data_2gle_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 2gle _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 ' 4' ' ' VAL . . . . . 0.481 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 2.7 m . . . . . 0 CA--C 1.5 -0.959 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -70.58 -7.72 46.12 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.751 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -101.85 -7.83 22.16 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.203 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.45 ' HA ' HE21 ' A' ' 11' ' ' GLN . 53.5 m0 -71.28 144.59 49.94 Favored 'General case' 0 CA--C 1.501 -0.92 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.1 m -94.84 -71.73 0.65 Allowed 'General case' 0 N--CA 1.419 -1.98 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.615 -173.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 74.9 t -146.08 -68.13 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.203 -1.376 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.2 pm0 -63.76 -20.82 66.05 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.914 -0.585 . . . . 0.0 112.445 -175.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.483 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 28.0 mt-30 -77.71 -13.31 59.94 Favored 'General case' 0 C--O 1.217 -0.61 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.1 p -77.16 -19.58 14.36 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.379 0 CA-C-O 121.393 0.616 . . . . 0.0 109.48 178.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 83.3 p -70.81 -39.25 73.17 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.948 -175.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . 0.483 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 42.5 m-70 -50.37 -36.58 33.15 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 114.392 -1.276 . . . . 0.0 110.92 -179.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.465 ' CH2' HG23 ' A' ' 60' ' ' VAL . 24.7 t90 -71.15 -61.85 1.61 Allowed 'General case' 0 N--CA 1.423 -1.788 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.784 175.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.429 HD12 ' CD2' ' A' ' 28' ' ' PHE . 44.5 mt -46.68 -49.07 19.9 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.474 1.11 . . . . 0.0 112.419 -177.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 99.5 t -59.35 -29.53 42.19 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.321 0 C-N-CA 122.74 0.416 . . . . 0.0 111.176 -179.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -72.39 -27.37 69.87 Favored Glycine 0 N--CA 1.447 -0.621 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.179 -176.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.463 HD22 ' O ' ' A' ' 15' ' ' TRP . 1.2 pt? -106.94 15.51 25.3 Favored 'General case' 0 C--N 1.317 -0.847 0 O-C-N 122.586 -0.361 . . . . 0.0 111.064 179.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.3 t 74.46 16.42 3.28 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-O 122.178 0.989 . . . . 0.0 111.523 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -93.95 17.85 11.56 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 114.914 -1.039 . . . . 0.0 109.629 -177.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -50.94 -30.79 15.79 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-O 121.538 0.685 . . . . 0.0 111.196 174.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -59.54 -25.74 64.78 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 124.593 1.157 . . . . 0.0 110.834 178.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -88.7 -21.96 23.63 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.774 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.7 t -55.85 -35.09 38.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 122.665 0.386 . . . . 0.0 111.338 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.8 m -57.32 -30.05 64.44 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 123.815 0.846 . . . . 0.0 111.879 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.591 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 21.1 tp10 -109.55 -35.99 6.08 Favored 'General case' 0 N--CA 1.431 -1.377 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.416 -178.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.429 ' CD2' HD12 ' A' ' 16' ' ' LEU . 1.9 m-85 -53.67 -43.44 68.87 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-O 121.411 0.624 . . . . 0.0 110.795 177.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.7 m -77.07 -23.04 52.0 Favored 'General case' 0 N--CA 1.44 -0.972 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.718 -177.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.87 -39.48 69.62 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.624 -178.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.32 9.33 40.26 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.288 -178.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 61.63 42.2 11.31 Favored 'General case' 0 C--O 1.234 0.271 0 O-C-N 123.611 0.569 . . . . 0.0 110.453 177.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.9 mm -72.18 114.25 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.013 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 90.2 p -107.37 -167.85 1.32 Allowed 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 178.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.481 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.17 -27.74 69.56 Favored Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 111.311 -0.716 . . . . 0.0 111.311 178.181 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -55.34 -42.75 74.24 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.044 0.937 . . . . 0.0 110.224 178.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.544 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -94.61 -24.74 17.08 Favored 'General case' 0 N--CA 1.433 -1.286 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.218 -179.271 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.4 tt -57.2 -52.73 64.14 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.868 1.267 . . . . 0.0 109.605 177.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.8 mt -62.58 -38.71 91.17 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -175.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -99.88 10.55 41.12 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -175.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 37' ' ' GLN . 40.5 mt -50.71 135.1 24.03 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 178.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -134.21 179.48 6.24 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 176.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.407 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -55.67 -42.76 85.74 Favored Glycine 0 C--O 1.204 -1.764 0 CA-C-O 119.238 -0.757 . . . . 0.0 112.699 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -55.33 -43.33 74.85 Favored 'General case' 0 CA--C 1.488 -1.409 0 CA-C-N 117.459 0.629 . . . . 0.0 111.873 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.6 mtpp -65.23 -49.5 69.42 Favored 'General case' 0 C--O 1.196 -1.754 0 O-C-N 123.763 0.665 . . . . 0.0 110.817 176.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 91.1 mt -60.0 -30.95 69.48 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.848 0.833 . . . . 0.0 111.391 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.467 ' HA ' HG22 ' A' ' 52' ' ' THR . 58.7 mtpt -77.68 -30.24 51.84 Favored 'General case' 0 N--CA 1.426 -1.659 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.127 177.339 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.38 -4.32 47.63 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.224 0.535 . . . . 0.0 111.267 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.591 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.3 mm? -84.94 -7.56 59.11 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 171.191 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.85 -1.26 39.95 Favored Glycine 0 C--O 1.223 -0.578 0 CA-C-N 115.879 -0.601 . . . . 0.0 113.719 176.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.407 ' C ' ' HG1' ' A' ' 52' ' ' THR . 15.3 tpt -85.32 -50.18 7.55 Favored 'General case' 0 C--N 1.307 -1.239 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 -178.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.467 HG22 ' HA ' ' A' ' 47' ' ' LYS . 74.8 p 52.88 31.72 11.24 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 123.995 0.918 . . . . 0.0 112.168 174.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.2 t -73.08 129.76 38.79 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.768 -175.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.6 t -53.66 -54.86 31.78 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 125.061 1.344 . . . . 0.0 113.118 -176.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -50.65 -55.88 14.4 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-O 122.513 1.149 . . . . 0.0 109.914 177.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.766 ' O ' HG12 ' A' ' 60' ' ' VAL . 6.3 m-20 -62.0 -42.16 98.85 Favored 'General case' 0 N--CA 1.412 -2.345 0 CA-C-N 113.055 -1.884 . . . . 0.0 111.105 -173.188 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -52.79 -25.64 11.95 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 177.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -101.35 -38.47 8.03 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-O 120.879 0.371 . . . . 0.0 110.985 176.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 56.0 tp -72.67 -55.2 7.18 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -174.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.766 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.4 p -59.88 -26.4 35.47 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.032 0 CA-C-O 121.637 0.732 . . . . 0.0 109.16 -179.249 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.409 ' HA ' ' CD2' ' A' ' 64' ' ' LEU . 55.9 tptt -72.01 -28.92 63.71 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 113.655 -1.612 . . . . 0.0 110.16 -172.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -84.44 -40.21 18.03 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 114.73 -1.123 . . . . 0.0 108.655 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.0 tppt? -69.43 -42.46 74.94 Favored 'General case' 0 C--N 1.297 -1.686 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.201 -175.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.41 HD21 ' HB2' ' A' ' 41' ' ' LEU . 3.7 pp -65.73 -30.06 70.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.343 -175.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -82.68 -22.13 34.68 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 119.701 -0.8 . . . . 0.0 111.711 -179.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 . . . . . 0 C--N 1.324 -0.51 0 CA-C-O 121.06 0.457 . . . . 0.0 110.205 179.458 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.497 HG12 ' CH2' ' A' ' 7' ' ' TRP . 4.3 m . . . . . 0 CA--C 1.51 -0.565 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 12.3 p-80 -71.12 -12.69 61.63 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-O 121.268 0.556 . . . . 0.0 110.643 178.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -91.66 -7.9 48.63 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.85 178.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.497 ' CH2' HG12 ' A' ' 4' ' ' VAL . 49.2 m0 -82.66 147.45 28.51 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 -179.345 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 58.0 m -115.75 -69.21 0.87 Allowed 'General case' 0 N--CA 1.416 -2.162 0 O-C-N 123.422 0.451 . . . . 0.0 110.917 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.401 ' O ' HG13 ' A' ' 12' ' ' VAL . 59.3 t -141.58 -60.56 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -178.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.7 pm0 -70.29 9.58 0.58 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.629 -1.168 . . . . 0.0 113.865 -177.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.418 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 18.8 mt-30 -123.15 -11.9 7.96 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 175.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.411 HG22 HD12 ' A' ' 38' ' ' LEU . 4.2 p -77.4 -19.52 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-O 122.488 1.137 . . . . 0.0 108.474 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.9 p -67.53 -40.38 85.05 Favored 'General case' 0 N--CA 1.425 -1.676 0 C-N-CA 125.692 1.597 . . . . 0.0 112.376 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . 0.418 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 45.1 m-70 -57.61 -38.57 75.15 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.266 -177.287 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.466 ' O ' HD22 ' A' ' 19' ' ' LEU . 42.5 t90 -64.94 -61.06 2.39 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.488 176.141 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.1 mt -45.37 -52.62 9.69 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.657 1.183 . . . . 0.0 112.389 -177.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 85.3 t -62.65 -27.39 42.83 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 CA-C-O 121.148 0.499 . . . . 0.0 111.489 -177.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.67 -30.76 70.57 Favored Glycine 0 C--O 1.217 -0.918 0 CA-C-N 115.914 -0.584 . . . . 0.0 112.034 -178.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.466 HD22 ' O ' ' A' ' 15' ' ' TRP . 0.4 OUTLIER -102.63 15.52 29.06 Favored 'General case' 0 C--N 1.314 -0.953 0 O-C-N 122.503 -0.41 . . . . 0.0 111.215 177.74 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.0 m 67.4 26.99 8.24 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 122.422 1.106 . . . . 0.0 111.008 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.57 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 1.2 mm? -98.0 21.28 10.92 Favored 'General case' 0 C--N 1.31 -1.114 0 C-N-CA 125.173 1.389 . . . . 0.0 108.69 178.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -60.45 -9.97 4.33 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 123.893 0.877 . . . . 0.0 112.939 176.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.57 ' NE2' ' HA ' ' A' ' 21' ' ' LEU . 0.3 OUTLIER -84.07 -18.14 37.95 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 118.957 -1.097 . . . . 0.0 111.431 172.497 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -84.75 -27.72 26.74 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -177.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.513 ' HA ' ' HB2' ' A' ' 28' ' ' PHE . 0.7 OUTLIER -58.89 -25.62 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 177.971 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.3 m -54.7 -40.78 69.53 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.836 0.854 . . . . 0.0 111.383 176.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 38.2 tp10 -105.97 -27.42 11.18 Favored 'General case' 0 C--O 1.219 -0.541 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.044 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.513 ' HB2' ' HA ' ' A' ' 25' ' ' VAL . 1.7 m-85 -53.73 -44.39 69.85 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 121.218 0.533 . . . . 0.0 110.473 176.066 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.6 m -69.5 -28.87 66.43 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.615 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -76.88 -19.82 56.99 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.949 -176.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -106.8 4.21 27.29 Favored 'General case' 0 CA--C 1.501 -0.917 0 C-N-CA 119.649 -0.82 . . . . 0.0 109.474 175.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 61.06 38.9 16.86 Favored 'General case' 0 C--O 1.245 0.868 0 O-C-N 124.087 0.867 . . . . 0.0 110.435 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 49.4 mm -67.95 114.64 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.874 0 CA-C-N 115.187 -0.915 . . . . 0.0 108.673 -179.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.467 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 89.1 p -103.49 -169.26 1.62 Allowed 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 178.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.461 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -60.96 -29.04 69.73 Favored Glycine 0 N--CA 1.439 -1.12 0 N-CA-C 111.42 -0.672 . . . . 0.0 111.42 178.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -58.4 -44.8 89.16 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.39 0.614 . . . . 0.0 109.631 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.94 -4.46 49.75 Favored 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -179.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.411 HD12 HG22 ' A' ' 12' ' ' VAL . 3.3 tt -80.57 -49.47 11.27 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 178.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.5 mt -61.38 -39.52 90.97 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.524 -178.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -93.47 15.4 16.0 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -178.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.8 mt -55.64 160.49 2.48 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.704 0.764 . . . . 0.0 112.674 178.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.434 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 15.5 t70 -162.08 172.36 16.0 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 105.784 -1.932 . . . . 0.0 105.784 -177.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.41 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -61.04 -34.73 89.05 Favored Glycine 0 C--O 1.204 -1.748 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 175.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -51.1 -48.55 61.68 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 123.455 0.702 . . . . 0.0 111.16 176.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.447 ' O ' HD22 ' A' ' 49' ' ' LEU . 14.0 mtpp -69.07 -43.08 75.32 Favored 'General case' 0 C--O 1.197 -1.702 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.266 176.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 91.0 mt -59.84 -27.23 66.47 Favored 'General case' 0 C--O 1.255 1.349 0 CA-C-O 121.603 0.716 . . . . 0.0 111.244 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.498 ' HA ' HG21 ' A' ' 52' ' ' THR . 58.4 mtpt -80.8 -40.34 25.19 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.701 175.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.26 -11.26 60.45 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.512 0.672 . . . . 0.0 111.59 179.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.454 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.0 mm? -78.21 -3.23 41.62 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 123.179 0.591 . . . . 0.0 110.029 171.22 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 70.57 8.99 64.22 Favored Glycine 0 C--N 1.341 0.845 0 CA-C-O 121.259 0.366 . . . . 0.0 112.665 177.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 22.0 mmt -92.13 -59.06 2.19 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 115.418 -0.391 . . . . 0.0 110.929 -178.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.498 HG21 ' HA ' ' A' ' 47' ' ' LYS . 25.5 p 57.68 25.57 11.92 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 124.588 1.155 . . . . 0.0 112.588 175.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.414 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 14.8 m -69.74 118.99 13.29 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 123.19 0.596 . . . . 0.0 111.559 -176.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.0 m -63.2 -34.42 77.61 Favored 'General case' 0 C--O 1.244 0.77 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -177.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.464 ' HG3' ' N ' ' A' ' 56' ' ' ASP . 5.3 pt20 -59.24 -45.26 91.63 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.548 0.689 . . . . 0.0 110.198 176.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.545 ' O ' HG13 ' A' ' 60' ' ' VAL . 70.9 m-20 -74.76 -35.08 62.58 Favored 'General case' 0 N--CA 1.425 -1.724 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.666 -175.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.414 ' HG2' ' O ' ' A' ' 53' ' ' SER . 49.0 mmm-85 -55.22 -25.81 35.51 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.684 0.394 . . . . 0.0 111.548 175.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -98.28 -17.69 18.79 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.889 0.375 . . . . 0.0 111.279 178.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.401 HD12 ' C ' ' A' ' 59' ' ' LEU . 1.8 tm? -96.39 -66.55 0.9 Allowed 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 120.641 0.258 . . . . 0.0 110.801 -175.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.545 HG13 ' O ' ' A' ' 56' ' ' ASP . 3.9 p -61.55 -24.57 34.22 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.849 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.769 -174.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -63.59 -36.25 83.17 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 122.107 0.956 . . . . 0.0 109.442 -179.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 65' ' ' LYS . 82.5 tttt -81.98 -34.76 29.53 Favored 'General case' 0 C--N 1.29 -2.016 0 CA-C-N 114.163 -1.381 . . . . 