10.44 Favored 'General case' 0 N--CA 1.516 2.837 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -125.36 -73.1 0.64 Allowed 'General case' 0 N--CA 1.516 2.832 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.82 ' CE3' HD22 ' B' ' 551' ' ' LEU . 66.6 t-105 -53.42 -39.46 64.36 Favored 'General case' 0 N--CA 1.536 3.85 0 C-N-CA 123.042 0.537 . . . . 0.0 109.64 175.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.45 HD22 ' N ' ' A' ' 20' ' ' LEU . 2.5 mm? -79.93 -27.29 39.86 Favored 'General case' 0 N--CA 1.517 2.898 0 CA-C-O 117.372 -1.299 . . . . 0.0 112.259 -175.557 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.8 mtt-85 -57.6 -31.72 66.49 Favored 'General case' 1 N--CA 1.547 4.406 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 172.126 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.58 ' CG ' HD21 ' B' ' 551' ' ' LEU . 0.0 OUTLIER -80.78 -36.81 31.31 Favored 'General case' 0 N--CA 1.504 2.247 0 CA-C-O 116.22 -1.847 . . . . 0.0 109.668 174.615 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.7 t -69.98 -22.83 24.87 Favored 'Isoleucine or valine' 1 N--CA 1.565 5.289 0 CA-C-N 121.373 1.897 . . . . 0.0 112.498 -176.147 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -78.21 -48.56 15.56 Favored 'General case' 0 N--CA 1.535 3.781 0 CA-C-N 120.418 1.463 . . . . 0.0 107.496 178.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.2 mp -70.38 -17.9 63.04 Favored 'General case' 0 N--CA 1.535 3.818 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 175.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.429 HD23 ' CE2' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -72.53 -38.56 67.99 Favored 'General case' 0 N--CA 1.517 2.907 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 176.793 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.51 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 32.6 tttt -66.61 -16.94 64.55 Favored 'General case' 0 N--CA 1.514 2.727 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.025 176.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -74.14 -40.08 62.86 Favored 'General case' 0 N--CA 1.528 3.457 0 N-CA-C 108.32 -0.992 . . . . 0.0 108.32 175.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.611 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -89.92 -4.5 57.48 Favored 'General case' 0 N--CA 1.505 2.321 0 CA-C-O 118.701 -0.666 . . . . 0.0 110.434 177.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.51 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -87.55 -33.98 18.73 Favored 'General case' 0 N--CA 1.529 3.518 0 CA-C-N 120.364 1.438 . . . . 0.0 108.381 179.34 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -61.64 -41.82 98.03 Favored 'General case' 0 N--CA 1.537 3.907 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -92.55 -85.38 0.26 Allowed 'General case' 0 N--CA 1.511 2.612 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 177.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p30 150.47 46.84 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.071 0 C-N-CA 127.673 2.389 . . . . 0.0 108.56 177.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.474 HD22 ' CD2' ' B' ' 596' ' ' LEU . 7.8 mt -106.02 16.19 25.41 Favored 'General case' 0 N--CA 1.522 3.171 0 C-N-CA 124.557 1.143 . . . . 0.0 110.365 -178.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.562 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 42.7 p-80 -82.65 4.2 25.82 Favored 'General case' 0 N--CA 1.514 2.735 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 175.27 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.446 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 17.5 mt -92.67 -50.45 0.28 Allowed Pre-proline 0 N--CA 1.509 2.49 0 C-N-CA 125.462 1.505 . . . . 0.0 108.665 -176.116 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.446 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 9.5 Cg_exo -62.51 -35.96 68.14 Favored 'Trans proline' 0 C--N 1.391 2.811 0 N-CA-C 105.945 -2.367 . . . . 0.0 105.945 168.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.1 tt -53.7 -44.24 69.63 Favored 'General case' 0 N--CA 1.534 3.725 0 C-N-CA 124.085 0.954 . . . . 0.0 108.998 174.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.748 HD11 ' CE2' ' B' ' 519' ' ' TRP . 0.5 OUTLIER -60.73 -40.91 94.14 Favored 'General case' 1 N--CA 1.557 4.898 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 177.834 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -63.59 -12.97 37.44 Favored 'General case' 0 N--CA 1.535 3.807 0 CA-C-O 118.123 -0.942 . . . . 0.0 113.036 -179.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -110.92 -41.78 4.16 Favored 'General case' 0 N--CA 1.531 3.579 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 -177.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 4.0 ptp -128.72 13.27 6.39 Favored 'General case' 1 N--CA 1.55 4.571 0 CA-C-N 119.848 1.204 . . . . 0.0 113.436 -175.359 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -113.2 -72.65 0.7 Allowed 'General case' 0 N--CA 1.496 1.856 0 CA-C-N 118.99 0.814 . . . . 0.0 108.946 179.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 14.2 p 126.52 156.98 0.0 OUTLIER Pre-proline 1 N--CA 1.549 4.507 0 C-N-CA 128.629 2.772 . . . . 0.0 107.343 -178.02 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -70.03 -35.74 11.32 Favored 'Trans proline' 0 CA--C 1.571 2.366 0 C-N-CA 122.345 2.03 . . . . 0.0 107.572 174.189 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -65.31 -21.11 66.67 Favored 'General case' 0 N--CA 1.529 3.503 0 CA-C-O 118.175 -0.916 . . . . 0.0 110.296 175.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -75.03 -28.76 60.57 Favored 'General case' 0 N--CA 1.52 3.027 0 CA-C-O 117.283 -1.341 . . . . 0.0 110.137 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.8 ptt180 -87.21 -19.84 27.81 Favored 'General case' 0 N--CA 1.539 3.991 0 CA-C-N 120.406 1.457 . . . . 0.0 107.745 172.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -72.96 -24.09 60.74 Favored 'General case' 0 N--CA 1.525 3.302 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 172.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.438 ' O ' ' HB2' ' A' ' 54' ' ' ARG . . . -87.1 -42.95 12.65 Favored 'General case' 0 N--CA 1.501 2.1 0 CA-C-O 117.982 -1.009 . . . . 0.0 108.71 179.527 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.47 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 24.0 tp -68.24 -20.21 64.79 Favored 'General case' 1 N--CA 1.544 4.252 0 CA-C-N 120.753 1.615 . . . . 0.0 107.747 173.855 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.456 ' HA2' ' CZ ' ' B' ' 522' ' ' PHE . . . -68.21 -69.27 1.42 Allowed Glycine 0 N--CA 1.5 2.966 0 C-N-CA 125.493 1.52 . . . . 0.0 111.17 177.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.7 m -75.44 -27.53 58.96 Favored 'General case' 0 N--CA 1.53 3.563 0 CA-C-O 117.838 -1.077 . . . . 0.0 112.442 -177.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -68.03 -49.4 61.72 Favored 'General case' 0 N--CA 1.531 3.62 0 CA-C-N 120.185 1.357 . . . . 0.0 107.705 177.514 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.3 t -65.67 -18.59 24.19 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.1 0 CA-C-O 117.929 -1.034 . . . . 0.0 109.776 176.258 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -71.84 -51.58 21.7 Favored 'General case' 0 N--CA 1.527 3.38 0 CA-C-N 120.012 1.278 . . . . 0.0 111.558 178.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -23.66 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.428 0 CA-C-N 120.789 1.631 . . . . 0.0 111.863 -178.049 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.423 ' CG1' HD22 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -86.13 -52.72 11.63 Favored 'Isoleucine or valine' 1 N--CA 1.548 4.454 0 CA-C-N 120.772 1.624 . . . . 0.0 107.308 -179.758 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -59.6 -24.06 63.47 Favored 'General case' 0 N--CA 1.532 3.634 0 CA-C-O 118.579 -0.724 . . . . 0.0 110.453 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -94.36 -24.18 17.49 Favored 'General case' 0 N--CA 1.524 3.23 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.5 177.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.423 HD22 ' OG ' ' A' ' 86' ' ' SER . 7.0 mt -72.2 -59.85 2.53 Favored 'General case' 0 N--CA 1.536 3.848 0 CA-C-N 119.521 1.055 . . . . 0.0 110.041 -179.622 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 46.3 mt -50.56 -29.29 10.39 Favored 'General case' 1 N--CA 1.545 4.308 0 C-N-CA 123.443 0.697 . . . . 0.0 112.732 -179.15 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -79.91 -47.78 14.51 Favored 'General case' 0 N--CA 1.528 3.446 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 71.67 86.99 0.15 Allowed Glycine 1 N--CA 1.519 4.169 0 CA-C-O 119.368 -0.684 . . . . 0.0 112.096 178.156 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -151.39 -54.71 0.14 Allowed 'General case' 0 N--CA 1.53 3.562 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 4.3 ttt -147.2 71.75 1.23 Allowed 'General case' 0 N--CA 1.52 3.045 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 178.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.523 ' HA ' HD22 ' A' ' 71' ' ' LEU . 97.2 p -142.86 7.41 1.64 Allowed 'General case' 0 N--CA 1.52 3.066 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -175.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -122.53 -62.31 1.38 Allowed 'General case' 0 N--CA 1.529 3.488 0 CA-C-N 119.672 1.124 . . . . 0.0 111.992 -178.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -110.28 -48.79 3.13 Favored 'General case' 0 N--CA 1.524 3.236 0 C-N-CA 123.547 0.739 . . . . 0.0 109.908 -177.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -78.47 4.6 12.77 Favored 'General case' 0 N--CA 1.513 2.71 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -177.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.681 HD23 HG21 ' A' ' 82' ' ' ILE . 44.0 tp -89.13 -46.54 8.74 Favored 'General case' 0 N--CA 1.53 3.567 0 CA-C-N 120.285 1.402 . . . . 0.0 113.233 -178.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -41.7 -42.59 2.6 Favored 'General case' 1 N--CA 1.544 4.228 0 N-CA-C 116.169 1.914 . . . . 0.0 116.169 -173.906 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -64.1 -21.52 66.57 Favored 'General case' 1 N--CA 1.545 4.306 0 CA-C-N 119.071 0.85 . . . . 0.0 113.117 -177.