0.0 109.571 -177.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.446 ' CB ' HD11 ' A' ' 19' ' ' LEU . 0.5 OUTLIER -74.54 -38.57 62.73 Favored 'General case' 0 C--O 1.191 -1.989 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.229 -176.99 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 pp -64.36 -29.96 71.02 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -176.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 21.6 pttp -75.25 -34.97 61.44 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 119.933 -0.707 . . . . 0.0 110.309 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 . . . . . 0 C--N 1.311 -1.089 0 CA-C-O 121.15 0.5 . . . . 0.0 111.062 -175.509 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.591 HG11 ' CH2' ' A' ' 7' ' ' TRP . 15.2 m . . . . . 0 C--O 1.214 -0.799 0 CA-C-O 121.238 0.542 . . . . 0.0 112.311 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.4 p-80 -73.37 -9.11 58.35 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.843 0.83 . . . . 0.0 110.725 179.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -98.74 -11.27 22.07 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.149 177.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.591 ' CH2' HG11 ' A' ' 4' ' ' VAL . 54.1 m0 -72.53 150.77 42.9 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 177.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.2 m -104.48 -75.0 0.63 Allowed 'General case' 0 N--CA 1.424 -1.759 0 CA-C-O 121.082 0.468 . . . . 0.0 109.992 -178.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.504 ' O ' HG13 ' A' ' 12' ' ' VAL . 94.5 t -139.06 -65.67 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.203 -1.353 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 -175.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -66.71 -14.04 62.06 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.153 0.501 . . . . 0.0 112.301 -176.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.477 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 26.3 mt-30 -88.34 -15.75 34.83 Favored 'General case' 0 N--CA 1.433 -1.299 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 178.038 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.504 HG13 ' O ' ' A' ' 9' ' ' VAL . 2.9 p -75.67 -25.76 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-O 122.028 0.918 . . . . 0.0 109.294 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.408 ' O ' HG23 ' A' ' 17' ' ' VAL . 0.8 OUTLIER -67.09 -28.38 68.13 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 114.6 -1.182 . . . . 0.0 111.654 -177.039 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . 0.477 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 83.6 m-70 -59.5 -41.68 90.41 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 -178.078 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.52 ' O ' HD22 ' A' ' 19' ' ' LEU . 38.0 t90 -64.51 -57.46 9.13 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.819 177.517 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.477 HD11 ' CG ' ' A' ' 28' ' ' PHE . 48.5 mt -48.96 -51.24 31.44 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.104 0.962 . . . . 0.0 112.738 -178.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 13' ' ' SER . 88.2 t -62.47 -24.78 36.15 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.033 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.022 -178.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -75.03 -24.13 72.56 Favored Glycine 0 N--CA 1.444 -0.775 0 N-CA-C 112.017 -0.433 . . . . 0.0 112.017 -177.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.52 HD22 ' O ' ' A' ' 15' ' ' TRP . 0.7 OUTLIER -105.56 15.98 26.15 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.143 0.496 . . . . 0.0 110.482 174.818 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.1 m 64.67 28.92 13.09 Favored 'General case' 0 C--O 1.213 -0.862 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.804 178.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.597 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 0.6 OUTLIER -100.51 20.86 14.19 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 126.851 2.06 . . . . 0.0 108.856 -179.593 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -49.59 -29.97 7.97 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.595 0.758 . . . . 0.0 112.242 176.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.597 ' NE2' ' HA ' ' A' ' 21' ' ' LEU . 2.6 pm0 -61.75 -22.37 65.33 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 176.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.403 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 8.4 m-85 -85.97 -22.87 27.14 Favored 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 86.9 t -54.86 -38.71 45.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 O-C-N 123.383 0.427 . . . . 0.0 111.254 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.8 m -50.86 -39.46 53.83 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.283 1.033 . . . . 0.0 111.745 -178.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.614 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 35.4 tp10 -103.34 -30.66 10.47 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.747 -178.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.477 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.6 m-85 -55.26 -41.13 71.8 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 121.389 0.614 . . . . 0.0 109.884 176.467 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 47.1 t -69.37 -34.81 75.1 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.911 178.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.52 -32.51 71.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.129 -173.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -99.33 6.44 46.15 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.124 -179.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 59.47 39.15 22.18 Favored 'General case' 0 C--O 1.244 0.783 0 O-C-N 123.867 0.729 . . . . 0.0 110.118 178.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.4 mm -67.76 112.54 2.98 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.219 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.34 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.407 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 87.6 p -107.13 -168.23 1.37 Allowed 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.488 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.9 -25.37 67.71 Favored Glycine 0 N--CA 1.441 -0.975 0 N-CA-C 111.458 -0.657 . . . . 0.0 111.458 177.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -56.26 -39.57 72.83 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.265 1.026 . . . . 0.0 108.955 178.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.1 -20.71 16.54 Favored 'General case' 0 N--CA 1.434 -1.27 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 179.211 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.6 tt -64.75 -51.47 62.16 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.915 0.886 . . . . 0.0 109.856 -179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 25.6 mt -62.31 -34.32 76.38 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.547 0.689 . . . . 0.0 111.718 -175.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -101.56 13.59 34.51 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -177.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.3 mt -55.03 155.19 4.73 Favored 'General case' 0 C--O 1.24 0.588 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 177.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -159.38 -176.66 5.92 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 176.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.95 -39.25 93.88 Favored Glycine 0 N--CA 1.429 -1.791 0 CA-C-O 118.982 -0.899 . . . . 0.0 113.014 -179.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 -57.55 -45.15 85.47 Favored 'General case' 0 CA--C 1.481 -1.686 0 CA-C-N 117.845 0.822 . . . . 0.0 111.896 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 mtpp -63.77 -46.31 85.82 Favored 'General case' 0 C--O 1.199 -1.58 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.999 177.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 83.8 mt -60.14 -32.48 71.07 Favored 'General case' 0 C--O 1.244 0.779 0 CA-C-O 121.679 0.752 . . . . 0.0 111.352 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.483 ' HA ' HG21 ' A' ' 52' ' ' THR . 40.9 mtpt -72.11 -34.74 68.83 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.922 175.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.07 -13.26 61.17 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 123.12 0.568 . . . . 0.0 111.434 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.614 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.3 mm? -77.71 -7.66 56.81 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-O 121.449 0.642 . . . . 0.0 109.544 173.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.89 -1.43 46.93 Favored Glycine 0 C--O 1.222 -0.614 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.955 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.403 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 37.6 tpp -85.15 -48.27 9.33 Favored 'General case' 0 N--CA 1.441 -0.885 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -178.395 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.483 HG21 ' HA ' ' A' ' 47' ' ' LYS . 70.5 p 55.72 17.02 2.21 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 125.579 1.552 . . . . 0.0 114.274 172.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.45 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 40.5 t -65.14 118.75 9.66 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 122.669 0.388 . . . . 0.0 111.25 -176.19 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.5 t -59.61 -46.46 88.89 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 123.745 0.818 . . . . 0.0 110.56 -177.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -57.13 -48.53 78.44 Favored 'General case' 0 C--O 1.241 0.619 0 O-C-N 123.427 0.455 . . . . 0.0 111.434 178.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.669 ' O ' HG12 ' A' ' 60' ' ' VAL . 29.0 m-20 -66.9 -44.81 79.84 Favored 'General case' 0 CA--C 1.474 -1.969 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.576 -177.449 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.66 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 28.5 mtm180 -58.15 -35.66 71.87 Favored 'General case' 0 C--O 1.196 -1.735 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 -178.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.81 -27.49 62.0 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.315 0.579 . . . . 0.0 110.648 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 47.8 tp -85.58 -51.57 6.4 Favored 'General case' 0 C--O 1.247 0.945 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.891 -177.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.669 HG12 ' O ' ' A' ' 56' ' ' ASP . 4.4 p -60.67 -22.52 26.31 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.513 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.003 178.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.66 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 26.5 tptp -70.55 -33.84 71.58 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 122.082 0.944 . . . . 0.0 108.877 -174.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -82.76 -43.28 16.94 Favored 'General case' 0 C--N 1.288 -2.103 0 CA-C-N 114.221 -1.354 . . . . 0.0 108.974 -178.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.447 ' CB ' HD12 ' A' ' 19' ' ' LEU . 0.8 OUTLIER -69.98 -36.31 75.09 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 114.734 -1.121 . . . . 0.0 112.198 -175.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.0 pp -69.7 -17.17 63.45 Favored 'General case' 0 C--O 1.205 -1.285 0 CA-C-N 116.757 -0.202 . . . . 0.0 111.303 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -98.47 0.57 45.45 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 119.719 -0.792 . . . . 0.0 112.342 176.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 . . . . . 0 C--N 1.322 -0.63 0 CA-C-O 122.82 1.295 . . . . 0.0 108.538 177.554 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.609 HG13 ' CH2' ' A' ' 7' ' ' TRP . 10.2 m . . . . . 0 CA--C 1.512 -0.506 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.4 p-80 -70.98 -12.98 61.84 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-O 121.39 0.615 . . . . 0.0 110.488 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -95.46 -2.18 49.29 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 123.908 0.883 . . . . 0.0 110.132 178.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.609 ' CH2' HG13 ' A' ' 4' ' ' VAL . 52.1 m0 -84.75 131.09 34.6 Favored 'General case' 0 N--CA 1.433 -1.304 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 179.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.2 m -87.57 -72.98 0.5 Allowed 'General case' 0 C--N 1.296 -1.754 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.801 -175.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.429 ' O ' HG13 ' A' ' 12' ' ' VAL . 66.7 t -143.49 -63.71 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.2 -1.514 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -179.617 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.412 ' NE2' ' HG3' ' A' ' 11' ' ' GLN . 4.3 pm0 -64.38 -24.7 67.73 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.051 -177.352 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.523 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 23.4 mt-30 -79.01 -14.51 59.15 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.429 HG13 ' O ' ' A' ' 9' ' ' VAL . 1.8 p -73.12 -26.19 22.58 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 CA-C-O 121.666 0.746 . . . . 0.0 109.688 179.445 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.424 ' HA ' HD13 ' A' ' 16' ' ' LEU . 1.5 m -71.62 -26.4 62.56 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.538 -174.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . 0.523 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 78.5 m-70 -61.72 -34.48 75.87 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.194 0.521 . . . . 0.0 110.348 -178.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.492 ' O ' HD21 ' A' ' 19' ' ' LEU . 40.3 t90 -68.05 -61.44 1.86 Allowed 'General case' 0 N--CA 1.433 -1.287 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 174.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.496 HD11 ' CG ' ' A' ' 28' ' ' PHE . 46.9 mt -45.43 -51.75 11.03 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.67 1.188 . . . . 0.0 112.676 -177.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 13' ' ' SER . 93.1 t -59.5 -31.51 46.84 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.261 -177.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.7 -35.9 86.57 Favored Glycine 0 N--CA 1.438 -1.229 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.342 -176.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.492 HD21 ' O ' ' A' ' 15' ' ' TRP . 0.5 OUTLIER -100.19 20.54 14.43 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 121.297 -0.161 . . . . 0.0 111.414 -179.214 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.5 m 68.43 20.3 8.58 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-O 121.638 0.732 . . . . 0.0 111.679 178.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.437 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -102.33 20.91 16.0 Favored 'General case' 0 C--N 1.294 -1.828 0 C-N-CA 123.961 0.904 . . . . 0.0 110.15 -178.745 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -52.8 -24.33 8.7 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.533 0.733 . . . . 0.0 110.964 174.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -60.68 -25.14 66.15 Favored 'General case' 0 C--N 1.301 -1.502 0 C-N-CA 125.338 1.455 . . . . 0.0 111.692 176.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.535 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 3.9 m-85 -89.17 -20.24 24.47 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 88.5 t -54.15 -38.58 39.13 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 O-C-N 123.553 0.533 . . . . 0.0 111.95 -179.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.2 m -52.1 -37.25 53.42 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.505 0.722 . . . . 0.0 112.324 -177.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 12.9 tp10 -105.18 -30.11 9.91 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.431 -178.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.496 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.4 m-85 -54.74 -42.97 72.26 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.177 0.513 . . . . 0.0 110.894 177.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.9 m -73.57 -25.17 60.24 Favored 'General case' 0 N--CA 1.435 -1.221 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.531 -179.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -76.22 -33.39 59.22 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.482 -175.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -95.95 7.27 46.83 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 119.825 -0.75 . . . . 0.0 110.073 -179.093 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 60.29 37.11 20.55 Favored 'General case' 0 CA--C 1.505 -0.752 0 O-C-N 123.861 0.726 . . . . 0.0 109.569 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 50.0 mm -68.5 113.62 4.47 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 179.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.502 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 99.0 p -104.74 -170.74 1.81 Allowed 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 178.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.494 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.47 -28.26 70.89 Favored Glycine 0 C--O 1.224 -0.522 0 N-CA-C 110.895 -0.882 . . . . 0.0 110.895 179.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -54.64 -44.89 73.59 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 125.027 1.331 . . . . 0.0 110.282 177.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.78 -1.07 50.48 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.9 tt -84.07 -43.03 15.49 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 9.4 mt -58.82 -40.43 84.1 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.542 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -100.96 18.25 20.14 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -175.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.443 HD23 ' HD3' ' A' ' 45' ' ' LYS . 40.5 mt -53.74 146.67 13.12 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 178.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -153.08 172.33 17.04 Favored 'General case' 0 C--N 1.297 -1.674 0 N-CA-C 106.592 -1.632 . . . . 0.0 106.592 178.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -57.64 -30.92 62.99 Favored Glycine 0 CA--C 1.481 -2.076 0 N-CA-C 111.29 -0.724 . . . . 0.0 111.29 177.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -53.36 -47.44 69.41 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.443 ' HD3' HD23 ' A' ' 41' ' ' LEU . 14.5 mtpp -72.73 -43.96 62.3 Favored 'General case' 0 C--O 1.186 -2.255 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.378 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 91.8 mt -55.55 -37.55 68.14 Favored 'General case' 0 N--CA 1.485 1.317 0 CA-C-O 122.142 0.972 . . . . 0.0 110.835 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.487 ' HA ' HG21 ' A' ' 52' ' ' THR . 41.4 mttm -71.49 -38.73 71.16 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 114.867 -1.061 . . . . 0.0 111.106 175.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.51 -13.04 60.35 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.475 0.655 . . . . 0.0 111.357 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.459 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.0 mm? -84.09 -1.78 55.54 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 174.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 69.84 6.57 56.43 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 115.516 -0.765 . . . . 0.0 114.956 174.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.535 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 13.5 tpt -85.34 -50.92 6.93 Favored 'General case' 0 CA--C 1.494 -1.183 0 C-N-CA 118.708 -1.197 . . . . 0.0 108.007 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.487 HG21 ' HA ' ' A' ' 47' ' ' LYS . 68.5 p 54.07 28.94 9.46 Favored 'General case' 0 C--O 1.25 1.091 0 C-N-CA 125.007 1.323 . . . . 0.0 113.252 170.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.552 ' HB2' ' OD1' ' A' ' 56' ' ' ASP . 58.5 m -72.99 -166.43 0.3 Allowed 'General case' 0 N--CA 1.425 -1.695 0 C-N-CA 123.228 0.611 . . . . 0.0 112.158 -176.626 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.0 t -117.93 -38.57 3.22 Favored 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 121.802 -0.561 . . . . 0.0 111.13 -177.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -72.94 -32.43 65.25 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-O 121.312 0.577 . . . . 0.0 110.99 -175.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.675 ' O ' HG13 ' A' ' 60' ' ' VAL . 10.4 p-10 -70.85 -40.31 72.43 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 -176.511 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.9 mmm180 -57.98 -14.7 6.93 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 125.161 1.384 . . . . 