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -57.65 -59.77 4.69 Favored 'General case' 0 N--CA 1.529 3.476 0 C-N-CA 124.579 1.152 . . . . 0.0 112.587 -178.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.427 HD23 ' N ' ' A' ' 75' ' ' LEU . 1.3 pt? -130.78 -42.0 1.15 Allowed 'General case' 0 N--CA 1.526 3.369 0 CA-C-O 118.857 -0.592 . . . . 0.0 111.21 -179.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 120.34 78.26 0.53 Allowed Glycine 0 N--CA 1.514 3.897 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 179.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -104.53 -39.76 6.29 Favored 'General case' 0 N--CA 1.524 3.257 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 177.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.34 162.24 23.52 Favored Glycine 1 N--CA 1.524 4.547 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 -179.007 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.541 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 1.5 mt -84.7 -13.82 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.813 0 CA-C-N 119.721 1.761 . . . . 0.0 108.346 178.111 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.941 ' HB3' ' H72' ' E' ' 14' ' ' ' DT' . . . -70.75 -40.31 72.77 Favored 'General case' 0 N--CA 1.517 2.878 0 CA-C-O 117.656 -1.164 . . . . 0.0 110.294 177.09 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.536 HG21 ' OP2' ' E' ' 14' ' ' ' DT' . 4.6 p -79.52 -42.37 25.32 Favored 'General case' 0 N--CA 1.538 3.961 0 CA-C-N 119.838 1.199 . . . . 0.0 112.807 -178.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.681 HG21 HD23 ' A' ' 71' ' ' LEU . 20.5 pt -70.88 -16.49 19.62 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.022 0 CA-C-O 117.853 -1.07 . . . . 0.0 113.749 -176.552 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 80.4 p -113.01 -32.75 6.26 Favored 'General case' 0 N--CA 1.514 2.773 0 CA-C-N 119.795 1.18 . . . . 0.0 110.216 178.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.5 ptt180 -71.91 -20.22 61.81 Favored 'General case' 0 N--CA 1.533 3.68 0 CA-C-N 119.56 1.073 . . . . 0.0 109.005 175.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -64.78 -38.18 95.26 Favored Glycine 1 N--CA 1.52 4.263 0 N-CA-C 108.529 -1.829 . . . . 0.0 108.529 175.43 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.423 ' OG ' HD22 ' A' ' 61' ' ' LEU . 50.3 m -65.09 -28.13 69.24 Favored 'General case' 1 N--CA 1.54 4.042 0 CA-C-N 117.747 0.773 . . . . 0.0 110.708 176.678 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -60.64 -31.62 70.82 Favored 'General case' 1 N--CA 1.54 4.046 0 CA-C-N 118.542 0.61 . . . . 0.0 111.228 179.218 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 2.6 m -65.59 -35.29 80.38 Favored 'General case' 0 N--CA 1.537 3.89 0 C-N-CA 123.471 0.708 . . . . 0.0 111.219 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 23.8 mt -56.33 -40.11 73.9 Favored 'General case' 0 N--CA 1.534 3.759 0 C-N-CA 124.165 0.986 . . . . 0.0 111.882 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -20.73 18.95 Favored 'General case' 1 N--CA 1.54 4.042 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 -178.756 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -106.56 -30.76 8.84 Favored 'General case' 0 N--CA 1.517 2.913 0 CA-C-N 119.301 0.955 . . . . 0.0 112.511 -179.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -49.88 160.37 0.64 Allowed Pre-proline 1 N--CA 1.55 4.531 0 CA-C-N 119.285 0.948 . . . . 0.0 113.508 -178.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -85.29 151.12 10.6 Favored 'Trans proline' 0 C--N 1.379 2.166 0 C-N-CA 122.497 2.131 . . . . 0.0 110.511 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.8 t -84.08 -25.83 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.217 0 CA-C-O 117.694 -1.146 . . . . 0.0 111.858 -179.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -63.27 -40.6 97.85 Favored 'General case' 0 N--CA 1.52 3.029 0 CA-C-N 120.346 1.43 . . . . 0.0 109.85 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.486 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.0 mp -97.87 -13.97 20.97 Favored 'General case' 0 N--CA 1.51 2.542 0 C-N-CA 123.818 0.847 . . . . 0.0 111.344 178.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.07 -36.65 84.7 Favored 'General case' 1 N--CA 1.544 4.237 0 N-CA-C 102.809 -3.034 . . . . 0.0 102.809 168.005 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -52.78 -38.27 60.87 Favored 'General case' 0 N--CA 1.517 2.886 0 C-N-CA 124.585 1.154 . . . . 0.0 111.621 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.661 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 50.6 t90 -63.0 -37.1 85.81 Favored 'General case' 0 N--CA 1.532 3.64 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 10.0 mp -55.31 -35.33 65.0 Favored 'General case' 1 N--CA 1.543 4.197 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 176.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -70.5 -35.95 73.51 Favored 'General case' 0 N--CA 1.536 3.853 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 175.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.411 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 3.0 mm-40 -62.2 -23.78 66.84 Favored 'General case' 1 N--CA 1.542 4.164 0 C-N-CA 123.739 0.816 . . . . 0.0 110.087 175.285 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.54 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -120.96 12.82 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.556 0 C-N-CA 123.673 0.789 . . . . 0.0 111.851 -178.052 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 43.4 mt -124.85 -62.32 1.25 Allowed 'General case' 0 N--CA 1.526 3.351 0 N-CA-C 106.573 -1.639 . . . . 0.0 106.573 176.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.411 ' O ' HD23 ' A' ' 105' ' ' LEU . 3.8 tt -46.68 -38.4 9.75 Favored 'General case' 1 N--CA 1.548 4.448 0 C-N-CA 125.278 1.431 . . . . 0.0 111.899 179.073 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 32.6 ttmt 89.19 102.03 0.03 OUTLIER 'General case' 1 N--CA 1.54 4.051 0 C-N-CA 125.793 1.637 . . . . 0.0 108.045 -179.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 28.3 p . . . . . 0 N--CA 1.525 3.317 0 CA-C-O 118.557 -0.735 . . . . 0.0 109.458 -179.763 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 . . . . . 0 N--CA 1.502 2.171 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 82.3 p 61.84 117.73 0.02 OUTLIER Pre-proline 0 N--CA 1.536 3.827 0 C-N-CA 125.412 1.485 . . . . 0.0 111.242 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -70.91 165.02 33.64 Favored 'Trans proline' 0 C--N 1.389 2.693 0 C-N-CA 122.421 2.081 . . . . 0.0 112.575 -179.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -121.61 -54.64 1.95 Allowed 'General case' 0 N--CA 1.518 2.96 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 178.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 71.5 m -112.83 146.32 39.08 Favored 'General case' 0 N--CA 1.522 3.174 0 C-N-CA 123.139 0.576 . . . . 0.0 111.609 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -101.9 126.72 48.86 Favored 'General case' 0 N--CA 1.52 3.03 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . -78.15 129.81 35.6 Favored 'General case' 0 N--CA 1.524 3.238 0 C-N-CA 122.395 0.278 . . . . 0.0 110.773 -178.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 48.2 mtt -145.88 126.79 14.49 Favored 'General case' 0 N--CA 1.526 3.333 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 179.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -115.35 135.63 53.94 Favored 'General case' 0 N--CA 1.521 3.078 0 C-N-CA 122.998 0.519 . . . . 0.0 111.275 -178.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -136.32 -54.97 0.75 Allowed 'General case' 0 N--CA 1.523 3.202 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 178.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -102.0 91.84 4.52 Favored 'General case' 0 N--CA 1.518 2.939 0 N-CA-C 108.323 -0.992 . . . . 0.0 108.323 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -139.57 132.08 28.67 Favored 'General case' 0 N--CA 1.527 3.418 0 C-N-CA 122.935 0.494 . . . . 0.0 110.075 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 12.1 p80 -150.49 113.66 4.85 Favored 'General case' 0 N--CA 1.524 3.27 0 C-N-CA 122.691 0.396 . . . . 0.0 110.145 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -101.49 129.74 47.6 Favored 'General case' 0 N--CA 1.527 3.394 0 C-N-CA 123.004 0.522 . . . . 0.0 110.242 -179.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -119.41 -77.16 0.57 Allowed 'General case' 0 N--CA 1.517 2.894 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 519' ' ' TRP . . . . . 0.748 ' CE2' HD11 ' A' ' 39' ' ' LEU . 68.5 t-105 -43.33 -28.09 0.3 Allowed 'General case' 1 N--CA 1.545 4.324 0 C-N-CA 124.206 1.002 . . . . 0.0 113.679 179.834 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 520' ' ' LEU . . . . . 0.578 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.2 mm? -96.12 -30.38 13.56 Favored 'General case' 0 N--CA 1.528 3.434 0 CA-C-O 117.847 -1.073 . . . . 0.0 113.733 -172.12 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 21.1 tpp180 -64.8 -23.44 67.24 Favored 'General case' 0 N--CA 1.533 3.679 0 N-CA-C 105.882 -1.896 . . . . 0.0 105.882 172.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . 0.543 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 2.1 m-85 -76.42 -41.39 47.85 Favored 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 106.059 -1.83 . . . . 0.0 106.059 172.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 523' ' ' VAL . . . . . 0.465 ' HA ' ' HB2' ' B' ' 526' ' ' LEU . 72.2 t -64.53 -18.32 22.98 Favored 'Isoleucine or valine' 1 N--CA 1.559 4.986 0 CA-C-N 119.52 1.055 . . . . 0.0 111.685 177.711 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -76.53 -56.22 4.82 Favored 'General case' 0 N--CA 1.532 3.669 0 CA-C-N 120.276 1.398 . . . . 0.0 107.842 -179.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 5.6 mp -67.61 -18.98 65.17 Favored 'General case' 0 N--CA 1.533 3.678 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 175.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 526' ' ' LEU . . . . . 0.465 ' HB2' ' HA ' ' B' ' 523' ' ' VAL . 0.4 OUTLIER -70.36 -39.78 74.44 Favored 'General case' 0 N--CA 1.513 2.716 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 177.688 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 527' ' ' LYS . . . . . 0.415 ' HA ' ' HB2' ' B' ' 530' ' ' TYR . 10.2 tttt -67.07 -18.65 65.43 Favored 'General case' 0 N--CA 1.524 3.24 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.884 177.229 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -72.97 -39.88 65.77 Favored 'General case' 0 N--CA 1.529 3.517 0 CA-C-N 119.46 1.027 . . . . 0.0 108.665 176.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 529' ' ' ALA . . . . . 0.661 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -92.83 -7.6 45.9 Favored 'General case' 0 N--CA 1.507 2.399 0 CA-C-O 118.629 -0.7 . . . . 0.0 111.166 178.221 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 530' ' ' TYR . . . . . 0.415 ' HB2' ' HA ' ' B' ' 527' ' ' LYS . 0.2 OUTLIER -83.73 -34.51 24.86 Favored 'General case' 0 N--CA 1.535 3.803 0 CA-C-N 120.35 1.432 . . . . 0.0 108.515 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -62.68 -41.35 99.05 Favored 'General case' 0 N--CA 1.534 3.728 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 177.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -91.85 -87.62 0.21 Allowed 'General case' 0 N--CA 1.514 2.732 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 176.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.9 p30 150.33 51.27 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.07 0 C-N-CA 127.755 2.422 . . . . 0.0 108.415 177.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 534' ' ' LEU . . . . . 0.486 HD22 ' CD2' ' A' ' 96' ' ' LEU . 4.8 mt -110.75 9.15 22.71 Favored 'General case' 0 N--CA 1.529 3.486 0 C-N-CA 124.624 1.17 . . . . 0.0 111.024 -178.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 535' ' ' HIS . . . . . 0.569 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 57.2 p-80 -82.53 -0.9 48.81 Favored 'General case' 0 N--CA 1.515 2.793 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 174.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 536' ' ' LEU . . . . . 0.43 ' HB2' ' HD3' ' B' ' 537' ' ' PRO . 39.2 mt -91.29 -49.82 0.33 Allowed Pre-proline 0 N--CA 1.505 2.277 0 CA-C-O 116.317 -1.802 . . . . 0.0 109.212 -176.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 537' ' ' PRO . . . . . 0.43 ' HD3' ' HB2' ' B' ' 536' ' ' LEU . 4.1 Cg_exo -66.26 -35.19 33.15 Favored 'Trans proline' 0 C--N 1.395 2.996 0 N-CA-C 107.345 -1.829 . . . . 0.0 107.345 171.252 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 538' ' ' LEU . . . . . 0.415 ' HB3' ' HA ' ' B' ' 535' ' ' HIS . 0.3 OUTLIER -62.17 -39.6 93.19 Favored 'General case' 0 N--CA 1.533 3.682 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 175.111 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 9.8 mt -73.32 -23.08 60.21 Favored 'General case' 0 N--CA 1.535 3.817 0 CA-C-O 118.583 -0.722 . . . . 0.0 111.125 177.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -71.53 -17.14 62.34 Favored 'General case' 0 N--CA 1.531 3.596 0 CA-C-N 118.853 0.751 . . . . 0.0 110.802 178.212 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 541' ' ' LEU . . . . . 0.433 ' O ' HD23 ' B' ' 541' ' ' LEU . 1.9 tt -101.01 -52.86 3.18 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 123.495 0.718 . . . . 0.0 110.916 -178.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 542' ' ' MET . . . . . . . . . . . . . 12.2 ptm -54.55 -41.52 69.87 Favored 'General case' 0 N--CA 1.531 3.611 0 CA-C-O 117.754 -1.117 . . . . 0.0 113.301 -174.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 543' ' ' LEU . . . . . . . . . . . . . 1.3 tt -134.37 -104.3 0.23 Allowed 'General case' 0 N--CA 1.533 3.722 0 CA-C-O 117.307 -1.33 . . . . 0.0 113.545 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 544' ' ' THR . . . . . . . . . . . . . 31.0 p -156.27 163.47 24.77 Favored Pre-proline 1 N--CA 1.545 4.278 0 CA-C-N 121.322 1.874 . . . . 0.0 112.389 -177.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -67.54 -27.48 39.19 Favored 'Trans proline' 0 C--N 1.392 2.85 0 C-N-CA 122.849 2.366 . . . . 0.0 111.287 176.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -61.36 -21.57 64.16 Favored 'General case' 1 N--CA 1.54 4.03 0 CA-C-O 118.327 -0.844 . . . . 0.0 111.122 178.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -71.27 -38.48 71.85 Favored 'General case' 0 N--CA 1.528 3.446 0 CA-C-N 119.061 0.846 . . . . 0.0 108.923 177.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -79.78 -19.71 47.98 Favored 'General case' 0 N--CA 1.525 3.285 0 CA-C-O 117.792 -1.099 . . . . 0.0 111.126 177.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -68.65 -45.89 70.58 Favored 'General case' 0 N--CA 1.539 3.998 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 175.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -79.53 -16.41 56.02 Favored 'General case' 0 N--CA 1.509 2.508 0 CA-C-O 117.376 -1.297 . . . . 0.0 110.726 176.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 551' ' ' LEU . . . . . 0.82 HD22 ' CE3' ' A' ' 19' ' ' TRP . 5.7 tp -74.89 -31.54 61.6 Favored 'General case' 0 N--CA 1.528 3.451 0 CA-C-N 120.758 1.617 . . . . 0.0 107.765 174.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -70.74 -62.06 3.79 Favored Glycine 0 N--CA 1.5 2.918 0 N-CA-C 109.051 -1.62 . . . . 0.0 109.051 178.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . 3.1 m -61.05 -27.37 68.29 Favored 'General case' 1 N--CA 1.54 4.058 0 CA-C-O 118.393 -0.813 . . . . 0.0 112.119 -179.34 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 7.5 mtm180 -69.5 -49.33 55.61 Favored 'General case' 0 N--CA 1.539 3.997 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 176.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 555' ' ' VAL . . . . . 0.556 HG23 ' O ' ' B' ' 551' ' ' LEU . 21.8 t -66.23 -15.51 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.865 0 CA-C-O 118.144 -0.931 . . . . 0.0 109.809 175.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 26.3 mtp180 -77.75 -46.71 20.94 Favored 'General case' 0 N--CA 1.52 3.067 0 CA-C-N 119.568 1.076 . . . . 0.0 110.807 178.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 557' ' ' ILE . . . . . 0.589 ' HB ' HG22 ' B' ' 582' ' ' ILE . 0.0 OUTLIER -71.56 -24.71 23.76 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.502 0 CA-C-N 120.282 1.401 . . . . 0.0 111.084 -179.054 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 558' ' ' VAL . . . . . 0.44 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -87.83 -52.64 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.76 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 -179.07 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -59.88 -22.95 63.02 Favored 'General case' 0 N--CA 1.534 3.741 0 CA-C-O 118.81 -0.614 . . . . 0.0 110.701 178.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -91.51 -28.34 17.65 Favored 'General case' 0 N--CA 1.524 3.249 0 CA-C-O 118.546 -0.74 . . . . 0.0 109.935 177.257 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -68.04 -46.17 71.92 Favored 'General case' 1 N--CA 1.539 4.015 0 CA-C-N 119.224 0.92 . . . . 0.0 109.249 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 33.3 mt -55.88 -25.71 43.78 Favored 'General case' 0 N--CA 1.535 3.781 0 C-N-CA 124.533 1.133 . . . . 0.0 112.234 178.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -82.99 -52.59 6.53 Favored 'General case' 0 N--CA 1.515 2.799 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 179.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 80.21 77.34 0.96 Allowed Glycine 0 N--CA 1.512 3.729 0 N-CA-C 110.018 -1.233 . . . . 0.0 110.018 179.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -144.61 -60.7 0.37 Allowed 'General case' 0 N--CA 1.523 3.208 0 CA-C-N 117.294 0.547 . . . . 0.0 109.615 -179.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 43.6 mtt -148.86 79.73 1.42 Allowed 'General case' 0 N--CA 1.524 3.251 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 567' ' ' SER . . . . . 0.402 ' HA ' HD22 ' B' ' 571' ' ' LEU . 17.4 m -140.46 -16.13 0.93 Allowed 'General case' 0 N--CA 1.522 3.169 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 -174.191 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -110.75 -53.43 2.7 Favored 'General case' 0 N--CA 1.531 3.6 0 CA-C-N 120.626 1.557 . . . . 0.0 112.159 -177.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -106.68 -53.37 2.63 Favored 'General case' 0 N--CA 1.528 3.458 0 C-N-CA 123.116 0.566 . . . . 0.0 110.475 -177.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -74.79 -0.13 17.27 Favored 'General case' 0 N--CA 1.515 2.812 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -177.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 571' ' ' LEU . . . . . 0.656 HD23 HG21 ' B' ' 582' ' ' ILE . 42.5 tp -88.64 -49.19 7.02 Favored 'General case' 0 N--CA 1.528 3.469 0 CA-C-N 120.142 1.337 . . . . 0.0 113.682 -177.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -44.39 -46.5 9.49 Favored 'General case' 1 N--CA 1.544 4.252 0 N-CA-C 114.935 1.457 . . . . 0.0 114.935 -175.11 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -62.47 -29.97 70.92 Favored 'General case' 1 N--CA 1.54 4.032 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -177.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -54.83 -57.36 11.87 Favored 'General case' 0 N--CA 1.528 3.437 0 C-N-CA 124.056 0.942 . . . . 0.0 112.636 -179.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -126.12 -38.99 2.11 Favored 'General case' 0 N--CA 1.533 3.709 0 CA-C-O 118.623 -0.703 . . . . 0.0 111.616 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . 123.33 65.66 0.21 Allowed Glycine 1 N--CA 1.519 4.225 0 CA-C-N 118.971 0.805 . . . . 0.0 111.122 179.281 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 577' ' ' ALA . . . . . . . . . . . . . . . -120.89 102.76 8.57 Favored 'General case' 0 N--CA 1.518 2.957 0 N-CA-C 105.506 -2.035 . . . . 0.0 105.506 177.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . -40.4 162.82 0.01 OUTLIER Glycine 1 N--CA 1.539 5.513 0 C-N-CA 124.758 1.17 . . . . 0.0 114.653 -177.402 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 579' ' ' ILE . . . . . 0.553 HG21 ' N6 ' ' E' ' 4' ' ' ' DA' . 1.1 mt -79.43 -20.59 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.627 0 CA-C-N 119.028 1.414 . . . . 0.0 108.944 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 580' ' ' ALA . . . . . 0.877 ' HB2' ' H62' ' F' ' 15' ' ' ' DA' . . . -63.41 -33.53 75.75 Favored 'General case' 0 N--CA 1.53 3.545 0 CA-C-N 120.294 1.406 . . . . 0.0 109.853 175.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 1.8 p -80.24 -52.47 7.7 Favored 'General case' 0 N--CA 1.532 3.638 0 CA-C-N 118.997 0.817 . . . . 