0.0 112.203 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -106.02 -38.39 6.33 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.396 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.407 HD13 ' HE2' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -75.3 -63.09 1.35 Allowed 'General case' 0 C--O 1.243 0.745 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.467 -176.17 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.675 HG13 ' O ' ' A' ' 56' ' ' ASP . 11.8 p -62.98 -24.39 35.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 122.083 0.944 . . . . 0.0 109.977 -174.204 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 51.8 tptt -68.87 -28.24 66.53 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 113.893 -1.503 . . . . 0.0 110.088 -175.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -89.98 -32.79 16.63 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.508 179.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.407 ' HE2' HD13 ' A' ' 59' ' ' LEU . 0.5 OUTLIER -75.11 -39.89 60.32 Favored 'General case' 0 C--N 1.294 -1.843 0 CA-C-N 114.95 -1.023 . . . . 0.0 112.049 -177.06 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.1 pp -65.41 -28.31 69.16 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.184 0.516 . . . . 0.0 110.977 -176.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -83.81 -10.76 57.83 Favored 'General case' 0 C--N 1.316 -0.885 0 C-N-CA 120.665 -0.414 . . . . 0.0 111.894 -178.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 . . . . . 0 CA--C 1.489 -1.384 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 179.645 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.52 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 4.4 m . . . . . 0 CA--C 1.509 -0.632 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -67.79 -17.93 64.69 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 120.977 0.418 . . . . 0.0 110.775 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -91.6 -12.36 34.52 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 123.224 0.61 . . . . 0.0 110.117 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.475 ' O ' ' HB2' ' A' ' 34' ' ' SER . 51.4 m0 -65.84 140.17 58.36 Favored 'General case' 0 CA--C 1.494 -1.206 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.33 -178.279 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.52 -89.28 0.16 Allowed 'General case' 0 N--CA 1.412 -2.333 0 CA-C-N 114.992 -1.004 . . . . 0.0 111.501 -178.275 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.525 ' O ' HG13 ' A' ' 12' ' ' VAL . 91.9 t -137.36 -59.88 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.284 -2.254 0 CA-C-N 114.2 -1.364 . . . . 0.0 108.145 -177.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -71.85 -14.73 62.04 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-O 121.246 0.546 . . . . 0.0 111.697 -178.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.533 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 47.2 mt-30 -78.68 -22.67 46.41 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.109 176.609 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.525 HG13 ' O ' ' A' ' 9' ' ' VAL . 1.4 p -75.28 -27.02 19.11 Favored 'Isoleucine or valine' 0 C--O 1.244 0.781 0 CA-C-O 121.761 0.791 . . . . 0.0 109.029 -177.277 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.2 -29.21 67.13 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 114.823 -1.08 . . . . 0.0 110.574 -178.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . 0.533 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 67.4 m-70 -60.19 -36.38 77.5 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.508 ' O ' HD21 ' A' ' 19' ' ' LEU . 37.6 t90 -69.41 -61.21 1.88 Allowed 'General case' 0 N--CA 1.426 -1.632 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.564 176.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.412 HD12 ' CD2' ' A' ' 28' ' ' PHE . 32.6 mt -47.53 -50.9 22.45 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.137 0.975 . . . . 0.0 112.466 -176.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.5 t -60.85 -28.74 43.89 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 C-N-CA 122.311 0.244 . . . . 0.0 111.092 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -72.37 -23.16 78.4 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 116.177 -0.465 . . . . 0.0 112.147 -176.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.508 HD21 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -110.55 19.59 18.56 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 121.009 -0.276 . . . . 0.0 110.933 176.623 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.4 m 66.81 24.42 9.83 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.384 0.673 . . . . 0.0 112.139 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.474 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -99.72 19.81 15.25 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 124.978 1.311 . . . . 0.0 108.836 -179.02 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -52.6 -28.41 21.05 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 124.228 1.011 . . . . 0.0 111.773 176.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.474 ' NE2' ' HA ' ' A' ' 21' ' ' LEU . 0.4 OUTLIER -70.23 -14.67 62.72 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 120.071 -0.652 . . . . 0.0 112.468 177.901 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.414 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 2.3 m-85 -88.53 -20.69 24.76 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.114 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 96.8 t -58.0 -34.19 48.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.344 178.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.7 m -48.41 -42.11 31.11 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.701 1.2 . . . . 0.0 111.457 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 10.9 tp10 -106.52 -29.62 9.56 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.569 -177.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.412 ' CD2' HD12 ' A' ' 16' ' ' LEU . 1.9 m-85 -55.0 -42.2 72.23 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-O 121.524 0.678 . . . . 0.0 110.316 176.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.7 t -71.96 -24.68 61.64 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.158 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -80.13 -31.37 39.09 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.531 -174.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -99.1 3.47 46.68 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 119.734 -0.787 . . . . 0.0 110.266 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 60.46 41.37 15.98 Favored 'General case' 0 C--O 1.243 0.743 0 O-C-N 123.881 0.738 . . . . 0.0 109.398 -179.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 42.7 mm -70.4 108.79 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.097 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.475 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 80.7 p -100.57 -170.43 1.86 Allowed 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 108.496 -0.928 . . . . 0.0 108.496 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.52 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -61.49 -27.05 67.3 Favored Glycine 0 N--CA 1.448 -0.552 0 N-CA-C 111.468 -0.653 . . . . 0.0 111.468 178.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -56.27 -43.94 79.27 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 124.548 1.139 . . . . 0.0 109.598 177.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.63 -5.5 35.29 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.427 -179.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.418 HD13 HG23 ' A' ' 12' ' ' VAL . 3.4 tt -78.78 -49.65 12.65 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 124.368 1.067 . . . . 0.0 108.86 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 54.7 mt -59.54 -35.83 74.96 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.698 -178.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.6 pp0? -97.01 11.77 34.92 Favored 'General case' 0 C--N 1.297 -1.699 0 CA-C-N 115.348 -0.842 . . . . 0.0 112.955 -176.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.3 mt -54.64 154.96 4.46 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 178.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -157.73 168.91 25.89 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 -178.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.81 -36.96 67.49 Favored Glycine 0 CA--C 1.496 -1.124 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -54.47 -46.57 73.4 Favored 'General case' 0 CA--C 1.5 -0.973 0 C-N-CA 122.965 0.506 . . . . 0.0 111.988 178.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 11.8 mtpp -66.48 -45.78 78.49 Favored 'General case' 0 C--O 1.195 -1.791 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.993 175.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 82.2 mt -59.6 -24.98 64.25 Favored 'General case' 0 C--O 1.254 1.319 0 C-N-CA 123.192 0.597 . . . . 0.0 111.954 -178.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.48 ' HA ' HG22 ' A' ' 52' ' ' THR . 23.4 mtpp -81.19 -31.2 34.1 Favored 'General case' 0 N--CA 1.437 -1.105 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.391 176.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.28 -4.73 57.74 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 123.253 0.621 . . . . 0.0 111.205 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.455 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.5 mm? -85.01 -3.89 58.95 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 173.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.18 -8.13 7.07 Favored Glycine 0 C--N 1.333 0.369 0 CA-C-N 115.708 -0.678 . . . . 0.0 113.842 176.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.467 ' HA ' ' HE1' ' A' ' 51' ' ' MET . 4.9 tpt -77.69 -48.28 17.12 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.48 HG22 ' HA ' ' A' ' 47' ' ' LYS . 67.9 p 52.3 26.31 3.96 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.323 1.449 . . . . 0.0 113.1 174.55 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.437 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 45.2 t -66.66 117.5 8.91 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 120.909 0.385 . . . . 0.0 110.994 -175.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.1 m -61.6 -39.18 90.28 Favored 'General case' 0 C--O 1.248 1.008 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.262 -176.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -68.37 -45.31 73.1 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.145 179.241 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.571 ' O ' HG11 ' A' ' 60' ' ' VAL . 36.5 m-20 -71.18 -40.46 71.22 Favored 'General case' 0 CA--C 1.487 -1.462 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.488 -177.196 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.443 ' HA ' HG11 ' A' ' 60' ' ' VAL . 31.0 mtm180 -60.72 -31.44 70.74 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -78.46 -2.56 39.12 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.138 0.494 . . . . 0.0 110.88 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.427 HD11 ' HZ2' ' A' ' 63' ' ' LYS . 40.5 tp -115.64 -47.99 2.79 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 120.96 0.409 . . . . 0.0 110.968 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.571 HG11 ' O ' ' A' ' 56' ' ' ASP . 5.2 p -60.4 -27.23 39.4 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.209 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.817 178.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -68.16 -36.45 79.65 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 122.005 0.907 . . . . 0.0 109.269 -175.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.409 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 23.8 ttmm -77.99 -41.81 34.72 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 113.724 -1.58 . . . . 0.0 108.776 -177.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.462 ' CB ' HD11 ' A' ' 19' ' ' LEU . 0.5 OUTLIER -69.67 -41.97 74.79 Favored 'General case' 0 C--O 1.186 -2.266 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.61 -177.65 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.2 pp -65.63 -30.88 71.65 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 120.828 0.347 . . . . 0.0 111.411 -176.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -81.79 -18.91 42.43 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.162 -0.615 . . . . 0.0 111.307 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 11.6 pt-20 . . . . . 0 C--O 1.212 -0.883 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.356 177.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.588 HG13 ' CH2' ' A' ' 7' ' ' TRP . 9.4 m . . . . . 0 C--O 1.219 -0.523 0 CA-C-O 121.133 0.492 . . . . 0.0 112.316 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.1 p-80 -70.91 -9.59 58.06 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.382 -177.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -102.73 -0.82 31.04 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.487 179.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.588 ' CH2' HG13 ' A' ' 4' ' ' VAL . 54.5 m0 -79.5 149.82 31.37 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.098 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.9 m -102.1 -79.49 0.52 Allowed 'General case' 0 N--CA 1.419 -2.023 0 O-C-N 123.469 0.481 . . . . 0.0 109.779 -177.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.472 ' O ' HG11 ' A' ' 12' ' ' VAL . 57.9 t -139.38 -60.46 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.3 5.19 5.9 Favored 'General case' 0 C--O 1.215 -0.76 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -176.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.483 HE21 ' HA ' ' A' ' 7' ' ' TRP . 25.9 mt-30 -103.62 -13.08 16.66 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.602 175.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.472 HG11 ' O ' ' A' ' 9' ' ' VAL . 2.4 p -81.08 -24.46 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 CA-C-O 121.811 0.815 . . . . 0.0 109.406 -179.186 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.471 ' HB3' ' CG1' ' A' ' 25' ' ' VAL . 0.3 OUTLIER -67.61 -36.15 80.3 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.449 -178.557 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 80.9 m-70 -57.77 -32.15 67.21 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.084 0.469 . . . . 0.0 110.486 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.511 ' O ' HD22 ' A' ' 19' ' ' LEU . 30.2 t90 -72.83 -60.97 1.98 Allowed 'General case' 0 N--CA 1.426 -1.658 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.202 174.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.574 HD11 ' CD2' ' A' ' 28' ' ' PHE . 44.2 mt -47.04 -51.96 16.14 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.132 0.973 . . . . 0.0 112.656 -177.431 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.408 HG21 ' O ' ' A' ' 13' ' ' SER . 77.4 t -61.69 -24.75 34.95 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 C-N-CA 122.896 0.478 . . . . 0.0 111.0 -177.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.11 -34.92 54.49 Favored Glycine 0 N--CA 1.436 -1.31 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 -177.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.511 HD22 ' O ' ' A' ' 15' ' ' TRP . 1.2 pt? -97.83 16.03 22.0 Favored 'General case' 0 C--O 1.214 -0.802 0 C-N-CA 121.071 -0.252 . . . . 0.0 111.107 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.0 m 73.81 14.49 4.09 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.146 0.978 . . . . 0.0 112.156 178.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -93.16 21.97 5.47 Favored 'General case' 0 C--N 1.292 -1.895 0 C-N-CA 124.55 1.14 . . . . 0.0 108.928 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -51.75 -32.82 32.29 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 124.165 0.986 . . . . 0.0 110.554 174.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -63.12 -22.71 67.05 Favored 'General case' 0 CA--C 1.548 0.88 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.757 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -86.84 -22.37 25.84 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.76 -178.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.471 ' CG1' ' HB3' ' A' ' 13' ' ' SER . 35.0 t -57.8 -34.06 47.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 O-C-N 123.101 0.25 . . . . 0.0 110.518 179.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.1 t -51.0 -35.56 34.59 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.995 0.918 . . . . 0.0 111.487 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 19.2 tp10 -108.15 -32.43 7.52 Favored 'General case' 0 N--CA 1.432 -1.346 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.916 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.574 ' CD2' HD11 ' A' ' 16' ' ' LEU . 2.1 m-85 -53.95 -40.34 66.72 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-O 121.214 0.53 . . . . 0.0 110.793 175.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 33.7 t -73.23 -25.56 60.79 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.594 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.56 -34.1 53.87 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 121.965 -0.459 . . . . 0.0 110.909 -175.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -95.63 -3.29 46.53 Favored 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 120.397 -0.521 . . . . 0.0 109.98 -178.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.1 m-80 62.85 45.08 5.82 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 121.799 0.809 . . . . 0.0 109.139 -178.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.4 mm -68.87 110.29 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.195 0 CA-C-N 114.358 -1.292 . . . . 0.0 108.638 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 89.8 p -102.53 -169.26 1.64 Allowed 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.565 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -63.49 -22.46 65.76 Favored Glycine 0 N--CA 1.439 -1.117 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.955 177.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -59.29 -42.46 91.36 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 177.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.52 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -93.93 -22.29 18.69 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.813 -179.415 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.429 HD12 HG23 ' A' ' 12' ' ' VAL . 3.0 tt -62.51 -50.41 71.49 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 124.587 1.155 . . . . 0.0 109.65 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 67.8 mt -64.14 -38.51 91.31 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.235 -0.438 . . . . 0.0 112.128 -177.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -96.23 11.05 35.9 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -177.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 37' ' ' GLN . 29.0 mt -50.5 136.61 20.62 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 122.322 1.058 . . . . 0.0 113.444 178.507 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -137.5 165.56 25.99 Favored 'General case' 0 C--N 1.285 -2.231 0 N-CA-C 107.34 -1.355 . . . . 0.0 107.34 -179.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -53.46 -39.46 59.87 Favored Glycine 0 C--O 1.212 -1.232 0 O-C-N 123.732 0.645 . . . . 0.0 111.774 178.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -53.01 -44.72 67.51 Favored 'General case' 0 CA--C 1.496 -1.111 0 C-N-CA 122.669 0.387 . . . . 0.0 111.23 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 11.4 mtpp -67.83 -50.05 58.81 Favored 'General case' 0 C--O 1.201 -1.48 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.664 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.8 mt -56.88 -31.12 64.53 Favored 'General case' 0 C--O 1.256 1.441 0 C-N-CA 123.645 0.778 . . . . 0.0 112.072 -177.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.497 ' HA ' HG21 ' A' ' 52' ' ' THR . 57.0 mtpt -80.08 -37.81 33.02 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.981 178.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.85 -15.4 62.64 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 122.99 0.516 . . . . 0.0 111.218 178.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.424 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.3 mm? -72.47 -4.78 32.39 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.245 0.618 . . . . 0.0 110.143 173.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 71.02 20.28 77.75 Favored Glycine 0 CA--C 1.501 -0.815 0 CA-C-N 116.416 -0.356 . . . . 0.0 112.524 177.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 23.2 mmt -105.71 -63.81 1.21 Allowed 'General case' 0 C--N 1.304 -1.389 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.795 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.497 HG21 ' HA ' ' A' ' 47' ' ' LYS . 20.2 p 64.15 13.33 7.75 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.697 1.599 . . . . 0.0 113.301 173.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.6 m -58.92 122.48 13.75 Favored 'General case' 0 N--CA 1.433 -1.314 0 C-N-CA 123.914 0.886 . . . . 0.0 111.143 -176.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.8 m -55.53 -35.13 65.33 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 -174.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -79.87 -33.7 39.85 Favored 'General case' 0 CA--C 1.497 -1.064 0 C-N-CA 119.255 -0.978 . . . . 0.0 111.207 -178.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.688 ' O ' HG11 ' A' ' 60' ' ' VAL . 1.7 m-20 -68.35 -44.9 74.25 Favored 'General case' 0 CA--C 1.477 -1.828 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -50.21 -29.4 9.33 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 124.75 1.22 . . . . 0.0 113.168 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -98.0 -37.5 9.75 Favored 'General case' 0 C--N 1.307 -1.279 0 O-C-N 123.578 0.549 . . . . 0.0 111.134 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 43.0 tp -74.4 -51.54 14.69 Favored 'General case' 0 C--O 1.243 0.715 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -175.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.688 HG11 ' O ' ' A' ' 56' ' ' ASP . 10.7 p -62.51 -24.62 35.78 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.986 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -179.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.418 ' HA ' ' CD2' ' A' ' 64' ' ' LEU . 56.5 tptt -73.57 -27.07 61.13 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.971 -1.468 . . . . 0.0 110.054 -173.394 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -88.41 -37.03 16.2 Favored 'General case' 0 C--N 1.291 -1.937 0 CA-C-N 114.956 -1.02 . . . . 0.0 108.834 178.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.423 ' HE3' ' CB ' ' A' ' 19' ' ' LEU . 2.6 tppt? -69.33 -41.33 76.8 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.165 -177.314 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.471 HD21 ' HB2' ' A' ' 41' ' ' LEU . 4.1 pp -64.42 -30.93 71.96 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 122.919 0.488 . . . . 0.0 112.263 -177.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -82.44 -27.24 32.06 Favored 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 119.784 -0.766 . . . . 0.0 111.642 -178.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 . . . . . 0 C--N 1.317 -0.838 0 C-N-CA 120.529 -0.468 . . . . 0.0 109.826 178.422 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.458 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 4.2 m . . . . . 0 CA--C 1.509 -0.627 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 9.3 p-80 -71.44 -9.8 58.75 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.527 0.68 . . . . 0.0 110.444 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -93.09 -10.3 36.49 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.94 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.403 ' CH2' HG12 ' A' ' 4' ' ' VAL . 54.8 m0 -80.98 146.94 30.45 Favored 'General case' 0 CA--C 1.498 -1.045 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 -179.274 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 70.2 m -104.62 -73.83 0.66 Allowed 'General case' 0 N--CA 1.413 -2.289 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.475 ' O ' HG13 ' A' ' 12' ' ' VAL . 55.6 t -140.79 -50.31 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.096 0 CA-C-O 121.918 0.866 . . . . 0.0 110.497 -174.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -75.61 -21.74 57.5 Favored 'General case' 0 C--N 1.282 -2.336 0 CA-C-N 114.503 -1.226 . . . . 0.0 111.348 -177.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.47 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 27.1 mt-30 -91.94 -11.42 36.27 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -176.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.475 HG13 ' O ' ' A' ' 9' ' ' VAL . 3.8 p -74.36 -25.83 19.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 CA-C-O 122.026 0.917 . . . . 0.0 108.545 178.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.404 ' HA ' HD12 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -69.76 -28.95 66.19 Favored 'General case' 0 N--CA 1.427 -1.583 0 CA-C-N 114.505 -1.225 . . . . 0.0 111.519 -176.139 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . 0.47 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 37.8 m-70 -63.61 -32.51 74.0 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.946 0.403 . . . . 0.0 110.15 -177.403 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.489 ' O ' HD23 ' A' ' 19' ' ' LEU . 27.5 t90 -69.41 -58.49 3.93 Favored 'General case' 0 N--CA 1.436 -1.147 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.46 175.317 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.467 HD13 ' CG ' ' A' ' 28' ' ' PHE . 48.3 mt -46.84 -50.39 18.57 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.307 1.043 . . . . 0.0 112.539 -177.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.0 t -60.2 -30.19 45.46 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.1 0 CA-C-O 120.822 0.344 . . . . 0.0 111.135 -178.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.01 -27.04 74.27 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 116.027 -0.533 . . . . 0.0 112.148 -176.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.489 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -107.28 15.93 24.52 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 178.845 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.5 m 70.64 25.62 4.09 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-O 121.694 0.759 . . . . 0.0 111.589 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.407 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.2 mm? -102.74 19.46 19.17 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 124.828 1.251 . . . . 0.0 110.516 -179.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -51.92 -30.6 25.03 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.214 0.531 . . . . 0.0 111.243 175.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -58.74 -23.13 59.36 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.87 0.868 . . . . 0.0 111.84 177.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -88.45 -22.98 23.4 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 94.8 t -54.44 -36.39 34.29 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 CA-C-O 120.885 0.374 . . . . 0.0 110.889 -178.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 22.7 t -46.62 -40.98 13.93 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.585 1.554 . . . . 0.0 111.649 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 39.2 tp10 -108.17 -28.93 9.2 Favored 'General case' 0 N--CA 1.438 -1.027 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.676 -179.024 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.467 ' CG ' HD13 ' A' ' 16' ' ' LEU . 1.1 m-85 -54.39 -46.1 73.02 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-O 121.432 0.634 . . . . 0.0 110.775 177.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 41.3 m -83.43 -6.33 59.43 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.038 -178.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.93 -37.14 20.89 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -91.4 0.79 57.46 Favored 'General case' 0 CA--C 1.506 -0.725 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.223 -178.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 66.17 38.64 4.57 Favored 'General case' 0 CA--C 1.512 -0.507 0 O-C-N 124.059 0.849 . . . . 0.0 109.731 -178.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.3 mm -67.75 116.06 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 178.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 90.8 p -105.94 -166.71 1.23 Allowed 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.458 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -63.35 -25.02 68.06 Favored Glycine 0 N--CA 1.439 -1.154 0 N-CA-C 110.956 -0.858 . . . . 0.0 110.956 177.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -56.65 -45.98 81.3 Favored 'General case' 0 CA--C 1.508 -0.635 0 C-N-CA 123.474 0.71 . . . . 0.0 109.786 177.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.555 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -92.61 -14.85 27.62 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.925 -177.485 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.7 tt -69.2 -50.41 47.65 Favored 'General case' 0 C--N 1.311 -1.076 0 O-C-N 123.955 0.784 . . . . 0.0 109.092 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 37.8 mt -63.92 -42.71 97.32 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.454 -177.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -91.8 14.97 13.9 Favored 'General case' 0 CA--C 1.564 1.519 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -176.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 37' ' ' GLN . 35.4 mt -57.01 158.42 4.98 Favored 'General case' 0 C--O 1.246 0.909 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 176.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.41 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 3.1 p-10 -165.4 -178.67 5.1 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 177.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.81 -41.28 83.09 Favored Glycine 0 C--O 1.214 -1.154 0 CA-C-O 119.256 -0.747 . . . . 0.0 113.464 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -55.63 -46.09 77.47 Favored 'General case' 0 CA--C 1.485 -1.521 0 CA-C-N 117.355 0.578 . . . . 0.0 111.376 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.449 ' O ' HD21 ' A' ' 49' ' ' LEU . 14.5 mtpp -66.12 -45.67 80.27 Favored 'General case' 0 C--O 1.198 -1.652 0 O-C-N 123.522 0.514 . . . . 0.0 110.724 177.2 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 92.2 mt -60.85 -24.1 65.64 Favored 'General case' 0 C--O 1.258 1.548 0 CA-C-O 121.391 0.615 . . . . 0.0 111.601 -178.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.471 ' HA ' HG21 ' A' ' 52' ' ' THR . 58.1 mtpt -85.16 -39.54 17.75 Favored 'General case' 0 N--CA 1.433 -1.285 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.044 176.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.23 -14.15 61.28 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.744 0.783 . . . . 0.0 110.956 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.539 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 3.6 mm? -75.74 3.27 10.13 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.296 172.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 63.75 19.22 62.71 Favored Glycine 0 C--N 1.342 0.891 0 CA-C-O 121.283 0.38 . . . . 0.0 112.506 177.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 23.1 mmt -103.57 -63.1 1.22 Allowed 'General case' 0 N--CA 1.421 -1.921 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -176.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.471 HG21 ' HA ' ' A' ' 47' ' ' LYS . 29.5 p 57.64 22.25 8.09 Favored 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 124.447 1.099 . . . . 0.0 112.24 176.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 35.6 t -61.08 118.74 7.17 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 124.47 1.108 . . . . 0.0 111.248 -174.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.9 m -53.29 -41.24 65.41 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 124.414 1.086 . . . . 0.0 113.609 -176.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -65.77 -51.91 55.29 Favored 'General case' 0 CA--C 1.5 -0.945 0 CA-C-O 122.295 1.045 . . . . 0.0 109.922 177.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.64 ' O ' HG11 ' A' ' 60' ' ' VAL . 63.7 m-20 -66.66 -35.92 81.32 Favored 'General case' 0 N--CA 1.419 -2.013 0 CA-C-N 113.734 -1.575 . . . . 0.0 111.364 -170.703 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.7 mmm180 -58.53 -14.68 8.6 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 175.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -107.56 -35.57 6.7 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-O 120.656 0.265 . . . . 0.0 110.965 174.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 48.8 tp -81.14 -57.57 3.45 Favored 'General case' 0 C--O 1.241 0.612 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -176.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.64 HG11 ' O ' ' A' ' 56' ' ' ASP . 7.7 p -61.31 -21.03 23.94 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.801 0 CA-C-O 121.535 0.683 . . . . 0.0 110.31 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -70.22 -26.17 63.74 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.579 -179.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.468 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 51.5 tttp -86.98 -40.58 14.63 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 114.939 -1.028 . . . . 0.0 108.828 178.095 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.464 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.6 OUTLIER -69.76 -43.63 71.83 Favored 'General case' 0 C--O 1.19 -2.065 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.801 -175.054 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.418 HD22 ' CB ' ' A' ' 41' ' ' LEU . 3.7 pp -61.58 -30.03 70.41 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.028 0.442 . . . . 0.0 111.805 -175.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 53.7 pttt -84.98 -18.97 32.85 Favored 'General case' 0 C--N 1.315 -0.93 0 C-N-CA 119.675 -0.81 . . . . 0.0 112.504 -178.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 12.0 pt-20 . . . . . 0 C--N 1.307 -1.26 0 CA-C-O 121.169 0.509 . . . . 0.0 111.116 178.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.557 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.5 m . . . . . 0 C--O 1.215 -0.745 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -72.89 -4.54 32.57 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-O 121.445 0.64 . . . . 0.0 110.828 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -103.36 -2.47 26.98 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.291 178.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.55 ' HA ' HE21 ' A' ' 11' ' ' GLN . 53.2 m0 -83.19 136.99 34.22 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.327 -177.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.7 m -90.69 -72.88 0.55 Allowed 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.899 -176.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.44 ' O ' HG11 ' A' ' 12' ' ' VAL . 79.4 t -143.56 -65.91 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.199 -1.564 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 -179.476 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 -66.91 -17.92 65.13 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.153 0.501 . . . . 0.0 112.349 -175.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.55 HE21 ' HA ' ' A' ' 7' ' ' TRP . 27.1 mt-30 -81.05 -17.75 49.09 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.98 178.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.483 ' HA ' ' CE3' ' A' ' 7' ' ' TRP . 2.2 p -69.45 -24.95 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-O 121.912 0.863 . . . . 0.0 109.47 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.58 -23.87 62.67 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-N 114.609 -1.178 . . . . 0.0 111.449 -176.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 51.5 m-70 -62.19 -39.19 91.89 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 110.285 -0.265 . . . . 0.0 110.285 -178.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.511 ' O ' HD23 ' A' ' 19' ' ' LEU . 32.6 t90 -67.91 -58.29 4.8 Favored 'General case' 0 N--CA 1.44 -0.94 0 O-C-N 123.816 0.697 . . . . 0.0 109.827 176.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.523 HD12 ' CD2' ' A' ' 28' ' ' PHE . 43.9 mt -47.1 -50.17 20.48 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.141 0.976 . . . . 0.0 112.511 -177.369 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 86.1 t -61.5 -26.38 39.36 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.076 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.463 -178.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.76 -26.09 68.06 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 116.33 -0.396 . . . . 0.0 112.197 -177.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.511 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -105.6 13.68 29.59 Favored 'General case' 0 C--N 1.321 -0.666 0 O-C-N 122.405 -0.467 . . . . 0.0 111.349 177.89 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.6 m 70.74 21.45 5.24 Favored 'General case' 0 C--O 1.211 -0.94 0 CA-C-O 121.866 0.841 . . . . 0.0 111.611 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.413 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.9 mm? -98.52 19.8 13.91 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.984 178.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -53.04 -25.76 13.51 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.829 0.852 . . . . 0.0 111.163 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -69.63 -18.77 63.62 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 123.504 0.722 . . . . 0.0 110.723 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -85.92 -22.06 27.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.526 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 89.3 t -54.49 -37.98 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 O-C-N 123.633 0.583 . . . . 0.0 111.132 -179.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.3 m -52.31 -33.09 40.76 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.077 0.951 . . . . 0.0 112.296 -177.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 53.3 tp10 -111.63 -27.69 8.44 Favored 'General case' 0 N--CA 1.444 -0.732 0 O-C-N 122.358 -0.214 . . . . 0.0 110.802 179.122 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.523 ' CD2' HD12 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -56.68 -42.29 78.79 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 121.677 0.751 . . . . 0.0 109.884 175.138 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 31.0 t -73.73 -21.56 60.17 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.709 -1.132 . . . . 0.0 109.605 -179.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.54 -39.79 24.1 Favored 'General case' 0 N--CA 1.436 -1.132 0 O-C-N 121.905 -0.497 . . . . 0.0 110.907 -176.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -87.36 2.51 50.15 Favored 'General case' 0 CA--C 1.501 -0.94 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.182 -177.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 65.07 34.94 8.34 Favored 'General case' 0 CA--C 1.501 -0.922 0 O-C-N 124.322 1.014 . . . . 0.0 109.713 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.8 mm -66.32 112.41 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.529 0 CA-C-N 114.7 -1.136 . . . . 0.0 108.244 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.463 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 97.5 p -103.46 -170.33 1.77 Allowed 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 178.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.557 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.43 -30.04 75.15 Favored Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -51.7 -48.0 63.69 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 123.986 0.914 . . . . 0.0 110.02 175.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.09 -22.51 25.36 Favored 'General case' 0 CA--C 1.502 -0.894 0 C-N-CA 120.49 -0.484 . . . . 0.0 111.786 -177.197 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.4 tt -61.33 -48.63 80.44 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 124.84 1.256 . . . . 0.0 109.272 178.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 35' ' ' GLY . 28.2 mt -65.89 -39.61 90.79 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.604 -178.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -95.55 22.17 7.38 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -177.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.435 HD21 ' HD3' ' A' ' 45' ' ' LYS . 59.7 mt -64.04 158.85 21.5 Favored 'General case' 0 C--O 1.247 0.923 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 176.025 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.468 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 2.8 p30 -164.52 178.28 7.5 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 175.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.51 -38.35 70.27 Favored Glycine 0 C--O 1.218 -0.883 0 O-C-N 123.764 0.665 . . . . 0.0 113.898 -177.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -59.89 -42.56 94.06 Favored 'General case' 0 CA--C 1.483 -1.603 0 CA-C-N 117.39 0.595 . . . . 0.0 111.325 -178.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.435 ' HD3' HD21 ' A' ' 41' ' ' LEU . 11.6 mtpp -66.45 -45.01 81.25 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.929 178.127 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 78.3 mt -61.1 -25.28 66.86 Favored 'General case' 0 C--O 1.256 1.419 0 CA-C-O 121.599 0.714 . . . . 0.0 110.966 -179.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.469 ' HA ' HG22 ' A' ' 52' ' ' THR . 7.3 mtpm? -82.63 -41.39 19.51 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 114.782 -1.099 . . . . 0.0 110.297 176.016 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.73 -13.44 62.29 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.462 0.705 . . . . 0.0 111.396 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.479 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 3.9 mm? -75.33 -2.36 27.98 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.52 172.289 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 70.65 16.06 73.82 Favored Glycine 0 C--N 1.342 0.864 0 CA-C-O 121.774 0.652 . . . . 0.0 111.598 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 97.7 mmm -100.97 -67.58 0.85 Allowed 'General case' 0 N--CA 1.423 -1.821 0 CA-C-N 114.782 -0.709 . . . . 0.0 110.002 -176.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.469 HG22 ' HA ' ' A' ' 47' ' ' LYS . 