0.0 111.578 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 582' ' ' ILE . . . . . 0.656 HG21 HD23 ' B' ' 571' ' ' LEU . 24.2 pt -67.33 -18.7 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.536 3.83 0 CA-C-O 117.701 -1.143 . . . . 0.0 113.482 -176.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 61.0 p -107.57 -25.61 11.28 Favored 'General case' 0 N--CA 1.516 2.844 0 CA-C-N 119.814 1.188 . . . . 0.0 110.781 178.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 13.8 ptt180 -75.64 -22.27 56.95 Favored 'General case' 0 N--CA 1.532 3.653 0 CA-C-N 120.232 1.378 . . . . 0.0 108.087 174.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -69.59 -34.64 73.45 Favored Glycine 0 N--CA 1.513 3.826 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 175.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 60.2 p -72.32 -39.59 68.09 Favored 'General case' 0 N--CA 1.536 3.831 0 CA-C-N 118.362 1.081 . . . . 0.0 110.052 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -60.58 -32.59 71.69 Favored 'General case' 1 N--CA 1.541 4.09 0 C-N-CA 123.126 0.571 . . . . 0.0 110.523 179.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 1.4 m -58.87 -38.88 79.8 Favored 'General case' 1 N--CA 1.541 4.114 0 C-N-CA 123.436 0.695 . . . . 0.0 110.381 178.488 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 42.1 mt -61.47 -44.91 96.26 Favored 'General case' 0 N--CA 1.525 3.286 0 C-N-CA 123.955 0.902 . . . . 0.0 110.725 179.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.92 -26.21 64.14 Favored 'General case' 1 N--CA 1.543 4.202 0 C-N-CA 123.678 0.791 . . . . 0.0 112.158 179.53 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -84.05 -39.99 18.91 Favored 'General case' 0 N--CA 1.517 2.911 0 CA-C-N 118.627 0.649 . . . . 0.0 111.917 -178.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -55.63 161.58 3.07 Favored Pre-proline 1 N--CA 1.546 4.373 0 CA-C-O 118.258 -0.877 . . . . 0.0 113.098 -179.591 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 593' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -80.05 -179.89 5.65 Favored 'Trans proline' 0 C--N 1.379 2.171 0 C-N-CA 121.777 1.651 . . . . 0.0 110.355 178.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.8 t -97.83 -28.34 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.036 0 CA-C-O 117.865 -1.064 . . . . 0.0 111.489 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -61.1 -44.04 97.97 Favored 'General case' 0 N--CA 1.517 2.903 0 CA-C-N 119.808 1.185 . . . . 0.0 110.373 -178.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 596' ' ' LEU . . . . . 0.474 ' CD2' HD22 ' A' ' 34' ' ' LEU . 6.9 mp -99.47 -14.39 19.11 Favored 'General case' 0 N--CA 1.509 2.503 0 CA-C-O 118.653 -0.689 . . . . 0.0 112.023 179.299 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.85 -27.84 66.18 Favored 'General case' 1 N--CA 1.54 4.052 0 N-CA-C 103.35 -2.833 . . . . 0.0 103.35 168.75 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -56.87 -38.76 73.18 Favored 'General case' 0 N--CA 1.519 3.01 0 C-N-CA 123.889 0.876 . . . . 0.0 109.641 173.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 599' ' ' TRP . . . . . 0.611 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 44.0 t90 -63.75 -36.09 82.75 Favored 'General case' 0 N--CA 1.529 3.482 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 177.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.28 -37.08 54.51 Favored 'General case' 0 N--CA 1.535 3.803 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 177.073 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -69.9 -38.93 76.44 Favored 'General case' 0 N--CA 1.539 3.983 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 175.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.97 -23.8 48.42 Favored 'General case' 1 N--CA 1.546 4.367 0 C-N-CA 123.199 0.6 . . . . 0.0 110.598 175.295 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 603' ' ' VAL . . . . . 0.553 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.3 OUTLIER -120.57 0.85 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.321 0 CA-C-O 118.351 -0.833 . . . . 0.0 113.159 -176.475 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -112.87 -59.73 1.98 Allowed 'General case' 0 N--CA 1.509 2.522 0 N-CA-C 105.964 -1.865 . . . . 0.0 105.964 176.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.29 -40.52 94.47 Favored 'General case' 1 N--CA 1.542 4.138 0 C-N-CA 123.948 0.899 . . . . 0.0 110.552 178.7 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 23.1 tttp 76.75 101.81 0.07 Allowed 'General case' 0 N--CA 1.527 3.395 0 C-N-CA 125.015 1.326 . . . . 0.0 108.884 -179.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 75.0 m . . . . . 0 N--CA 1.525 3.296 0 C-N-CA 123.451 0.701 . . . . 0.0 109.854 -179.814 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.112 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.146 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.42 -9.796 3 O4'-C1'-N19 119.549 14.686 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' E' E ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.415 -10.338 2 O4'-C1'-N19 120.093 15.366 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' E' E ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.419 -9.92 4 O4'-C1'-N19 119.233 14.292 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . 0.974 ' H62' HG21 ' B' ' 579' ' ' ILE . . . . . . . . 5 C3'--C2' 1.416 -10.169 4 O4'-C1'-N19 120.453 15.816 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' E' E ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.574 11.009 4 O4'-C1'-N19 119.855 15.069 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.399 -11.864 6 O4'-C1'-N19 119.427 14.534 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' E' E ' 7' ' ' ' DA' . . . . . 0.521 H2'' " H5'" ' E' ' 8' ' ' ' DG' . . . . . . . . 6 C3'--C2' 1.4 -11.801 4 C4'-C3'-C2' 113.12 9.92 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' E' E ' 8' ' ' ' DG' . . . . . 0.521 " H5'" H2'' ' E' ' 7' ' ' ' DA' . . . . . . . . 6 O3'--C3' 1.563 10.177 2 O4'-C1'-N19 119.82 15.026 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.408 -10.989 5 O4'-C1'-N19 119.996 15.245 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.409 -10.88 5 O4'-C1'-N19 117.784 12.481 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.407 -11.063 6 O4'-C1'-N19 120.385 15.731 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' E' E ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.403 -11.489 2 O4'-C1'-N19 120.768 16.21 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' E' E ' 13' ' ' ' DC' . . . . . 0.476 H2'' " O5'" ' E' ' 14' ' ' ' DT' . . . . . . . . 6 O3'--C3' 1.556 9.643 4 O4'-C1'-N19 119.038 14.047 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' E' E ' 14' ' ' ' DT' . . . . . 0.589 ' H72' ' HB3' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.404 -11.382 6 O4'-C1'-N19 118.983 13.979 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' E' E ' 15' ' ' ' DA' . . . . . 0.704 ' H62' ' HB2' ' A' ' 80' ' ' ALA . . . . . . . . 6 C3'--C2' 1.418 -10.009 5 O4'-C1'-N19 120.014 15.267 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' E' E ' 16' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.417 -10.062 5 O4'-C1'-N19 120.279 15.599 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' E' E ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.566 10.396 3 O4'-C1'-N19 119.65 14.812 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' E' E ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.413 -10.478 5 O4'-C1'-N19 120.503 15.879 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' E' E ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.418 5 O4'-C1'-N19 119.805 15.007 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' E' E ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.509 6.836 4 O4'-C1'-N19 119.659 14.824 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' F' F ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.565 10.317 2 C4'-C3'-C2' 116.735 13.535 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' F' F ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.41 -10.769 5 O4'-C1'-N19 119.926 15.157 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' F' F ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.417 -10.093 4 O4'-C1'-N19 120.302 15.628 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' F' F ' 4' ' ' ' DA' . . . . . 0.52 ' N6 ' HG21 ' A' ' 79' ' ' ILE . . . . . . . . 5 C3'--C2' 1.415 -10.31 4 O4'-C1'-N19 120.944 16.43 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' F' F ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.578 11.3 4 O4'-C1'-N19 118.738 13.672 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 7 C3'--C2' 1.402 -11.601 6 O4'-C1'-N19 119.172 14.215 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' F' F ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 5 C4'--C3' 1.42 -10.81 3 N19-C1'-C2' 131.227 10.642 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' F' F ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 4 C3'--C2' 1.412 -10.627 5 O4'-C1'-N19 119.716 14.896 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' F' F ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.43 5 O4'-C1'-N19 119.282 14.352 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' F' F ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 5 C3'--C2' 1.402 -11.623 4 O4'-C1'-N19 118.084 12.855 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.413 -10.521 5 O4'-C1'-N19 119.879 15.098 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' F' F ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.402 -11.565 2 O4'-C1'-N19 120.355 15.694 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' F' F ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 5 O3'--C3' 1.553 9.409 4 O4'-C1'-N19 124.167 20.458 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' F' F ' 14' ' ' ' DT' . . . . . 0.715 ' H72' ' HB3' ' B' ' 580' ' ' ALA . . . . . . . . 5 C3'--C2' 1.405 -11.332 6 O4'-C1'-N19 120.103 15.379 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' F' F ' 15' ' ' ' DA' . . . . . 0.617 ' H62' ' HB2' ' B' ' 580' ' ' ALA . . . . . . . . 5 C3'--C2' 1.426 -9.182 3 O4'-C1'-N19 120.083 15.353 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' F' F ' 16' ' ' ' DG' . . . . . 0.512 ' O6 ' ' HB ' ' B' ' 579' ' ' ILE . . . . . . . . 5 C3'--C2' 1.417 -10.111 4 O4'-C1'-N19 119.973 15.216 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' F' F ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.422 -9.607 3 O4'-C1'-N19 118.734 13.668 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' F' F ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 6 C3'--C2' 1.414 -10.383 4 O4'-C1'-N19 119.644 14.804 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 6 O3'--C3' 1.565 10.273 3 O4'-C1'-N19 119.789 14.986 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' F' F ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 3 O4'--C1' 1.511 7.034 4 O4'-C1'-N19 119.817 15.021 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 . . . . . 0 N--CA 1.501 2.106 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.2 t -89.38 133.39 34.88 Favored Pre-proline 0 N--CA 1.524 3.255 0 CA-C-O 117.423 -1.275 . . . . 0.0 109.762 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_endo -68.58 -34.13 20.38 Favored 'Trans proline' 0 C--N 1.391 2.787 0 C-N-CA 122.561 2.174 . . . . 0.0 111.685 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -88.28 130.58 35.07 Favored 'General case' 0 N--CA 1.521 3.09 0 CA-C-N 118.24 0.473 . . . . 0.0 110.048 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 10.6 t -127.17 119.47 26.52 Favored 'General case' 0 N--CA 1.521 3.121 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 178.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 68.53 131.01 0.03 OUTLIER 'General case' 1 N--CA 1.542 4.135 0 C-N-CA 123.621 0.768 . . . . 0.0 109.117 -177.179 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.64 -54.64 38.94 Favored 'General case' 1 N--CA 1.543 4.189 0 C-N-CA 122.956 0.502 . . . . 0.0 111.937 -178.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 29.7 mtt -115.89 115.21 25.82 Favored 'General case' 0 N--CA 1.517 2.92 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -159.15 132.07 6.99 Favored 'General case' 0 N--CA 1.524 3.23 0 C-N-CA 122.632 0.373 . . . . 0.0 110.896 -179.075 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 64.46 124.17 0.02 OUTLIER 'General case' 0 N--CA 1.538 3.97 0 C-N-CA 124.673 1.189 . . . . 0.0 110.948 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -148.9 129.6 14.12 Favored 'General case' 0 N--CA 1.534 3.736 0 C-N-CA 122.878 0.471 . . . . 0.0 110.008 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 44.0 mtp180 -75.4 139.25 42.23 Favored 'General case' 0 N--CA 1.533 3.681 0 C-N-CA 122.534 0.334 . . . . 0.0 111.3 -178.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -71.69 149.46 45.46 Favored 'General case' 0 N--CA 1.534 3.765 0 C-N-CA 123.128 0.571 . . . . 0.0 111.961 -178.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 43.5 mt-30 -83.12 135.61 34.75 Favored 'General case' 0 N--CA 1.533 3.711 0 C-N-CA 122.792 0.437 . . . . 0.0 110.919 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -122.02 -68.53 0.89 Allowed 'General case' 0 N--CA 1.521 3.112 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 179.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.761 ' CE3' HD22 ' B' ' 551' ' ' LEU . 76.4 t-105 -51.37 -44.42 62.1 Favored 'General case' 1 N--CA 1.541 4.093 0 C-N-CA 123.471 0.708 . . . . 0.0 109.736 177.29 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.401 HD22 ' N ' ' A' ' 20' ' ' LEU . 2.3 mm? -77.41 -25.61 50.93 Favored 'General case' 0 N--CA 1.524 3.271 0 CA-C-O 117.557 -1.211 . . . . 0.0 111.745 -177.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.0 tpm_? -55.64 -30.54 61.17 Favored 'General case' 1 N--CA 1.544 4.266 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 173.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.55 ' HB2' HG21 ' B' ' 555' ' ' VAL . 0.0 OUTLIER -84.89 -37.57 20.46 Favored 'General case' 0 N--CA 1.507 2.411 0 CA-C-O 116.125 -1.893 . . . . 0.0 109.482 173.496 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 22.0 t -70.67 -29.9 40.03 Favored 'Isoleucine or valine' 1 N--CA 1.574 5.769 0 CA-C-N 121.382 1.901 . . . . 0.0 113.475 -174.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -73.05 -50.64 21.83 Favored 'General case' 0 N--CA 1.533 3.719 0 CA-C-N 120.298 1.408 . . . . 0.0 108.3 -179.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.7 mp -72.8 -15.69 61.63 Favored 'General case' 0 N--CA 1.525 3.314 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 175.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.537 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -69.79 -37.0 76.16 Favored 'General case' 0 N--CA 1.517 2.896 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 175.294 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.487 ' HA ' ' HB2' ' A' ' 30' ' ' TYR . 35.4 tttt -63.42 -21.68 66.44 Favored 'General case' 0 N--CA 1.522 3.169 0 CA-C-O 118.437 -0.792 . . . . 0.0 111.247 176.633 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -70.6 -41.47 72.27 Favored 'General case' 0 N--CA 1.534 3.768 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 175.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.633 ' HB2' ' CZ2' ' B' ' 599' ' ' TRP . . . -88.72 -6.19 57.6 Favored 'General case' 0 N--CA 1.507 2.398 0 CA-C-O 118.676 -0.678 . . . . 0.0 110.908 178.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.487 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -83.94 -36.06 23.54 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-N 120.218 1.372 . . . . 0.0 108.52 179.486 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -61.08 -39.06 88.46 Favored 'General case' 0 N--CA 1.532 3.658 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 177.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -97.32 -85.45 0.36 Allowed 'General case' 0 N--CA 1.516 2.872 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 177.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p30 149.78 51.97 0.0 OUTLIER 'General case' 1 N--CA 1.56 5.044 0 C-N-CA 127.515 2.326 . . . . 0.0 107.982 178.312 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.488 HD22 ' CD2' ' B' ' 596' ' ' LEU . 7.3 mt -112.32 11.56 20.1 Favored 'General case' 0 N--CA 1.532 3.652 0 C-N-CA 123.74 0.816 . . . . 0.0 111.354 -178.161 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.56 ' N ' ' HB1' ' A' ' 29' ' ' ALA . 52.8 p-80 -81.4 0.29 38.12 Favored 'General case' 0 N--CA 1.518 2.966 0 C-N-CA 123.381 0.672 . . . . 0.0 109.473 174.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.463 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 22.8 mt -91.3 -50.98 0.31 Allowed Pre-proline 0 N--CA 1.51 2.555 0 C-N-CA 125.266 1.426 . . . . 0.0 109.148 -176.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.463 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 9.1 Cg_exo -62.11 -39.9 45.97 Favored 'Trans proline' 0 C--N 1.386 2.523 0 N-CA-C 106.428 -2.182 . . . . 0.0 106.428 170.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.458 ' HB3' ' HA ' ' A' ' 35' ' ' HIS . 0.3 OUTLIER -56.59 -38.64 72.29 Favored 'General case' 0 N--CA 1.531 3.606 0 C-N-CA 123.928 0.891 . . . . 0.0 109.736 176.11 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.648 HD11 ' CE2' ' B' ' 519' ' ' TRP . 3.0 mt -60.08 -42.25 94.2 Favored 'General case' 1 N--CA 1.561 5.093 0 CA-C-N 119.478 1.035 . . . . 0.0 109.237 175.979 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -63.27 -25.62 68.4 Favored 'General case' 1 N--CA 1.544 4.244 0 CA-C-O 118.614 -0.707 . . . . 0.0 112.732 -179.646 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.803 HD11 ' HB2' ' B' ' 592' ' ' ALA . 7.8 mp -81.19 -41.14 22.79 Favored 'General case' 0 N--CA 1.534 3.771 0 CA-C-N 118.827 0.74 . . . . 0.0 109.112 -179.357 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 11.9 ptt? -97.82 44.29 1.05 Allowed 'General case' 0 N--CA 1.53 3.537 0 N-CA-C 104.05 -2.574 . . . . 0.0 104.05 173.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.9 tp -30.73 -103.64 0.0 OUTLIER 'General case' 0 N--CA 1.531 3.611 0 C-N-CA 127.338 2.255 . . . . 0.0 115.41 -173.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 54.0 p 52.5 126.94 0.0 OUTLIER Pre-proline 0 N--CA 1.535 3.795 0 CA-C-N 120.624 1.557 . . . . 0.0 111.69 -178.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -62.09 -32.06 83.46 Favored 'Trans proline' 0 C--N 1.382 2.316 0 C-N-CA 121.27 1.313 . . . . 0.0 110.335 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -48.85 -21.78 0.7 Allowed 'General case' 1 N--CA 1.551 4.585 0 C-N-CA 124.394 1.078 . . . . 0.0 113.71 178.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -62.45 -73.81 0.1 Allowed 'General case' 0 N--CA 1.538 3.936 0 CA-C-N 119.671 1.123 . . . . 0.0 110.522 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -89.64 6.18 42.45 Favored 'General case' 0 N--CA 1.535 3.806 0 CA-C-N 119.806 1.184 . . . . 0.0 111.837 177.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -86.67 -30.77 21.48 Favored 'General case' 0 N--CA 1.518 2.975 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 172.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.88 -48.71 6.85 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.472 ' HG ' ' CD2' ' B' ' 522' ' ' PHE . 13.1 tp -65.06 -28.77 69.7 Favored 'General case' 1 N--CA 1.54 4.071 0 CA-C-N 119.98 1.263 . . . . 0.0 107.853 175.304 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.441 ' HA2' ' CE2' ' B' ' 522' ' ' PHE . . . -68.46 -73.72 0.67 Allowed Glycine 0 N--CA 1.505 3.262 0 C-N-CA 124.474 1.035 . . . . 0.0 112.64 177.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.5 m -69.78 -29.0 66.21 Favored 'General case' 0 N--CA 1.537 3.915 0 CA-C-O 117.989 -1.005 . . . . 0.0 113.418 -175.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.413 ' O ' HD13 ' A' ' 57' ' ' ILE . 6.6 mtt180 -73.39 -46.89 46.19 Favored 'General case' 0 N--CA 1.53 3.532 0 CA-C-N 120.179 1.354 . . . . 0.0 107.644 178.079 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.5 t -66.18 -16.96 21.57 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.9 0 O-C-N 120.648 -1.282 . . . . 0.0 109.41 174.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.32 -51.48 20.5 Favored 'General case' 0 N--CA 1.529 3.51 0 CA-C-N 120.022 1.283 . . . . 0.0 111.499 177.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.462 ' HB ' HG22 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -71.84 -23.57 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.51 0 CA-C-N 120.336 1.426 . . . . 