20.9 p 65.64 -3.41 0.71 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.863 1.665 . . . . 0.0 113.938 175.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.6 m -50.75 121.39 5.82 Favored 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 126.665 1.986 . . . . 0.0 112.427 -173.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.1 p -54.31 -48.77 70.96 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -173.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -56.05 -50.06 72.02 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-O 121.844 0.83 . . . . 0.0 109.832 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.692 ' O ' HG12 ' A' ' 60' ' ' VAL . 4.8 m-20 -63.39 -47.95 79.91 Favored 'General case' 0 CA--C 1.486 -1.485 0 CA-C-N 113.874 -1.512 . . . . 0.0 109.622 -176.114 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.457 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 39.1 mmm-85 -49.05 -38.49 24.09 Favored 'General case' 0 CA--C 1.506 -0.721 0 C-N-CA 124.587 1.155 . . . . 0.0 112.44 -179.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -83.11 -33.74 26.25 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-O 121.197 0.523 . . . . 0.0 111.402 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.402 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 45.9 tp -80.36 -51.08 9.29 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -174.689 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.692 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.4 p -64.25 -21.26 28.61 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.217 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 4.9 tppp? -69.28 -35.95 76.57 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.149 -178.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 59' ' ' LEU . 19.1 ptmt -90.2 -18.75 25.15 Favored 'General case' 0 N--CA 1.419 -1.99 0 CA-C-N 115.089 -0.96 . . . . 0.0 109.507 -176.057 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.4 ' CB ' HD13 ' A' ' 19' ' ' LEU . 1.8 tppt? -84.56 -38.79 19.55 Favored 'General case' 0 C--O 1.199 -1.588 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.035 177.166 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.6 pp -66.42 -14.55 62.33 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.619 0.368 . . . . 0.0 111.731 -176.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 59.4 pttt -90.03 -12.99 36.94 Favored 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.477 176.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 . . . . . 0 CA--C 1.509 -0.629 0 CA-C-O 123.041 1.4 . . . . 0.0 109.985 -176.544 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.477 HG13 ' CH2' ' A' ' 7' ' ' TRP . 6.8 m . . . . . 0 CA--C 1.506 -0.716 0 N-CA-C 112.311 0.485 . . . . 0.0 112.311 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.5 p-80 -71.67 -12.8 61.51 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-O 120.97 0.414 . . . . 0.0 110.801 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -91.03 -19.43 23.2 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.625 177.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.477 ' CH2' HG13 ' A' ' 4' ' ' VAL . 50.7 m0 -58.36 145.38 38.39 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -174.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.4 m -95.43 -80.36 0.42 Allowed 'General case' 0 N--CA 1.415 -2.184 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.465 -175.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.494 ' O ' HG11 ' A' ' 12' ' ' VAL . 73.8 t -146.03 -61.85 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.554 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 -178.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.5 pm0 -67.34 -17.69 64.85 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.542 -177.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -80.02 -17.68 52.16 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.402 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.494 HG11 ' O ' ' A' ' 9' ' ' VAL . 2.6 p -74.27 -21.86 17.78 Favored 'Isoleucine or valine' 0 C--O 1.245 0.847 0 CA-C-O 121.908 0.861 . . . . 0.0 109.096 -177.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.87 -26.58 64.26 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.957 -177.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 -62.47 -32.59 73.51 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.332 0.587 . . . . 0.0 109.7 -177.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.481 ' O ' HD21 ' A' ' 19' ' ' LEU . 28.4 t90 -74.24 -58.82 3.04 Favored 'General case' 0 N--CA 1.427 -1.591 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.473 175.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.446 HD11 ' CG ' ' A' ' 28' ' ' PHE . 38.8 mt -48.05 -48.85 32.97 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.261 1.024 . . . . 0.0 112.5 -176.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 77.2 t -60.5 -29.25 44.18 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 CA-C-O 120.769 0.319 . . . . 0.0 110.97 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -71.72 -22.2 78.74 Favored Glycine 0 N--CA 1.442 -0.952 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.406 -176.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.481 HD21 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -113.7 17.8 17.91 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 117.076 0.438 . . . . 0.0 111.716 177.791 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.5 m 68.84 20.82 7.87 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.699 0.8 . . . . 0.0 112.063 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.466 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.8 mm? -98.94 18.34 17.42 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.963 179.573 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.404 ' HA ' HG21 ' A' ' 25' ' ' VAL . 8.7 p-10 -52.34 -25.2 9.03 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.912 0.885 . . . . 0.0 111.216 175.284 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -64.47 -23.75 67.39 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 124.023 0.929 . . . . 0.0 111.373 178.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.486 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 3.0 m-85 -86.57 -20.79 27.43 Favored 'General case' 0 N--CA 1.437 -1.087 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.87 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.404 HG21 ' HA ' ' A' ' 22' ' ' ASP . 90.7 t -53.08 -40.87 39.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 C-N-CA 123.495 0.718 . . . . 0.0 111.404 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.9 m -53.7 -35.49 61.19 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.237 0.615 . . . . 0.0 112.163 -177.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.604 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 21.2 tp10 -103.7 -28.94 11.37 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.851 -179.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.446 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.9 m-85 -56.22 -32.99 64.94 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-O 121.851 0.834 . . . . 0.0 109.965 176.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.414 ' HA ' HG11 ' A' ' 9' ' ' VAL . 21.6 p -80.76 -31.73 35.79 Favored 'General case' 0 N--CA 1.423 -1.823 0 CA-C-N 114.809 -1.087 . . . . 0.0 111.722 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.36 -45.5 76.15 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-O 121.819 0.819 . . . . 0.0 110.441 -176.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -94.72 14.72 20.29 Favored 'General case' 0 C--N 1.299 -1.617 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.815 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . 0.285 4.3 p30 46.05 60.92 2.93 Favored 'General case' 0 CA--C 1.502 -0.892 0 CA-C-O 122.476 1.132 . . . . 0.0 113.429 177.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 49.5 mm -85.11 117.51 30.43 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.846 0 CA-C-N 113.86 -1.518 . . . . 0.0 107.024 176.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.6 p -106.59 -166.03 1.14 Allowed 'General case' 0 C--N 1.293 -1.861 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 177.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.472 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -64.15 -25.81 69.91 Favored Glycine 0 N--CA 1.441 -1.007 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 178.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -57.38 -45.21 84.7 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 123.693 0.797 . . . . 0.0 109.381 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.57 -3.22 43.42 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.539 -179.2 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.5 tt -81.85 -51.11 8.44 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 46.6 mt -61.08 -30.85 70.59 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.473 -176.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -103.09 13.63 33.7 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 37.8 mt -47.32 148.39 1.31 Allowed 'General case' 0 C--O 1.246 0.872 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.448 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 12.8 t70 -143.9 165.44 27.71 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 106.368 -1.716 . . . . 0.0 106.368 -175.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -57.28 -38.23 85.29 Favored Glycine 0 C--O 1.214 -1.143 0 N-CA-C 109.646 -1.382 . . . . 0.0 109.646 175.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -54.28 -47.98 71.75 Favored 'General case' 0 CA--C 1.495 -1.146 0 C-N-CA 123.806 0.843 . . . . 0.0 111.168 177.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.425 ' O ' HD22 ' A' ' 49' ' ' LEU . 14.2 mtpp -63.97 -46.64 83.71 Favored 'General case' 0 C--O 1.199 -1.555 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.531 177.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 83.4 mt -58.73 -25.49 63.02 Favored 'General case' 0 C--O 1.256 1.435 0 CA-C-O 121.604 0.716 . . . . 0.0 111.181 -179.272 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.474 ' HA ' HG23 ' A' ' 52' ' ' THR . 23.8 mtpp -83.43 -36.62 24.08 Favored 'General case' 0 N--CA 1.432 -1.357 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.467 176.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.34 -16.38 61.88 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.541 0.686 . . . . 0.0 111.127 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.604 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.6 mm? -73.68 -6.66 48.19 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.631 0.729 . . . . 0.0 109.094 172.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 69.87 4.52 48.16 Favored Glycine 0 CA--C 1.502 -0.779 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.512 177.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.591 ' HG3' ' OG ' ' A' ' 53' ' ' SER . 30.2 tpp -88.0 -51.16 5.97 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 -176.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.474 HG23 ' HA ' ' A' ' 47' ' ' LYS . 62.0 p 51.66 23.45 1.96 Allowed 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 125.257 1.423 . . . . 0.0 113.826 174.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.591 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 12.9 m -62.27 127.02 29.35 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 124.29 1.036 . . . . 0.0 111.939 -174.264 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.1 m -55.2 -51.25 67.15 Favored 'General case' 0 CA--C 1.553 1.079 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -172.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -58.33 -54.27 48.95 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 122.836 1.303 . . . . 0.0 109.634 178.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.702 ' O ' HG13 ' A' ' 60' ' ' VAL . 6.2 m-20 -59.57 -44.16 93.38 Favored 'General case' 0 C--N 1.282 -2.368 0 CA-C-N 112.279 -2.237 . . . . 0.0 111.026 -172.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.1 mmm180 -54.26 -23.17 13.88 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 177.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -100.18 -34.16 10.14 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.962 0.41 . . . . 0.0 110.78 176.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.407 HD13 ' HZ3' ' A' ' 63' ' ' LYS . 48.7 tp -77.22 -57.29 3.92 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -176.35 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.702 HG13 ' O ' ' A' ' 56' ' ' ASP . 4.8 p -60.15 -21.01 21.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 CA-C-O 121.729 0.776 . . . . 0.0 110.628 -179.292 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 15.1 tppt? -65.62 -35.03 79.62 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 114.296 -1.32 . . . . 0.0 109.846 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -91.68 -30.25 16.41 Favored 'General case' 0 C--N 1.292 -1.897 0 CA-C-N 114.788 -1.097 . . . . 0.0 109.989 -177.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.41 ' HG2' HD13 ' A' ' 19' ' ' LEU . 2.8 tppt? -72.08 -40.73 68.03 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 115.067 -0.969 . . . . 0.0 111.29 -178.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 pp -59.2 -30.09 67.97 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.884 0.373 . . . . 0.0 111.677 -176.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -82.63 -22.27 34.78 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 120.37 -0.532 . . . . 0.0 111.901 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 . . . . . 0 C--O 1.24 0.577 0 CA-C-O 121.062 0.458 . . . . 0.0 110.178 179.758 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.573 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 4.4 m . . . . . 0 C--O 1.217 -0.606 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . 0.43 ' CD2' ' HG2' ' A' ' 6' ' ' GLU . 9.3 p-80 -70.62 -13.39 62.07 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 121.478 0.656 . . . . 0.0 110.719 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.43 ' HG2' ' CD2' ' A' ' 5' ' ' HIS . 18.3 mm-40 -96.17 -4.27 42.9 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.138 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.522 ' CD2' ' HA ' ' A' ' 4' ' ' VAL . 52.3 m0 -83.77 142.16 30.88 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.62 -178.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 21.3 m -103.58 -72.14 0.71 Allowed 'General case' 0 N--CA 1.423 -1.813 0 CA-C-O 121.195 0.522 . . . . 0.0 110.918 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.527 ' O ' HG13 ' A' ' 12' ' ' VAL . 69.9 t -139.57 -61.7 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.208 -1.12 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 -176.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.7 pm0 -66.01 -19.86 66.0 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.305 -176.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -86.23 -17.74 33.96 Favored 'General case' 0 N--CA 1.435 -1.212 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.477 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.527 HG13 ' O ' ' A' ' 9' ' ' VAL . 3.2 p -72.39 -24.27 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 CA-C-O 121.79 0.805 . . . . 0.0 109.785 -177.513 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.419 ' O ' HG22 ' A' ' 17' ' ' VAL . 1.1 m -71.22 -27.89 63.81 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.357 -177.19 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -59.54 -40.57 87.66 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-O 120.978 0.418 . . . . 0.0 110.095 -178.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.443 ' O ' HD21 ' A' ' 19' ' ' LEU . 35.6 t90 -64.65 -57.22 9.65 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.51 177.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.462 HD13 ' CG ' ' A' ' 28' ' ' PHE . 41.4 mt -49.02 -46.32 43.91 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.932 0.893 . . . . 0.0 112.138 -177.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.419 HG22 ' O ' ' A' ' 13' ' ' SER . 98.1 t -61.2 -26.21 38.58 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.208 0 CA-C-O 121.208 0.528 . . . . 0.0 111.114 -179.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.95 -24.84 73.04 Favored Glycine 0 N--CA 1.438 -1.198 0 C-N-CA 121.32 -0.467 . . . . 0.0 112.491 -177.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.502 HD13 ' CB ' ' A' ' 63' ' ' LYS . 0.7 OUTLIER -114.49 21.97 14.08 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -179.06 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.1 m 71.49 17.5 5.69 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.756 0.789 . . . . 0.0 111.266 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.441 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.3 mm? -100.54 15.12 29.05 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.311 -177.15 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -56.02 -19.6 13.34 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 121.253 0.549 . . . . 0.0 111.6 174.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -68.38 -23.72 64.7 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 124.125 0.97 . . . . 0.0 111.112 176.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -86.86 -19.81 28.38 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.592 -179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 88.7 t -52.21 -39.24 26.76 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 C-N-CA 123.117 0.567 . . . . 0.0 111.654 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.1 m -51.25 -37.63 48.18 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.085 0.954 . . . . 0.0 112.166 -178.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 14.9 tp10 -103.28 -31.73 9.93 Favored 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.112 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.462 ' CG ' HD13 ' A' ' 16' ' ' LEU . 1.3 m-85 -54.49 -45.33 73.23 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 121.198 0.523 . . . . 0.0 111.618 178.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 35.2 m -76.32 -16.88 59.67 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.71 -178.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -79.69 -35.04 39.68 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.699 -178.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -90.87 2.56 56.05 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 119.844 -0.742 . . . . 0.0 110.04 -177.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.493 ' N ' HD21 ' A' ' 32' ' ' ASN . 0.6 OUTLIER 67.0 32.84 6.08 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.105 178.896 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.3 mm -64.39 118.73 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.051 -178.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.474 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 93.3 p -107.07 -172.35 2.06 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 176.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.573 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -64.43 -22.77 67.9 Favored Glycine 0 N--CA 1.439 -1.164 0 N-CA-C 111.184 -0.767 . . . . 0.0 111.184 179.38 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -59.5 -45.78 90.7 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 123.219 0.608 . . . . 0.0 109.366 176.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.416 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -88.48 -17.05 31.17 Favored 'General case' 0 CA--C 1.494 -1.21 0 C-N-CA 120.413 -0.515 . . . . 0.0 111.47 -178.447 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.1 tt -69.51 -49.59 53.17 Favored 'General case' 0 C--N 1.308 -1.198 0 O-C-N 124.367 1.042 . . . . 0.0 108.802 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.9 mt -59.6 -42.54 92.8 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.551 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -94.57 25.84 3.77 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -178.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.456 ' CB ' HD23 ' A' ' 64' ' ' LEU . 28.2 mt -65.74 161.4 20.85 Favored 'General case' 0 C--O 1.247 0.924 0 CA-C-O 121.173 0.511 . . . . 0.0 111.869 175.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -167.94 176.73 6.03 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.79 -39.09 93.32 Favored Glycine 0 CA--C 1.497 -1.07 0 CA-C-O 119.608 -0.551 . . . . 0.0 112.193 -178.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -51.12 -48.18 61.81 Favored 'General case' 0 CA--C 1.506 -0.731 0 C-N-CA 123.331 0.652 . . . . 0.0 110.667 178.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.402 ' HD3' HD22 ' A' ' 41' ' ' LEU . 11.2 mtpp -67.65 -44.88 76.85 Favored 'General case' 0 C--O 1.197 -1.67 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.297 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 91.3 mt -59.46 -28.84 67.35 Favored 'General case' 0 C--O 1.255 1.343 0 CA-C-O 121.488 0.661 . . . . 0.0 111.734 -179.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.499 ' HA ' HG21 ' A' ' 52' ' ' THR . 22.2 mtpp -76.77 -33.07 58.08 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.906 176.593 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.03 -12.78 60.02 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.685 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.515 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.5 mm? -78.56 -2.16 37.46 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.347 0.594 . . . . 0.0 109.421 173.11 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.07 -0.72 37.03 Favored Glycine 0 C--O 1.216 -1.017 0 CA-C-N 115.832 -0.622 . . . . 0.0 113.185 176.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 24.6 mmt -85.33 -53.72 5.04 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 120.721 0.296 . . . . 0.0 111.365 -177.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.499 HG21 ' HA ' ' A' ' 47' ' ' LYS . 20.0 p 56.11 25.22 8.75 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.584 1.154 . . . . 0.0 112.547 174.1 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 47.4 t -68.28 127.66 33.74 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 123.289 0.636 . . . . 0.0 111.158 -174.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.6 m -58.01 -44.33 87.21 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -175.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -58.94 -55.34 36.44 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.969 0.89 . . . . 0.0 109.658 178.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.695 ' O ' HG13 ' A' ' 60' ' ' VAL . 48.5 m-20 -62.33 -38.58 90.03 Favored 'General case' 0 N--CA 1.42 -1.967 0 CA-C-N 113.838 -1.528 . . . . 0.0 111.245 -173.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 46.9 mmm-85 -56.53 -15.7 4.74 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 176.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -108.57 -39.29 5.44 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-O 121.042 0.449 . . . . 0.0 110.169 175.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.487 HD13 ' HZ2' ' A' ' 63' ' ' LYS . 47.6 tp -73.68 -54.93 6.97 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -173.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.695 HG13 ' O ' ' A' ' 56' ' ' ASP . 7.0 p -64.64 -25.13 37.12 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.02 0 CA-C-O 121.352 0.596 . . . . 0.0 110.195 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.1 mmmt -70.91 -23.75 62.33 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.662 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.471 ' O ' ' HG2' ' A' ' 65' ' ' LYS . 22.5 ttmm -87.39 -40.88 14.02 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 114.656 -1.156 . . . . 0.0 108.964 178.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.502 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -72.6 -34.11 67.16 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-N 115.344 -0.844 . . . . 0.0 112.699 -178.344 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.456 HD23 ' CB ' ' A' ' 41' ' ' LEU . 3.2 pp -72.34 -24.56 61.31 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.003 0.43 . . . . 0.0 111.352 -177.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 21.5 ptmt -83.98 -9.33 58.76 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 120.465 -0.494 . . . . 0.0 111.339 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 . . . . . 0 C--N 1.321 -0.668 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 178.611 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.516 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.5 m . . . . . 0 N--CA 1.479 0.991 0 N-CA-C 113.842 1.052 . . . . 0.0 113.842 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 15.6 p-80 -70.77 -8.47 52.55 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-O 121.175 0.512 . . . . 0.0 111.223 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -99.75 -8.02 24.78 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.631 0.772 . . . . 0.0 109.862 177.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.507 ' CH2' HG13 ' A' ' 4' ' ' VAL . 50.1 m0 -74.53 133.01 42.32 Favored 'General case' 0 CA--C 1.489 -1.373 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -178.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.402 ' O ' ' HB3' ' A' ' 34' ' ' SER . 3.3 m -91.3 -75.51 0.47 Allowed 'General case' 0 N--CA 1.428 -1.56 0 CA-C-O 121.317 0.579 . . . . 0.0 110.156 -175.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.458 ' O ' HG12 ' A' ' 12' ' ' VAL . 97.9 t -140.83 -63.83 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.2 -1.535 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 179.129 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -62.88 -18.79 63.46 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.98 -177.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.458 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 47.0 mt-30 -82.13 -20.97 36.92 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.142 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.458 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.3 p -76.49 -26.42 16.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 CA-C-O 122.114 0.959 . . . . 0.0 108.652 -178.119 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.404 ' HA ' HD12 ' A' ' 16' ' ' LEU . 2.5 m -66.05 -33.41 75.73 Favored 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 114.479 -1.237 . . . . 0.0 112.342 -176.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . 0.458 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 44.6 m-70 -59.35 -37.67 78.45 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.666 0.746 . . . . 0.0 109.028 -178.013 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.52 ' O ' HD22 ' A' ' 19' ' ' LEU . 42.3 t90 -67.67 -58.89 3.87 Favored 'General case' 0 N--CA 1.424 -1.766 0 CA-C-N 114.374 -1.285 . . . . 0.0 109.983 176.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.44 HD13 ' CD2' ' A' ' 28' ' ' PHE . 46.8 mt -47.99 -49.83 29.49 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 124.181 0.992 . . . . 0.0 111.945 -178.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 94.5 t -67.21 -18.09 23.59 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.225 -178.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -86.79 -33.13 13.25 Favored Glycine 0 N--CA 1.438 -1.213 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 -176.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.52 HD22 ' O ' ' A' ' 15' ' ' TRP . 1.8 pt? -95.09 12.19 29.48 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.207 178.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.7 m 66.06 40.58 3.93 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 122.295 1.045 . . . . 0.0 110.29 -178.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.443 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.7 mm? -119.63 20.04 12.44 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 113.947 -1.479 . . . . 0.0 109.36 177.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.443 ' HA ' HG11 ' A' ' 25' ' ' VAL . 4.6 p-10 -55.57 -14.74 2.26 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-O 121.57 0.7 . . . . 0.0 112.139 174.189 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -65.97 -26.13 67.42 Favored 'General case' 0 C--N 1.293 -1.879 0 C-N-CA 123.978 0.911 . . . . 0.0 110.343 174.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.562 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 6.8 m-85 -89.77 -25.13 21.28 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -177.534 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.537 ' HA ' ' HB2' ' A' ' 28' ' ' PHE 0.325 1.4 p -59.64 -26.6 35.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 178.81 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.2 m -59.15 -27.88 66.06 Favored 'General case' 0 CA--C 1.562 1.439 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.887 177.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 16.0 tp10 -112.02 -33.31 6.31 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 179.305 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.537 ' HB2' ' HA ' ' A' ' 25' ' ' VAL . 3.5 m-85 -54.39 -40.96 68.7 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 121.011 0.434 . . . . 0.0 110.407 175.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.1 t -72.37 -22.91 61.07 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.252 -178.441 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -80.03 -37.56 33.79 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.611 -177.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -94.88 4.83 53.36 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 119.844 -0.743 . . . . 0.0 111.291 -178.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 61.1 39.13 16.49 Favored 'General case' 0 C--N 1.351 0.65 0 C-N-CA 123.148 0.579 . . . . 0.0 109.586 179.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.2 mm -66.37 110.02 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.049 0 CA-C-N 115.304 -0.862 . . . . 0.0 108.698 -179.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.497 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 78.5 p -105.76 -169.68 1.62 Allowed 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.516 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -58.73 -31.83 68.41 Favored Glycine 0 N--CA 1.445 -0.716 0 O-C-N 123.575 0.547 . . . . 0.0 112.102 -179.557 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -53.49 -50.12 66.05 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 123.678 0.791 . . . . 0.0 110.075 176.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.519 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -86.79 -17.3 33.85 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.229 -177.799 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.416 HD11 HG21 ' A' ' 12' ' ' VAL . 2.1 tt -70.51 -51.38 29.29 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.924 0.89 . . . . 0.0 109.171 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 47.1 mt -61.01 -36.05 78.47 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-O 121.341 0.591 . . . . 0.0 112.419 -176.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -102.76 17.63 23.38 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.05 -177.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 37' ' ' GLN . 21.4 mt -54.6 154.94 4.42 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 121.789 0.804 . . . . 0.0 112.203 176.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -161.89 168.24 23.32 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 -175.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.15 -38.05 65.88 Favored Glycine 0 C--O 1.209 -1.41 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 177.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -51.48 -48.48 62.85 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 122.674 0.389 . . . . 0.0 111.093 176.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.3 mtpp -70.06 -45.31 67.35 Favored 'General case' 0 C--O 1.193 -1.915 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.89 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 94.3 mt -56.61 -38.04 71.5 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-O 121.825 0.821 . . . . 0.0 110.751 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.475 ' HA ' HG22 ' A' ' 52' ' ' THR . 24.5 mtpp -69.73 -36.58 75.98 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.161 177.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.85 -10.68 59.73 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 123.223 0.609 . . . . 0.0 111.378 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.515 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.2 mm? -84.55 -1.94 56.61 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.522 0.677 . . . . 0.0 109.286 173.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 70.62 7.11 60.59 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.761 -0.654 . . . . 0.0 114.284 174.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.562 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 40.3 tpp -90.29 -53.93 4.24 Favored 'General case' 0 C--N 1.311 -1.078 0 C-N-CA 119.07 -1.052 . . . . 0.0 109.3 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.475 HG22 ' HA ' ' A' ' 47' ' ' LYS . 63.7 p 54.9 33.25 19.57 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 124.586 1.154 . . . . 0.0 112.714 172.118 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.51 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 60.5 m -70.66 -174.68 0.93 Allowed 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 123.473 0.709 . . . . 0.0 112.909 -178.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.1 p -102.01 -41.18 6.54 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -60.8 -45.36 94.72 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.498 0.666 . . . . 0.0 111.036 -177.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.626 ' O ' HG12 ' A' ' 60' ' ' VAL . 11.5 p-10 -66.01 -45.21 82.37 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.89 -172.445 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 56.6 mmm-85 -56.33 -18.59 11.28 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 123.332 0.653 . . . . 0.0 111.954 -176.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -104.15 -44.26 5.03 Favored 'General case' 0 N--CA 1.419 -1.994 0 CA-C-O 121.048 0.451 . . . . 0.0 110.213 174.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.425 HD12 ' HZ1' ' A' ' 63' ' ' LYS . 23.4 tp -76.84 -55.99 5.0 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -172.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.626 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.6 p -65.51 -22.04 30.24 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.779 0 CA-C-O 121.419 0.628 . . . . 0.0 109.37 -178.483 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -68.92 -31.21 69.94 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 114.254 -1.339 . . . . 0.0 108.8 -177.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -86.41 -42.14 13.88 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.425 -1.261 . . . . 0.0 109.39 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.425 ' HZ1' HD12 ' A' ' 59' ' ' LEU . 0.9 OUTLIER -65.29 -40.84 94.37 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.213 -176.785 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.444 HD23 ' CB ' ' A' ' 41' ' ' LEU . 3.6 pp -64.1 -32.36 73.89 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.163 -177.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -80.81 -18.88 46.04 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.287 -0.565 . . . . 0.0 111.999 -178.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 . . . . . 0 C--N 1.318 -0.775 0 O-C-N 122.474 -0.141 . . . . 0.0 111.082 -179.252 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.521 HG13 ' CH2' ' A' ' 7' ' ' TRP . 3.6 m . . . . . 0 N--CA 1.468 0.43 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.2 p-80 -70.54 -7.27 42.52 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-O 121.498 0.666 . . . . 0.0 110.783 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -99.61 -9.41 23.23 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 124.268 1.027 . . . . 0.0 110.298 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.538 ' HA ' ' NE2' ' A' ' 11' ' ' GLN . 54.4 m0 -76.03 142.35 41.85 Favored 'General case' 0 CA--C 1.504 -0.794 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.307 -175.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.9 m -94.81 -79.42 0.43 Allowed 'General case' 0 N--CA 1.418 -2.039 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.862 -178.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.49 ' O ' HG13 ' A' ' 12' ' ' VAL . 94.9 t -141.77 -59.66 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -179.46 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.6 pm0 -60.46 -26.45 66.78 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.03 -0.987 . . . . 0.0 111.437 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.538 ' NE2' ' HA ' ' A' ' 7' ' ' TRP . 23.8 mt-30 -81.31 -16.99 50.8 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 115.01 -0.995 . . . . 0.0 112.356 -175.425 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.49 HG13 ' O ' ' A' ' 9' ' ' VAL . 1.7 p -79.91 -20.17 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 121.894 0.854 . . . . 0.0 109.073 -179.379 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.418 ' HA ' HD12 ' A' ' 16' ' ' LEU . 2.5 m -77.15 -23.51 51.64 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.461 -174.306 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . 0.516 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 97.6 m-70 -60.63 -41.01 94.01 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.491 ' O ' HD23 ' A' ' 19' ' ' LEU . 31.3 t90 -61.99 -60.03 4.22 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 114.649 -1.16 . . . . 0.0 110.163 177.699 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.469 HD13 ' CG ' ' A' ' 28' ' ' PHE . 43.3 mt -47.97 -47.61 32.72 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.262 1.025 . . . . 0.0 112.441 -177.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 89.4 t -64.43 -22.55 31.46 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.168 0 CA-C-O 121.257 0.551 . . . . 0.0 111.018 -179.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.11 -29.84 61.95 Favored Glycine 0 N--CA 1.442 -0.913 0 CA-C-N 116.23 -0.441 . . . . 0.0 112.105 -179.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.506 HD13 ' CB ' ' A' ' 63' ' ' LYS . 0.6 OUTLIER -108.69 17.67 21.66 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -178.821 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.2 m 68.17 25.28 7.36 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 121.845 0.831 . . . . 0.0 111.169 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.458 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.1 mm? -103.62 16.29 26.79 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 124.247 1.019 . . . . 0.0 109.383 178.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -51.5 -26.51 8.52 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.078 0.951 . . . . 0.0 111.606 175.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -64.38 -23.52 67.32 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 124.066 0.946 . . . . 0.0 111.129 178.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.425 ' CE1' ' HG2' ' A' ' 51' ' ' MET . 2.0 m-85 -85.89 -19.01 31.19 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.34 -178.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 95.7 t -53.64 -38.56 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.863 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.9 t -50.01 -39.23 40.69 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.774 0.829 . . . . 0.0 111.734 -179.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 12.3 tp10 -104.22 -30.53 10.12 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 120.978 -0.289 . . . . 0.0 110.829 -178.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.469 ' CG ' HD13 ' A' ' 16' ' ' LEU . 1.7 m-85 -56.18 -39.22 72.05 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 121.48 0.657 . . . . 0.0 110.238 176.656 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.8 t -76.05 -30.16 58.31 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.403 179.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.76 -45.18 72.06 Favored 'General case' 0 CA--C 1.504 -0.817 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.01 -176.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -94.7 13.94 22.78 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 -178.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 57.57 39.91 27.32 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.857 0.863 . . . . 0.0 111.837 174.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 49.9 mm -68.84 115.47 7.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.456 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 89.6 p -108.7 -170.21 1.63 Allowed 'General case' 0 N--CA 1.423 -1.789 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 178.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.475 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -60.04 -32.72 76.51 Favored Glycine 0 CA--C 1.507 -0.406 0 N-CA-C 111.379 -0.688 . . . . 0.0 111.379 -179.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -50.28 -45.27 54.32 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 125.146 1.378 . . . . 0.0 110.387 176.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.449 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -96.79 -14.8 21.69 Favored 'General case' 0 C--O 1.214 -0.765 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 179.778 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.6 tt -69.03 -53.06 22.47 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 -179.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 36.3 mt -60.3 -36.23 77.4 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.949 -176.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -97.36 10.51 39.45 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 113.755 1.021 . . . . 0.0 113.755 -175.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 37' ' ' GLN . 41.0 mt -54.51 136.14 45.01 Favored 'General case' 0 C--O 1.243 0.745 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 179.28 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -134.78 -177.77 4.77 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 177.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.18 -41.99 95.05 Favored Glycine 0 C--O 1.211 -1.338 0 CA-C-O 119.169 -0.795 . . . . 