0.0 112.123 -177.916 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.7 HG11 HD11 ' B' ' 541' ' ' LEU . 0.1 OUTLIER -86.11 -51.51 13.15 Favored 'Isoleucine or valine' 1 N--CA 1.541 4.088 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 -179.697 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -58.57 -25.0 62.07 Favored 'General case' 0 N--CA 1.538 3.931 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.505 178.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -94.45 -24.3 17.37 Favored 'General case' 0 N--CA 1.526 3.341 0 CA-C-O 118.303 -0.856 . . . . 0.0 110.859 177.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 20.7 tp -79.14 -70.2 0.52 Allowed 'General case' 0 N--CA 1.529 3.506 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.8 mt -42.84 -31.93 0.55 Allowed 'General case' 1 N--CA 1.544 4.232 0 C-N-CA 125.163 1.385 . . . . 0.0 113.683 -178.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.7 mmm180 -87.99 -43.33 11.82 Favored 'General case' 0 N--CA 1.526 3.345 0 CA-C-O 119.149 -0.453 . . . . 0.0 110.115 -179.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.37 87.12 0.59 Allowed Glycine 1 N--CA 1.517 4.097 0 N-CA-C 110.678 -0.969 . . . . 0.0 110.678 178.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -148.68 -54.53 0.19 Allowed 'General case' 0 N--CA 1.522 3.146 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 76.3 mtm -148.42 83.12 1.48 Allowed 'General case' 0 N--CA 1.516 2.83 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.8 t -146.95 14.9 1.18 Allowed 'General case' 0 N--CA 1.528 3.436 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -178.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 8.4 mp0 -116.29 -72.18 0.7 Allowed 'General case' 0 N--CA 1.526 3.341 0 CA-C-N 119.154 0.888 . . . . 0.0 111.097 179.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -110.86 -46.29 3.37 Favored 'General case' 0 N--CA 1.522 3.149 0 C-N-CA 123.278 0.631 . . . . 0.0 110.135 -178.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -68.17 -14.62 63.12 Favored 'General case' 0 N--CA 1.517 2.892 0 CA-C-O 117.866 -1.064 . . . . 0.0 113.441 -178.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.73 HD23 HG21 ' A' ' 82' ' ' ILE . 13.6 tp -76.89 -60.34 2.4 Favored 'General case' 0 N--CA 1.529 3.485 0 CA-C-N 120.117 1.326 . . . . 0.0 112.701 -177.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -39.03 -32.63 0.09 Allowed 'General case' 1 N--CA 1.552 4.67 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -177.783 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -72.78 -44.64 61.31 Favored 'General case' 0 N--CA 1.532 3.642 0 CA-C-N 118.361 0.528 . . . . 0.0 110.46 -178.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -41.34 -51.65 3.63 Favored 'General case' 1 N--CA 1.541 4.094 0 C-N-CA 125.548 1.539 . . . . 0.0 113.39 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.99 -77.2 0.59 Allowed 'General case' 0 N--CA 1.532 3.674 0 CA-C-O 118.739 -0.648 . . . . 0.0 109.374 -179.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 157.63 45.89 0.01 OUTLIER Glycine 1 N--CA 1.522 4.38 0 CA-C-O 119.177 -0.79 . . . . 0.0 111.522 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -113.3 113.48 25.34 Favored 'General case' 0 N--CA 1.514 2.755 0 N-CA-C 107.4 -1.334 . . . . 0.0 107.4 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -44.67 176.24 0.01 OUTLIER Glycine 1 N--CA 1.541 5.652 0 C-N-CA 124.966 1.27 . . . . 0.0 115.184 -177.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.52 HG21 ' N6 ' ' F' ' 4' ' ' ' DA' . 3.4 mt -81.55 -18.81 11.36 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.913 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 177.183 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.704 ' HB2' ' H62' ' E' ' 15' ' ' ' DA' . . . -75.43 -0.19 19.2 Favored 'General case' 0 N--CA 1.513 2.694 0 CA-C-O 117.86 -1.067 . . . . 0.0 111.084 174.243 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.74 -47.94 3.91 Favored 'General case' 0 N--CA 1.536 3.864 0 CA-C-N 120.758 1.617 . . . . 0.0 109.283 176.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.73 HG21 HD23 ' A' ' 71' ' ' LEU . 0.1 OUTLIER -66.16 -41.01 88.56 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.912 0 CA-C-O 118.938 -0.553 . . . . 0.0 111.373 -178.192 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 50.3 p -82.64 -26.28 32.33 Favored 'General case' 0 N--CA 1.519 2.991 0 CA-C-O 118.743 -0.646 . . . . 0.0 109.991 178.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.6 ttp180 -65.15 -35.16 80.22 Favored 'General case' 1 N--CA 1.544 4.264 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 175.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -56.56 -36.61 71.66 Favored Glycine 1 N--CA 1.529 4.849 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 176.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 14.7 m -62.25 -41.43 98.43 Favored 'General case' 1 N--CA 1.542 4.158 0 CA-C-N 117.552 0.676 . . . . 0.0 110.181 177.526 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -61.67 -32.72 72.92 Favored 'General case' 1 N--CA 1.541 4.084 0 C-N-CA 123.893 0.877 . . . . 0.0 112.219 -179.677 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 2.5 m -68.32 -39.43 81.96 Favored 'General case' 1 N--CA 1.54 4.026 0 CA-C-N 118.311 0.505 . . . . 0.0 111.07 -178.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.4 mt -59.35 -40.46 86.47 Favored 'General case' 0 N--CA 1.528 3.471 0 C-N-CA 123.764 0.826 . . . . 0.0 111.588 -179.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -56.82 -28.69 61.87 Favored 'General case' 1 N--CA 1.543 4.219 0 CA-C-O 118.771 -0.633 . . . . 0.0 112.064 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.96 -38.0 21.55 Favored 'General case' 0 N--CA 1.516 2.874 0 CA-C-N 118.323 0.51 . . . . 0.0 111.216 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.11 161.86 0.68 Allowed Pre-proline 1 N--CA 1.548 4.434 0 CA-C-O 118.206 -0.902 . . . . 0.0 112.897 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -81.64 170.73 14.03 Favored 'Trans proline' 0 C--N 1.379 2.155 0 C-N-CA 121.687 1.591 . . . . 0.0 110.72 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.44 ' HA ' ' HB3' ' A' ' 97' ' ' ARG . 2.8 t -95.34 -29.08 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.029 0 CA-C-O 117.92 -1.038 . . . . 0.0 111.076 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -62.3 -42.61 99.5 Favored 'General case' 0 N--CA 1.513 2.685 0 CA-C-N 119.764 1.166 . . . . 0.0 109.962 -179.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.528 ' CD2' HD22 ' B' ' 534' ' ' LEU . 7.2 mp -98.84 -14.04 19.82 Favored 'General case' 0 N--CA 1.508 2.47 0 CA-C-O 118.302 -0.856 . . . . 0.0 112.221 179.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.44 ' HB3' ' HA ' ' A' ' 94' ' ' VAL . 0.1 OUTLIER -67.42 -30.57 70.35 Favored 'General case' 1 N--CA 1.549 4.522 0 N-CA-C 102.728 -3.064 . . . . 0.0 102.728 168.254 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -57.04 -39.59 75.14 Favored 'General case' 0 N--CA 1.517 2.914 0 C-N-CA 123.871 0.868 . . . . 0.0 110.201 174.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.658 ' CZ2' ' HB2' ' B' ' 529' ' ' ALA . 47.8 t90 -65.1 -33.96 77.27 Favored 'General case' 0 N--CA 1.527 3.407 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 177.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.23 -36.68 61.3 Favored 'General case' 0 N--CA 1.538 3.928 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 176.429 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -69.51 -38.7 77.69 Favored 'General case' 1 N--CA 1.54 4.052 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 175.213 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.42 ' HB2' ' HA ' ' A' ' 99' ' ' TRP . 1.2 mm-40 -59.17 -23.99 62.69 Favored 'General case' 1 N--CA 1.546 4.341 0 C-N-CA 123.4 0.68 . . . . 0.0 110.63 175.865 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.508 HG22 ' O ' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -113.37 -2.9 10.66 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.348 0 CA-C-O 118.11 -0.947 . . . . 0.0 112.399 -176.947 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 54.5 mt -102.99 -62.24 1.3 Allowed 'General case' 0 N--CA 1.527 3.378 0 N-CA-C 105.088 -2.19 . . . . 0.0 105.088 174.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.6 tp -54.83 -33.3 61.53 Favored 'General case' 0 N--CA 1.53 3.538 0 C-N-CA 125.077 1.351 . . . . 0.0 111.384 177.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.8 mttp 70.01 5.04 5.09 Favored 'General case' 1 N--CA 1.539 4.008 0 C-N-CA 124.987 1.315 . . . . 0.0 113.364 -179.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.525 3.295 0 CA-C-N 119.791 1.178 . . . . 0.0 110.07 178.837 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 504' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 . . . . . 0 N--CA 1.508 2.445 0 CA-C-O 119.653 -0.213 . . . . 0.0 110.851 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 37.4 p -84.39 123.66 74.6 Favored Pre-proline 0 N--CA 1.527 3.392 0 CA-C-O 117.248 -1.358 . . . . 0.0 109.499 179.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -73.95 -1.93 11.55 Favored 'Trans proline' 0 CA--C 1.579 2.734 0 C-N-CA 122.452 2.101 . . . . 0.0 113.445 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 507' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 67.67 117.67 0.03 OUTLIER 'General case' 0 N--CA 1.537 3.897 0 CA-C-N 120.016 1.28 . . . . 0.0 108.933 -177.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 508' ' ' SER . . . . . . . . . . . . . 7.1 t -117.28 -43.38 2.84 Favored 'General case' 0 N--CA 1.53 3.546 0 CA-C-O 118.969 -0.539 . . . . 0.0 111.238 -178.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 509' ' ' ALA . . . . . . . . . . . . . . . -93.62 126.63 38.89 Favored 'General case' 0 N--CA 1.523 3.219 0 CA-C-N 118.294 0.497 . . . . 0.0 110.158 -179.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 510' ' ' ALA . . . . . . . . . . . . . . . 64.56 139.73 0.02 OUTLIER 'General case' 0 N--CA 1.537 3.91 0 C-N-CA 124.519 1.128 . . . . 0.0 111.77 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 511' ' ' MET . . . . . . . . . . . . . 17.5 ptt? -103.38 -40.44 6.38 Favored 'General case' 0 N--CA 1.527 3.422 0 CA-C-O 119.074 -0.488 . . . . 0.0 110.17 179.299 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 512' ' ' ALA . . . . . . . . . . . . . . . -156.45 139.3 15.25 Favored 'General case' 0 N--CA 1.523 3.213 0 CA-C-N 118.063 0.392 . . . . 