0.0 113.412 -178.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -62.52 -37.43 86.0 Favored 'General case' 0 CA--C 1.475 -1.932 0 CA-C-N 117.654 0.727 . . . . 0.0 112.442 -177.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.5 mtpp -63.48 -49.6 72.97 Favored 'General case' 0 C--N 1.299 -1.6 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.791 175.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.6 mt -60.99 -22.58 64.64 Favored 'General case' 0 C--O 1.261 1.694 0 CA-C-O 121.328 0.585 . . . . 0.0 111.725 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.447 ' HA ' HG21 ' A' ' 52' ' ' THR . 62.2 mtpt -82.98 -41.67 18.48 Favored 'General case' 0 N--CA 1.433 -1.304 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.966 176.699 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.37 -11.23 60.79 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.554 0.693 . . . . 0.0 110.795 177.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.464 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 3.7 mm? -77.01 -3.28 38.24 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 172.37 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.14 1.85 51.0 Favored Glycine 0 CA--C 1.506 -0.506 0 CA-C-N 116.226 -0.443 . . . . 0.0 113.591 175.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.425 ' HG2' ' CE1' ' A' ' 24' ' ' TYR . 15.7 tpt -91.89 -50.89 5.48 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.367 -177.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.447 HG21 ' HA ' ' A' ' 47' ' ' LYS . 68.6 p 53.51 20.17 1.98 Allowed 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 124.959 1.304 . . . . 0.0 113.736 176.161 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 42.4 t -68.78 130.19 42.09 Favored 'General case' 0 C--N 1.31 -1.122 0 C-N-CA 123.057 0.543 . . . . 0.0 111.472 -172.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 31.7 t -56.38 -47.57 78.65 Favored 'General case' 0 C--O 1.247 0.931 0 C-N-CA 124.633 1.173 . . . . 0.0 111.631 -175.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 -53.88 -58.2 8.12 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-O 122.165 0.984 . . . . 0.0 110.471 177.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.693 ' O ' HG12 ' A' ' 60' ' ' VAL . 7.7 m-20 -63.15 -40.85 98.76 Favored 'General case' 0 N--CA 1.422 -1.869 0 CA-C-N 113.451 -1.704 . . . . 0.0 110.592 -171.736 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -54.06 -26.3 26.08 Favored 'General case' 0 C--O 1.218 -0.571 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 178.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -104.79 -14.92 15.37 Favored 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 121.134 -0.226 . . . . 0.0 111.504 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.408 HD13 ' C ' ' A' ' 59' ' ' LEU . 3.4 tm? -96.57 -59.01 1.91 Allowed 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 -175.12 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.693 HG12 ' O ' ' A' ' 56' ' ' ASP . 4.8 p -57.41 -26.77 27.17 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.553 0 CA-C-O 120.805 0.336 . . . . 0.0 110.865 -177.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.465 ' HD2' HD21 ' A' ' 64' ' ' LEU . 24.7 mmmt -62.12 -30.53 71.09 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.84 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.422 ' HA ' ' HE2' ' A' ' 65' ' ' LYS . 37.9 ttmt -79.25 -44.69 21.25 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 121.952 0.882 . . . . 0.0 109.114 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.506 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -70.54 -31.74 68.92 Favored 'General case' 0 C--N 1.295 -1.795 0 CA-C-N 114.01 -1.45 . . . . 0.0 112.404 -174.356 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.465 HD21 ' HD2' ' A' ' 61' ' ' LYS . 3.9 pp -75.05 -32.15 61.47 Favored 'General case' 0 N--CA 1.437 -1.107 0 N-CA-C 112.0 0.371 . . . . 0.0 112.0 179.507 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.422 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 64.2 pttt -80.07 -29.2 39.13 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 119.491 -0.884 . . . . 0.0 111.022 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.403 ' HG2' ' HA ' ' A' ' 63' ' ' LYS . 12.1 pt-20 . . . . . 0 C--O 1.242 0.677 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 178.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.574 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.4 m . . . . . 0 CA--C 1.511 -0.532 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 22.8 p-80 -73.38 -6.77 48.36 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 121.044 0.45 . . . . 0.0 110.606 178.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -105.25 -2.22 24.33 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.611 178.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.495 ' HA ' ' NE2' ' A' ' 11' ' ' GLN . 53.5 m0 -78.74 142.12 37.29 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.337 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.9 m -96.41 -81.92 0.41 Allowed 'General case' 0 N--CA 1.415 -2.222 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.98 -177.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.543 ' O ' HG12 ' A' ' 12' ' ' VAL . 87.2 t -139.71 -58.62 0.31 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.951 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 -178.426 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.4 pm0 -63.07 -29.47 70.84 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.523 0.678 . . . . 0.0 111.356 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.495 ' NE2' ' HA ' ' A' ' 7' ' ' TRP . 20.4 mt-30 -75.66 -15.63 60.29 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.802 -176.712 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.543 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.9 p -80.73 -18.32 12.06 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-O 121.285 0.564 . . . . 0.0 109.789 -179.423 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.425 ' O ' HG21 ' A' ' 17' ' ' VAL . 86.1 p -73.6 -39.27 64.72 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.448 -174.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -50.69 -41.07 55.49 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 114.831 -1.077 . . . . 0.0 110.842 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.469 ' O ' HD23 ' A' ' 19' ' ' LEU . 28.6 t90 -65.52 -58.81 4.9 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.988 176.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 40.4 mt -48.66 -48.28 39.99 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.963 0.905 . . . . 0.0 112.189 -178.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.425 HG21 ' O ' ' A' ' 13' ' ' SER . 60.6 t -65.68 -16.34 20.26 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.393 0 CA-C-O 121.069 0.462 . . . . 0.0 111.162 -178.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -85.81 -21.26 53.86 Favored Glycine 0 N--CA 1.444 -0.807 0 N-CA-C 112.336 -0.306 . . . . 0.0 112.336 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.469 HD23 ' O ' ' A' ' 15' ' ' TRP . 1.3 pt? -112.45 21.66 15.46 Favored 'General case' 0 C--O 1.213 -0.839 0 O-C-N 122.154 -0.615 . . . . 0.0 111.572 177.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.4 m 68.82 22.26 7.33 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.613 0.765 . . . . 0.0 111.747 -179.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -103.11 17.74 23.36 Favored 'General case' 0 C--N 1.3 -1.564 0 C-N-CA 123.905 0.882 . . . . 0.0 110.55 -178.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -54.68 -26.82 35.92 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.468 0.707 . . . . 0.0 111.312 176.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -64.88 -21.66 66.85 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 124.599 1.16 . . . . 0.0 111.327 177.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.448 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 3.2 m-85 -89.65 -20.63 23.44 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.784 -179.097 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.1 t -55.73 -38.15 49.78 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 O-C-N 123.321 0.388 . . . . 0.0 111.532 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.4 m -51.12 -41.09 59.83 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.812 0.845 . . . . 0.0 111.282 -178.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 16.1 tp10 -99.31 -34.58 10.26 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.267 -177.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -54.21 -48.19 71.31 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-O 121.297 0.57 . . . . 0.0 110.919 178.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 45.8 m -77.81 -11.23 59.86 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.516 -178.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.22 -29.63 26.38 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.878 0.371 . . . . 0.0 110.401 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.74 2.45 47.02 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 120.132 -0.627 . . . . 0.0 109.871 178.718 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 65.53 32.44 9.38 Favored 'General case' 0 CA--C 1.514 -0.439 0 C-N-CA 123.981 0.912 . . . . 0.0 110.826 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.9 mm -62.63 113.13 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 O-C-N 123.643 0.589 . . . . 0.0 109.628 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 71.1 p -100.09 -172.09 2.16 Favored 'General case' 0 N--CA 1.423 -1.822 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.574 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -65.17 -23.05 69.54 Favored Glycine 0 N--CA 1.439 -1.159 0 N-CA-C 111.513 -0.635 . . . . 0.0 111.513 178.331 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -62.45 -40.44 96.62 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 123.641 0.776 . . . . 0.0 109.917 179.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.411 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -93.04 -17.37 23.94 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.909 179.743 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.43 HD12 HG23 ' A' ' 12' ' ' VAL . 3.2 tt -69.0 -51.48 38.84 Favored 'General case' 0 C--N 1.314 -0.96 0 C-N-CA 124.593 1.157 . . . . 0.0 109.217 179.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 63.5 mt -58.63 -38.91 79.07 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.369 0.604 . . . . 0.0 111.776 -178.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -97.77 13.73 29.4 Favored 'General case' 0 C--N 1.299 -1.611 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.715 -176.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.464 ' CB ' HD21 ' A' ' 64' ' ' LEU . 31.4 mt -54.22 139.22 36.56 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.801 0.81 . . . . 0.0 112.271 177.443 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -139.39 170.62 15.59 Favored 'General case' 0 C--N 1.284 -2.264 0 N-CA-C 106.296 -1.742 . . . . 0.0 106.296 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -53.3 -37.56 55.41 Favored Glycine 0 C--O 1.211 -1.324 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 177.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -49.56 -49.87 44.59 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.834 0.853 . . . . 0.0 110.352 178.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.3 mtpp -71.31 -44.04 65.92 Favored 'General case' 0 N--CA 1.421 -1.879 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.624 -177.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 88.2 mt -60.17 -28.38 67.89 Favored 'General case' 0 C--O 1.255 1.387 0 CA-C-O 121.49 0.662 . . . . 0.0 111.121 -179.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.488 ' HA ' HG21 ' A' ' 52' ' ' THR . 54.3 mtpt -78.92 -33.13 45.72 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 115.151 -0.932 . . . . 0.0 109.952 176.762 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.98 -4.89 46.35 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 123.127 0.571 . . . . 0.0 111.574 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.571 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.4 mm? -87.53 -2.15 58.42 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 173.17 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.06 -9.76 6.46 Favored Glycine 0 C--O 1.222 -0.602 0 CA-C-N 115.713 -0.676 . . . . 0.0 114.128 175.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.768 ' SD ' ' HB2' ' A' ' 53' ' ' SER . 0.0 OUTLIER -79.49 -50.36 10.88 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -176.336 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.488 HG21 ' HA ' ' A' ' 47' ' ' LYS . 70.1 p 53.21 27.44 6.0 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.833 1.253 . . . . 0.0 113.103 175.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.768 ' HB2' ' SD ' ' A' ' 51' ' ' MET . 40.0 t -65.7 123.55 20.02 Favored 'General case' 0 C--N 1.313 -1.015 0 C-N-CA 123.532 0.733 . . . . 0.0 111.944 -174.6 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.1 m -54.6 -41.72 70.27 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.958 0.903 . . . . 0.0 113.198 -177.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -61.07 -55.83 28.09 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.982 0.896 . . . . 0.0 109.557 176.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.691 ' O ' HG13 ' A' ' 60' ' ' VAL . 67.0 m-20 -62.61 -40.55 97.31 Favored 'General case' 0 N--CA 1.427 -1.577 0 CA-C-N 113.593 -1.64 . . . . 0.0 111.135 -171.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.1 mmm180 -53.79 -22.39 9.38 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 124.058 0.943 . . . . 0.0 113.045 177.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -106.8 -26.2 11.37 Favored 'General case' 0 N--CA 1.444 -0.752 0 O-C-N 123.138 0.274 . . . . 0.0 111.425 177.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.425 HD13 ' HZ1' ' A' ' 63' ' ' LYS . 47.8 tp -86.42 -52.57 5.52 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -176.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.691 HG13 ' O ' ' A' ' 56' ' ' ASP . 6.5 p -62.77 -22.88 31.36 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.244 0 CA-C-O 121.414 0.625 . . . . 0.0 109.485 178.063 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.427 ' HA ' ' CD2' ' A' ' 64' ' ' LEU . 26.7 tptp -71.22 -27.53 63.56 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 114.422 -1.263 . . . . 0.0 108.797 -176.594 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -83.44 -46.78 12.11 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.909 -1.496 . . . . 0.0 108.995 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.453 ' HE3' ' CB ' ' A' ' 19' ' ' LEU . 0.9 OUTLIER -67.58 -40.01 84.84 Favored 'General case' 0 N--CA 1.426 -1.657 0 CA-C-N 114.143 -1.39 . . . . 0.0 110.933 -174.885 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.464 HD21 ' CB ' ' A' ' 41' ' ' LEU . 3.9 pp -64.05 -30.72 71.77 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.012 -176.279 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -87.29 -10.17 53.03 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 118.078 -1.449 . . . . 0.0 111.639 -178.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 . . . . . 0 C--N 1.309 -1.156 0 C-N-CA 120.364 -0.534 . . . . 0.0 109.605 178.692 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.529 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.4 m . . . . . 0 N--CA 1.468 0.443 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 18.0 p-80 -71.55 -12.85 61.58 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-O 121.292 0.568 . . . . 0.0 110.969 178.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -96.73 -12.6 23.53 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.994 178.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.413 ' CH2' HG11 ' A' ' 4' ' ' VAL . 51.0 m0 -66.45 141.03 58.06 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.171 -178.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.1 m -94.54 -80.06 0.41 Allowed 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.647 -178.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.538 ' O ' HG13 ' A' ' 12' ' ' VAL . 91.9 t -141.12 -60.43 0.22 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.143 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 -176.351 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.1 pm0 -64.01 -23.29 67.28 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 115.186 -0.916 . . . . 0.0 112.265 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.521 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 34.6 mt-30 -81.16 -18.26 46.94 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 179.375 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.538 HG13 ' O ' ' A' ' 9' ' ' VAL . 2.0 p -73.77 -24.34 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-O 121.63 0.728 . . . . 0.0 109.699 -179.102 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.452 ' O ' HG23 ' A' ' 17' ' ' VAL . 0.7 OUTLIER -70.8 -30.1 66.46 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.195 -176.214 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . 0.521 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 94.8 m-70 -58.09 -39.33 78.33 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-O 121.037 0.446 . . . . 0.0 110.039 -178.258 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.567 ' O ' HD23 ' A' ' 19' ' ' LEU . 35.4 t90 -65.17 -60.47 2.98 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.936 176.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.505 HD13 ' CG ' ' A' ' 28' ' ' PHE . 50.3 mt -48.59 -51.08 29.7 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.103 0.961 . . . . 0.0 112.441 -177.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 13' ' ' SER . 59.2 t -66.22 -20.78 27.78 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 CA-C-O 121.044 0.449 . . . . 0.0 110.572 -177.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -76.6 -30.33 56.53 Favored Glycine 0 N--CA 1.439 -1.158 0 N-CA-C 111.174 -0.77 . . . . 0.0 111.174 -177.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.567 HD23 ' O ' ' A' ' 15' ' ' TRP . 1.0 OUTLIER -102.11 14.11 32.87 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.995 -0.282 . . . . 0.0 110.579 177.197 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.9 m 65.03 37.82 6.57 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-O 121.591 0.71 . . . . 0.0 112.255 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.701 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -109.82 22.31 15.82 Favored 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 127.082 2.153 . . . . 0.0 107.889 176.61 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -53.24 -27.77 23.93 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.321 0.648 . . . . 0.0 112.621 177.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.701 ' NE2' ' HA ' ' A' ' 21' ' ' LEU . 3.5 pm0 -66.39 -18.38 65.32 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 175.653 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -87.45 -21.53 25.49 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.225 178.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 90.8 t -57.48 -37.96 60.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 122.508 0.323 . . . . 0.0 110.705 179.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 7.2 m -49.66 -36.76 25.87 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 124.81 1.244 . . . . 0.0 111.929 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.476 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 19.8 tp10 -106.62 -34.06 7.45 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.507 -178.531 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.505 ' CG ' HD13 ' A' ' 16' ' ' LEU . 1.2 m-85 -53.02 -48.14 67.81 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 121.37 0.605 . . . . 0.0 110.811 177.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.4 m -76.83 -21.17 55.45 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.385 -177.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.69 -31.82 63.62 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.818 0.342 . . . . 0.0 111.273 -178.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.74 7.58 44.96 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 119.78 -0.768 . . . . 0.0 111.94 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 65.24 36.98 6.72 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.68 0.792 . . . . 0.0 110.695 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.448 HG21 ' HB2' ' A' ' 37' ' ' GLN . 45.0 mm -69.04 119.2 14.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 178.467 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 63.1 p -106.33 -172.31 2.06 Favored 'General case' 0 N--CA 1.419 -2.003 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 179.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.529 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -64.48 -22.96 68.17 Favored Glycine 0 N--CA 1.447 -0.592 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 177.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -60.08 -44.29 94.88 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 123.673 0.789 . . . . 0.0 109.791 177.