0.0 111.618 -179.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -106.5 126.69 52.57 Favored 'General case' 0 N--CA 1.523 3.206 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 514' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -99.69 -54.23 2.98 Favored 'General case' 0 N--CA 1.528 3.444 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -178.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? 63.06 123.57 0.01 OUTLIER 'General case' 0 N--CA 1.536 3.864 0 C-N-CA 124.308 1.043 . . . . 0.0 112.3 178.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 516' ' ' HIS . . . . . . . . . . . . . 3.4 t-80 62.16 136.56 0.01 OUTLIER 'General case' 0 N--CA 1.535 3.816 0 C-N-CA 124.85 1.26 . . . . 0.0 112.848 177.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 517' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -112.26 124.92 53.51 Favored 'General case' 0 N--CA 1.522 3.165 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 177.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 518' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -95.87 -71.03 0.69 Allowed 'General case' 0 N--CA 1.522 3.137 0 CA-C-O 118.66 -0.686 . . . . 0.0 110.924 -178.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 519' ' ' TRP . . . . . 0.648 ' CE2' HD11 ' A' ' 39' ' ' LEU . 70.8 t-105 -43.7 -28.68 0.43 Allowed 'General case' 1 N--CA 1.55 4.559 0 N-CA-C 113.658 0.985 . . . . 0.0 113.658 -178.542 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 520' ' ' LEU . . . . . 0.605 HD22 ' N ' ' B' ' 520' ' ' LEU . 2.1 mm? -97.76 -28.34 13.92 Favored 'General case' 0 N--CA 1.529 3.485 0 CA-C-O 117.637 -1.173 . . . . 0.0 113.715 -172.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 521' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -63.05 -24.84 68.1 Favored 'General case' 1 N--CA 1.54 4.039 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 171.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . 0.558 ' CD2' ' HA ' ' B' ' 519' ' ' TRP . 1.5 m-85 -76.73 -41.54 44.7 Favored 'General case' 0 N--CA 1.513 2.724 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 173.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 523' ' ' VAL . . . . . . . . . . . . . 43.4 t -67.12 -22.51 29.38 Favored 'Isoleucine or valine' 1 N--CA 1.564 5.25 0 CA-C-O 117.645 -1.169 . . . . 0.0 112.631 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 524' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -78.03 -51.45 10.31 Favored 'General case' 0 N--CA 1.528 3.44 0 CA-C-N 120.202 1.364 . . . . 0.0 109.153 -177.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . 0.454 HD23 ' HB ' ' A' ' 103' ' ' VAL . 5.0 mp -75.71 -18.84 59.46 Favored 'General case' 0 N--CA 1.524 3.249 0 O-C-N 123.395 0.434 . . . . 0.0 109.979 176.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 526' ' ' LEU . . . . . 0.444 HD23 ' O ' ' B' ' 522' ' ' PHE . 0.4 OUTLIER -71.89 -32.84 67.83 Favored 'General case' 0 N--CA 1.524 3.228 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 173.873 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -65.02 -26.35 68.23 Favored 'General case' 0 N--CA 1.518 2.966 0 CA-C-O 118.398 -0.81 . . . . 0.0 110.386 176.173 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 528' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -66.6 -41.93 87.67 Favored 'General case' 1 N--CA 1.54 4.071 0 CA-C-N 119.088 0.858 . . . . 0.0 108.861 176.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 529' ' ' ALA . . . . . 0.658 ' HB2' ' CZ2' ' A' ' 99' ' ' TRP . . . -88.11 -10.47 49.96 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 118.035 -0.983 . . . . 0.0 111.548 178.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 530' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -81.31 -34.3 31.99 Favored 'General case' 0 N--CA 1.534 3.745 0 CA-C-N 120.925 1.693 . . . . 0.0 108.864 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 531' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -60.31 -43.02 96.71 Favored 'General case' 0 N--CA 1.538 3.972 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 177.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 532' ' ' ASN . . . . . . . . . . . . . 61.5 m-80 -92.96 -85.81 0.26 Allowed 'General case' 0 N--CA 1.516 2.864 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 177.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 1.9 p30 150.14 48.98 0.0 OUTLIER 'General case' 1 N--CA 1.559 5.017 0 C-N-CA 127.89 2.476 . . . . 0.0 108.245 177.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 534' ' ' LEU . . . . . 0.528 HD22 ' CD2' ' A' ' 96' ' ' LEU . 6.0 mt -105.45 7.7 33.21 Favored 'General case' 0 N--CA 1.53 3.564 0 C-N-CA 124.3 1.04 . . . . 0.0 111.012 -179.339 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 535' ' ' HIS . . . . . 0.615 ' N ' ' HB1' ' B' ' 529' ' ' ALA . 46.6 p-80 -82.52 0.47 42.39 Favored 'General case' 0 N--CA 1.508 2.469 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 175.103 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 536' ' ' LEU . . . . . . . . . . . . . 42.5 mt -92.93 -49.16 0.29 Allowed Pre-proline 0 N--CA 1.508 2.458 0 CA-C-O 116.391 -1.766 . . . . 0.0 109.282 -176.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 537' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -67.11 -37.01 19.9 Favored 'Trans proline' 0 C--N 1.394 2.921 0 N-CA-C 107.179 -1.893 . . . . 0.0 107.179 171.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 538' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.85 -43.69 98.0 Favored 'General case' 0 N--CA 1.529 3.507 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 176.455 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 539' ' ' LEU . . . . . . . . . . . . . 11.6 mt -66.36 -31.04 71.57 Favored 'General case' 0 N--CA 1.537 3.893 0 CA-C-O 118.865 -0.588 . . . . 0.0 110.781 179.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 540' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -54.63 -23.48 17.28 Favored 'General case' 1 N--CA 1.542 4.158 0 CA-C-N 118.952 0.796 . . . . 0.0 111.996 178.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 541' ' ' LEU . . . . . 0.7 HD11 HG11 ' A' ' 58' ' ' VAL . 0.0 OUTLIER -102.18 -41.34 6.43 Favored 'General case' 0 N--CA 1.519 2.98 0 C-N-CA 123.734 0.814 . . . . 0.0 109.297 -179.553 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 542' ' ' MET . . . . . 0.665 ' N ' HD13 ' B' ' 541' ' ' LEU . 4.3 ptt? -101.46 25.11 8.74 Favored 'General case' 1 N--CA 1.541 4.108 0 CA-C-N 119.061 0.846 . . . . 0.0 112.789 -178.427 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 543' ' ' LEU . . . . . 0.409 ' O ' HG23 ' B' ' 544' ' ' THR . 18.7 tp -131.64 -96.43 0.34 Allowed 'General case' 0 N--CA 1.536 3.84 0 CA-C-O 117.559 -1.21 . . . . 0.0 112.67 178.465 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 544' ' ' THR . . . . . 0.409 HG23 ' O ' ' B' ' 543' ' ' LEU . 18.1 p 129.14 140.23 0.0 OUTLIER Pre-proline 1 N--CA 1.558 4.952 0 C-N-CA 128.727 2.811 . . . . 0.0 106.94 -177.145 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 545' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -57.49 -32.56 94.5 Favored 'Trans proline' 0 N--CA 1.521 3.098 0 C-N-CA 122.84 2.36 . . . . 0.0 113.368 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 546' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -63.17 -34.76 78.32 Favored 'General case' 1 N--CA 1.539 4.024 0 CA-C-O 118.886 -0.578 . . . . 0.0 111.02 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 547' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -68.67 -40.97 79.91 Favored 'General case' 0 N--CA 1.53 3.534 0 CA-C-O 118.469 -0.777 . . . . 0.0 110.759 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 548' ' ' ARG . . . . . . . . . . . . . 19.8 ptt180 -76.21 -20.5 57.41 Favored 'General case' 0 N--CA 1.529 3.519 0 CA-C-O 118.045 -0.979 . . . . 0.0 111.592 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 549' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -69.17 -44.26 72.57 Favored 'General case' 0 N--CA 1.536 3.842 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 174.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -80.18 -11.12 59.77 Favored 'General case' 0 N--CA 1.512 2.66 0 CA-C-O 117.736 -1.126 . . . . 0.0 111.538 177.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 551' ' ' LEU . . . . . 0.761 HD22 ' CE3' ' A' ' 19' ' ' TRP . 10.2 tp -77.23 -44.04 31.41 Favored 'General case' 0 N--CA 1.528 3.43 0 CA-C-N 120.779 1.627 . . . . 0.0 107.827 176.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 552' ' ' GLY . . . . . . . . . . . . . . . -69.78 -49.23 37.22 Favored Glycine 0 N--CA 1.506 3.309 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 553' ' ' THR . . . . . 0.458 HG21 ' HB2' ' B' ' 577' ' ' ALA . 2.6 m -65.21 -33.81 76.88 Favored 'General case' 0 N--CA 1.532 3.667 0 CA-C-O 118.535 -0.745 . . . . 0.0 112.037 -178.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 554' ' ' ARG . . . . . . . . . . . . . 22.6 mtt180 -65.31 -52.34 54.71 Favored 'General case' 1 N--CA 1.541 4.082 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 176.294 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 555' ' ' VAL . . . . . 0.55 HG21 ' HB2' ' A' ' 22' ' ' PHE . 17.5 t -64.86 -16.81 20.51 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.806 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.559 177.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 11.4 mmt180 -79.11 -43.49 23.98 Favored 'General case' 0 N--CA 1.52 3.03 0 CA-C-N 119.884 1.22 . . . . 0.0 110.5 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 557' ' ' ILE . . . . . 0.537 HD13 ' N ' ' B' ' 558' ' ' VAL . 0.0 OUTLIER -75.94 -25.68 17.23 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.93 0 CA-C-N 120.124 1.329 . . . . 0.0 111.421 -178.89 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 558' ' ' VAL . . . . . 0.537 ' N ' HD13 ' B' ' 557' ' ' ILE . 0.1 OUTLIER -86.43 -51.42 13.16 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.902 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 -178.708 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 559' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -61.08 -28.28 68.97 Favored 'General case' 0 N--CA 1.527 3.381 0 CA-C-O 118.6 -0.714 . . . . 0.0 110.326 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 560' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -89.49 -22.64 22.36 Favored 'General case' 0 N--CA 1.522 3.156 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.326 177.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 561' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.14 -46.62 70.31 Favored 'General case' 1 N--CA 1.543 4.185 0 CA-C-N 119.749 1.159 . . . . 0.0 108.379 177.503 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 15.2 mt -50.25 -28.61 7.97 Favored 'General case' 0 N--CA 1.537 3.911 0 C-N-CA 124.048 0.939 . . . . 0.0 111.978 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 563' ' ' ARG . . . . . . . . . . . . . 24.8 mmm180 -82.61 -52.73 6.54 Favored 'General case' 0 N--CA 1.526 3.369 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 564' ' ' GLY . . . . . . . . . . . . . . . 66.02 83.71 0.1 OUTLIER Glycine 1 N--CA 1.524 4.559 0 CA-C-O 119.308 -0.718 . . . . 0.0 112.949 177.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 565' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -161.8 -52.26 0.04 OUTLIER 'General case' 0 N--CA 1.528 3.46 0 CA-C-N 117.581 0.69 . . . . 0.0 109.729 178.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 566' ' ' MET . . . . . . . . . . . . . 86.9 mtp -145.02 54.53 1.22 Allowed 'General case' 0 N--CA 1.525 3.299 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 567' ' ' SER . . . . . . . . . . . . . 75.7 p -130.75 -4.88 4.09 Favored 'General case' 0 N--CA 1.522 3.16 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -176.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 568' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -107.29 -57.81 2.03 Favored 'General case' 0 N--CA 1.527 3.387 0 CA-C-N 119.938 1.244 . . . . 0.0 111.238 -178.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 569' ' ' ARG . . . . . . . . . . . . . 3.5 ttm180 -99.53 -51.4 3.78 Favored 'General case' 0 N--CA 1.529 3.512 0 C-N-CA 123.234 0.613 . . . . 0.0 110.617 -177.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 570' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -73.73 3.77 6.03 Favored 'General case' 0 N--CA 1.515 2.797 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -176.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 571' ' ' LEU . . . . . 0.556 HD23 HD11 ' B' ' 582' ' ' ILE . 45.8 tp -91.12 -56.01 3.32 Favored 'General case' 0 N--CA 1.526 3.349 0 CA-C-N 120.219 1.372 . . . . 0.0 113.299 -178.585 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 572' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -30.12 -34.19 0.01 OUTLIER 'General case' 1 N--CA 1.551 4.615 0 N-CA-C 117.662 2.468 . . . . 0.0 117.662 -174.67 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 573' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -55.23 -20.36 10.63 Favored 'General case' 1 N--CA 1.545 4.276 0 CA-C-N 119.155 0.889 . . . . 0.0 112.779 -179.331 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 574' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -101.95 -83.1 0.47 Allowed 'General case' 0 N--CA 1.509 2.485 0 C-N-CA 124.287 1.035 . . . . 0.0 109.143 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 575' ' ' LEU . . . . . . . . . . . . . 55.4 mt -139.17 17.85 2.6 Favored 'General case' 0 N--CA 1.53 3.529 0 CA-C-N 119.14 0.882 . . . . 0.0 111.51 -179.086 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 576' ' ' GLY . . . . . . . . . . . . . . . -47.68 -28.75 5.39 Favored Glycine 1 N--CA 1.548 6.138 0 O-C-N 120.866 -1.146 . . . . 0.0 113.851 -179.164 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 577' ' ' ALA . . . . . 0.458 ' HB2' HG21 ' B' ' 553' ' ' THR . . . 67.5 39.99 2.72 Favored 'General case' 1 N--CA 1.545 4.288 0 CA-C-N 118.539 1.17 . . . . 0.0 112.071 178.523 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 578' ' ' GLY . . . . . . . . . . . . . . . 86.21 167.4 43.51 Favored Glycine 1 N--CA 1.519 4.195 0 CA-C-O 119.449 -0.639 . . . . 0.0 112.317 178.182 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 579' ' ' ILE . . . . . 0.974 HG21 ' H62' ' E' ' 4' ' ' ' DA' . 36.2 mm -84.63 -17.79 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.709 0 CA-C-N 118.621 1.21 . . . . 0.0 108.466 176.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 580' ' ' ALA . . . . . 0.715 ' HB3' ' H72' ' F' ' 14' ' ' ' DT' . . . -63.82 -39.39 94.12 Favored 'General case' 0 N--CA 1.523 3.218 0 CA-C-N 120.17 1.35 . . . . 0.0 110.097 177.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 581' ' ' THR . . . . . . . . . . . . . 15.2 p -77.44 -40.69 42.48 Favored 'General case' 1 N--CA 1.542 4.134 0 CA-C-N 119.208 0.913 . . . . 0.0 111.64 178.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 582' ' ' ILE . . . . . 0.556 HD11 HD23 ' B' ' 571' ' ' LEU . 1.1 tt -63.31 -36.8 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.258 0 C-N-CA 123.563 0.745 . . . . 0.0 112.682 -175.082 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 583' ' ' THR . . . . . . . . . . . . . 41.3 p -99.24 -30.15 12.42 Favored 'General case' 0 N--CA 1.513 2.722 0 CA-C-O 118.053 -0.975 . . . . 0.0 111.428 -178.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 21.3 ptt180 -71.91 -22.66 61.45 Favored 'General case' 0 N--CA 1.533 3.676 0 CA-C-N 119.891 1.223 . . . . 0.0 109.411 175.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -77.99 -28.06 57.17 Favored Glycine 0 N--CA 1.511 3.662 0 N-CA-C 109.428 -1.469 . . . . 0.0 109.428 176.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 10.9 m -63.16 -40.35 97.31 Favored 'General case' 0 N--CA 1.537 3.9 0 CA-C-N 118.239 1.019 . . . . 0.0 111.074 179.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 587' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -61.24 -24.93 66.72 Favored 'General case' 1 N--CA 1.54 4.03 0 CA-C-O 118.783 -0.627 . . . . 0.0 112.318 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 588' ' ' SER . . . . . . . . . . . . . 7.8 m -64.12 -41.88 97.07 Favored 'General case' 1 N--CA 1.541 4.093 0 CA-C-N 118.726 0.694 . . . . 0.0 110.663 179.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 589' ' ' LEU . . . . . . . . . . . . . 42.1 mt -54.7 -43.3 72.41 Favored 'General case' 0 N--CA 1.531 3.588 0 C-N-CA 124.406 1.082 . . . . 0.0 111.944 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.86 -31.98 73.12 Favored 'General case' 1 N--CA 1.541 4.117 0 C-N-CA 123.339 0.656 . . . . 0.0 112.382 -178.83 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 591' ' ' ALA . . . . . . . . . . . . . . . -74.35 -35.1 63.55 Favored 'General case' 0 N--CA 1.525 3.281 0 CA-C-N 118.352 0.524 . . . . 0.0 111.983 -179.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . 0.803 ' HB2' HD11 ' A' ' 41' ' ' LEU . . . -45.07 163.61 0.2 Allowed Pre-proline 1 N--CA 1.548 4.452 0 N-CA-C 115.207 1.558 . . . . 0.0 115.207 -178.837 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 593' ' ' PRO . . . . . 0.44 ' O ' ' HB2' ' B' ' 597' ' ' ARG . 60.1 Cg_endo -86.81 173.82 5.89 Favored 'Trans proline' 0 C--N 1.38 2.229 0 C-N-CA 122.125 1.884 . . . . 0.0 107.407 174.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 594' ' ' VAL . . . . . . . . . . . . . 2.9 t -98.92 -27.62 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.311 0 CA-C-N 120.188 1.358 . . . . 0.0 111.662 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -62.55 -43.4 98.91 Favored 'General case' 0 N--CA 1.517 2.905 0 CA-C-N 120.079 1.309 . . . . 0.0 110.792 -178.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 596' ' ' LEU . . . . . 0.488 ' CD2' HD22 ' A' ' 34' ' ' LEU . 7.2 mp -99.97 -14.35 18.72 Favored 'General case' 0 N--CA 1.511 2.61 0 CA-C-O 118.723 -0.656 . . . . 0.0 112.26 179.382 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' B' ' 593' ' ' PRO . 0.0 OUTLIER -68.07 -30.17 69.3 Favored 'General case' 0 N--CA 1.538 3.927 0 N-CA-C 103.245 -2.872 . . . . 0.0 103.245 168.412 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 598' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -54.73 -37.97 66.55 Favored 'General case' 0 N--CA 1.521 3.115 0 C-N-CA 123.868 0.867 . . . . 0.0 110.094 173.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 599' ' ' TRP . . . . . 0.633 ' CZ2' ' HB2' ' A' ' 29' ' ' ALA . 43.3 t90 -63.06 -38.41 91.07 Favored 'General case' 0 N--CA 1.536 3.828 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 177.262 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 600' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.85 -36.86 59.49 Favored 'General case' 0 N--CA 1.535 3.796 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 177.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 601' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -70.12 -36.24 74.67 Favored 'General case' 1 N--CA 1.541 4.117 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 175.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 602' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -62.27 -23.82 66.92 Favored 'General case' 1 N--CA 1.543 4.199 0 C-N-CA 123.619 0.768 . . . . 0.0 110.402 176.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 603' ' ' VAL . . . . . 0.51 HG22 ' O ' ' B' ' 599' ' ' TRP . 0.1 OUTLIER -115.73 9.79 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.529 3.497 0 C-N-CA 123.163 0.585 . . . . 0.0 111.832 -177.501 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 604' ' ' LEU . . . . . . . . . . . . . 26.7 mt -110.03 -63.1 1.42 Allowed 'General case' 0 N--CA 1.519 2.977 0 N-CA-C 105.281 -2.118 . . . . 0.0 105.281 175.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 605' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.57 -45.22 60.25 Favored 'General case' 0 N--CA 1.525 3.285 0 C-N-CA 124.484 1.114 . . . . 0.0 109.932 179.395 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 606' ' ' LYS . . . . . . . . . . . . . 57.9 mttp 69.04 97.02 0.06 Allowed 'General case' 0 N--CA 1.527 3.394 0 C-N-CA 124.786 1.234 . . . . 0.0 108.766 -178.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 607' ' ' SER . . . . . . . . . . . . . 52.9 p . . . . . 0 N--CA 1.524 3.261 0 CA-C-O 118.184 -0.912 . . . . 0.0 110.347 -178.671 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 898' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.209 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 998' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.049 0 CA-C-O 118.099 -0.953 . . . . 0.0 108.441 . . . . . . . . . 1 1 . 1 stop_ save_