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.448 ' HB2' HG21 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -83.96 -26.25 29.41 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 -177.703 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.1 tt -62.79 -50.64 70.2 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.007 1.323 . . . . 0.0 110.724 -174.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 38.6 mt -62.96 -31.47 72.58 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.161 -177.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -103.41 13.08 34.41 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-N 115.575 -0.738 . . . . 0.0 112.553 -177.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.7 mt -53.49 145.67 14.3 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.409 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 24.5 t70 -142.39 169.04 18.33 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 105.827 -1.916 . . . . 0.0 105.827 179.016 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.502 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -54.03 -36.32 55.97 Favored Glycine 0 CA--C 1.487 -1.705 0 N-CA-C 110.502 -1.039 . . . . 0.0 110.502 176.286 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.409 ' HA ' ' HD3' ' A' ' 47' ' ' LYS . 66.1 t30 -50.67 -51.25 50.99 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-O 121.748 0.785 . . . . 0.0 110.238 178.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.446 ' O ' HD23 ' A' ' 49' ' ' LEU . 13.5 mtpp -68.27 -39.8 82.06 Favored 'General case' 0 C--O 1.198 -1.64 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.3 -177.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 81.6 mt -62.89 -24.7 67.95 Favored 'General case' 0 C--O 1.254 1.299 0 CA-C-O 121.452 0.644 . . . . 0.0 110.767 179.211 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.502 ' HG3' ' O ' ' A' ' 43' ' ' GLY . 6.8 mtpm? -80.11 -35.78 36.31 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.067 -0.97 . . . . 0.0 108.931 175.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.45 -9.24 58.29 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 123.63 0.772 . . . . 0.0 111.581 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.476 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 2.9 mm? -86.06 -4.49 59.18 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 172.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 69.71 -0.07 22.34 Favored Glycine 0 C--N 1.328 0.135 0 CA-C-N 116.088 -0.506 . . . . 0.0 114.11 176.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.454 ' HA ' ' HE1' ' A' ' 51' ' ' MET . 0.6 OUTLIER -84.37 -43.6 14.57 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 179.212 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.495 HG22 ' HA ' ' A' ' 47' ' ' LYS . 72.0 p 50.39 21.09 0.77 Allowed 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 125.721 1.608 . . . . 0.0 114.406 172.49 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.1 t -73.04 121.92 20.94 Favored 'General case' 0 C--N 1.3 -1.565 0 C-N-CA 122.428 0.291 . . . . 0.0 111.331 -174.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.2 m -63.59 -28.74 70.14 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -178.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.93 -54.59 24.36 Favored 'General case' 0 CA--C 1.503 -0.839 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 176.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.602 ' O ' HG12 ' A' ' 60' ' ' VAL . 4.6 m-20 -61.13 -45.71 93.55 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.182 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.507 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 12.0 mtm180 -63.51 -17.4 62.73 Favored 'General case' 0 C--O 1.207 -1.152 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.7 -15.5 30.21 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 121.373 0.606 . . . . 0.0 110.332 177.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.514 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 39.3 tp -100.81 -49.06 4.27 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.181 -178.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.602 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.5 p -60.62 -25.81 35.98 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.767 0 CA-C-O 121.727 0.775 . . . . 0.0 109.998 179.16 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 56.8 tptt -71.85 -34.03 68.92 Favored 'General case' 0 C--N 1.295 -1.776 0 CA-C-N 114.246 -1.343 . . . . 0.0 109.701 -172.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.514 ' HG2' ' O ' ' A' ' 59' ' ' LEU . 21.0 ptmt -87.9 -31.86 19.24 Favored 'General case' 0 N--CA 1.418 -2.061 0 CA-C-N 114.78 -1.1 . . . . 0.0 108.306 -177.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.6 tppt? -70.98 -44.87 65.06 Favored 'General case' 0 N--CA 1.417 -2.09 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.854 -178.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.7 pp -59.15 -31.42 68.95 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.959 0.409 . . . . 0.0 111.858 -176.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -87.86 -5.04 58.79 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -177.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 . . . . . 0 C--N 1.312 -1.05 0 C-N-CA 120.268 -0.573 . . . . 0.0 109.685 174.324 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.503 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 10.9 m . . . . . 0 N--CA 1.469 0.52 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -69.37 -13.08 62.18 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-O 121.603 0.716 . . . . 0.0 110.75 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -88.95 -12.45 41.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.671 178.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.501 ' CH2' HG13 ' A' ' 4' ' ' VAL . 50.2 m0 -79.12 142.84 36.07 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 -179.525 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 13.1 m -99.83 -72.16 0.67 Allowed 'General case' 0 C--N 1.294 -1.819 0 O-C-N 123.657 0.598 . . . . 0.0 110.374 -178.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.513 ' O ' HG13 ' A' ' 12' ' ' VAL . 54.6 t -141.48 -65.76 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.209 -1.076 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 -179.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -62.4 -22.86 66.49 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -176.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.44 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 18.3 mt-30 -80.32 -18.47 49.09 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 176.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.513 HG13 ' O ' ' A' ' 9' ' ' VAL . 1.4 p -75.25 -23.0 16.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 179.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.419 ' HA ' HD13 ' A' ' 16' ' ' LEU . 1.4 m -76.04 -27.56 57.36 Favored 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.246 -176.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . 0.44 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 84.4 m-70 -63.16 -34.82 78.45 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.491 ' O ' HD22 ' A' ' 19' ' ' LEU . 30.4 t90 -66.38 -62.21 1.59 Allowed 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.483 175.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.509 HD11 ' CG ' ' A' ' 28' ' ' PHE . 56.8 mt -44.83 -50.18 10.4 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.354 1.061 . . . . 0.0 112.946 -177.527 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 99.0 t -62.01 -27.73 42.99 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.277 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.688 -178.052 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.63 -35.44 74.39 Favored Glycine 0 N--CA 1.444 -0.831 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 -177.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.491 HD22 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -98.55 10.0 41.96 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 -179.305 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.3 m 75.59 19.47 2.06 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 124.206 1.002 . . . . 0.0 112.301 179.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -95.99 19.32 11.75 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.103 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -48.21 -33.56 8.73 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.231 1.412 . . . . 0.0 111.187 173.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -62.56 -22.05 66.05 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.77 -1.105 . . . . 0.0 111.124 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.454 ' HB3' ' CD1' ' A' ' 28' ' ' PHE . 13.4 m-85 -90.77 -20.24 22.59 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.877 -178.209 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 99.0 t -52.84 -37.62 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 C-N-CA 123.055 0.542 . . . . 0.0 111.855 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 29.7 t -57.58 -33.27 67.99 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 122.902 0.481 . . . . 0.0 111.923 -177.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -106.91 -28.21 10.22 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 121.176 -0.21 . . . . 0.0 110.898 -179.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.574 ' CE1' HD11 ' A' ' 49' ' ' LEU . 2.1 m-85 -54.79 -38.76 67.68 Favored 'General case' 0 C--N 1.347 0.476 0 CA-C-O 121.829 0.823 . . . . 0.0 109.462 174.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 31.1 p -74.17 -27.56 60.89 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 114.841 -1.072 . . . . 0.0 111.887 -179.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.09 -31.95 64.68 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-O 121.166 0.508 . . . . 0.0 110.387 -175.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.469 ' NE2' HD21 ' A' ' 49' ' ' LEU . 5.6 mt-30 -95.16 -1.39 51.95 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 119.815 -0.754 . . . . 0.0 110.41 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 63.58 38.69 9.45 Favored 'General case' 0 CA--C 1.512 -0.486 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -179.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.46 HG22 ' HB2' ' A' ' 37' ' ' GLN . 44.7 mm -65.01 114.75 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.603 -179.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.4 p -97.34 -175.53 3.24 Favored 'General case' 0 N--CA 1.407 -2.584 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 176.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.503 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -65.25 -21.46 68.31 Favored Glycine 0 N--CA 1.433 -1.533 0 N-CA-C 111.563 -0.615 . . . . 0.0 111.563 178.126 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -65.49 -38.7 90.54 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.46 ' HB2' HG22 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -84.85 -28.39 26.07 Favored 'General case' 0 CA--C 1.507 -0.685 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 -179.227 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.416 HD13 HG21 ' A' ' 12' ' ' VAL . 2.6 tt -58.56 -51.05 71.54 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 125.196 1.398 . . . . 0.0 109.654 -178.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 21.7 mt -57.37 -37.94 73.43 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.366 -178.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -100.48 21.49 13.16 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -177.718 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.414 ' HB2' HD21 ' A' ' 64' ' ' LEU . 27.9 mt -62.37 139.02 58.55 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.116 0.484 . . . . 0.0 111.786 175.253 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.466 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 0.6 OUTLIER -138.95 178.05 7.44 Favored 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 177.656 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.59 -37.93 69.45 Favored Glycine 0 C--O 1.203 -1.815 0 CA-C-O 119.322 -0.71 . . . . 0.0 113.209 178.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -62.35 -41.67 98.77 Favored 'General case' 0 CA--C 1.482 -1.636 0 CA-C-N 117.747 0.774 . . . . 0.0 112.666 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.51 ' O ' ' HG ' ' A' ' 49' ' ' LEU . 16.5 mtpp -66.02 -40.6 91.2 Favored 'General case' 0 C--N 1.31 -1.141 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.087 175.662 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.483 ' HA ' HD12 ' A' ' 49' ' ' LEU . 87.5 mt -63.96 -34.16 77.35 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-O 121.773 0.797 . . . . 0.0 110.548 178.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.511 ' HA ' HG22 ' A' ' 52' ' ' THR . 43.1 mtpt -71.39 -37.1 71.58 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.242 176.634 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.11 3.74 16.65 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.455 0.645 . . . . 0.0 110.87 -179.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.574 HD11 ' CE1' ' A' ' 28' ' ' PHE . 72.4 mt -95.94 -0.84 50.26 Favored 'General case' 0 N--CA 1.428 -1.535 0 CA-C-O 121.663 0.744 . . . . 0.0 109.215 176.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 81.14 -23.26 4.63 Favored Glycine 0 CA--C 1.501 -0.79 0 CA-C-N 115.271 -0.877 . . . . 0.0 113.58 173.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 16.4 mmt -74.97 -55.4 5.8 Favored 'General case' 0 C--N 1.296 -1.742 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 -176.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.511 HG22 ' HA ' ' A' ' 47' ' ' LYS . 14.7 p 60.49 23.37 13.01 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.312 1.045 . . . . 0.0 110.922 174.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.8 m -68.38 126.11 28.58 Favored 'General case' 0 N--CA 1.421 -1.877 0 C-N-CA 124.531 1.133 . . . . 0.0 112.426 -173.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.9 m -58.98 -40.85 86.09 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.391 1.077 . . . . 0.0 113.398 -175.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -55.23 -57.87 10.01 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 122.817 1.294 . . . . 0.0 109.072 177.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.739 ' O ' HG12 ' A' ' 60' ' ' VAL . 9.8 m-20 -60.42 -42.53 96.18 Favored 'General case' 0 N--CA 1.415 -2.219 0 CA-C-N 112.462 -2.154 . . . . 0.0 110.961 -174.198 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.5 mmm-85 -52.35 -24.48 7.68 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 177.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -104.08 -36.56 7.67 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-O 120.97 0.414 . . . . 0.0 111.081 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.418 ' C ' HD11 ' A' ' 59' ' ' LEU . 2.1 tm? -72.59 -60.67 2.12 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.301 -176.249 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.739 HG12 ' O ' ' A' ' 56' ' ' ASP . 8.2 p -60.63 -25.28 34.42 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.72 0 CA-C-O 121.837 0.827 . . . . 0.0 109.417 -176.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -71.02 -25.92 62.88 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.059 -175.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.3 tttm -85.14 -39.56 17.75 Favored 'General case' 0 N--CA 1.424 -1.769 0 CA-C-N 115.428 -0.806 . . . . 0.0 109.057 176.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.06 -40.76 87.13 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.408 -176.086 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.414 HD21 ' HB2' ' A' ' 41' ' ' LEU . 4.1 pp -66.36 -29.02 69.12 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.934 -177.133 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -88.24 -1.87 58.27 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 120.099 -0.64 . . . . 0.0 111.773 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 . . . . . 0 C--N 1.313 -1.002 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 176.664 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.492 ' HA ' ' CD2' ' A' ' 7' ' ' TRP . 4.5 m . . . . . 0 C--O 1.221 -0.406 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 11.1 p-80 -68.34 -15.91 63.74 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.338 0.589 . . . . 0.0 110.895 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -86.48 -11.85 50.61 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.555 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.492 ' CD2' ' HA ' ' A' ' 4' ' ' VAL . 51.2 m0 -78.8 142.32 37.04 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-O 121.436 0.636 . . . . 0.0 111.132 -176.517 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.98 -80.66 0.33 Allowed 'General case' 0 N--CA 1.417 -2.1 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.104 -178.567 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.47 ' O ' HG11 ' A' ' 12' ' ' VAL . 59.5 t -143.27 -60.76 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.839 0 CA-C-N 113.82 -1.537 . . . . 0.0 108.882 -177.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.0 pm0 -74.12 -10.94 60.12 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.296 0.57 . . . . 0.0 112.091 -175.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -86.32 -17.46 34.5 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.72 176.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.47 HG11 ' O ' ' A' ' 9' ' ' VAL . 2.5 p -70.66 -24.12 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-O 122.125 0.964 . . . . 0.0 108.979 -178.565 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.462 ' HA ' HD11 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -70.06 -26.24 63.93 Favored 'General case' 0 N--CA 1.418 -2.064 0 CA-C-N 114.425 -1.261 . . . . 0.0 111.31 -176.733 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 29.3 m-70 -63.67 -39.36 94.14 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -177.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.493 ' O ' HD23 ' A' ' 19' ' ' LEU . 28.0 t90 -63.93 -55.83 19.67 Favored 'General case' 0 CA--C 1.511 -0.544 0 O-C-N 123.814 0.696 . . . . 0.0 109.743 176.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.462 HD11 ' HA ' ' A' ' 13' ' ' SER . 46.4 mt -48.11 -48.71 33.64 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.269 1.028 . . . . 0.0 112.458 -178.213 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.459 HG21 ' O ' ' A' ' 13' ' ' SER . 86.7 t -61.16 -27.08 41.01 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 C-N-CA 122.471 0.308 . . . . 0.0 111.381 -178.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.24 -28.73 65.56 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.735 -0.546 . . . . 0.0 111.735 -176.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.493 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.9 OUTLIER -106.34 17.95 22.68 Favored 'General case' 0 C--O 1.212 -0.87 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.336 179.114 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.5 t 65.91 29.88 10.12 Favored 'General case' 0 C--O 1.208 -1.111 0 CA-C-O 121.575 0.702 . . . . 0.0 110.55 179.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.407 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.7 mm? -107.71 18.79 20.97 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 123.552 0.741 . . . . 0.0 109.989 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -48.91 -32.09 8.39 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.921 0.889 . . . . 0.0 111.444 174.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -59.51 -20.67 57.13 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 124.686 1.195 . . . . 0.0 112.014 178.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -90.45 -19.9 23.35 Favored 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 179.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.414 HG13 ' HG ' ' A' ' 13' ' ' SER . 92.6 t -53.13 -38.01 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 C-N-CA 122.798 0.439 . . . . 0.0 110.722 179.061 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.1 m -50.63 -29.38 10.86 Favored 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 125.706 1.602 . . . . 0.0 112.881 -179.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 18.3 tp10 -117.49 -30.47 5.52 Favored 'General case' 0 N--CA 1.432 -1.359 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.289 178.347 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.44 ' CG ' HD12 ' A' ' 16' ' ' LEU . 1.6 m-85 -54.61 -42.83 71.63 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-O 121.508 0.671 . . . . 0.0 110.938 177.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 45.8 m -84.36 -9.44 58.44 Favored 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.87 -178.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -83.07 -41.24 18.86 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.674 0.75 . . . . 0.0 110.059 179.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.407 ' HG3' HG12 ' A' ' 33' ' ' ILE . 3.7 pt20 -93.21 17.0 11.78 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 59.84 36.57 21.99 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.668 174.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.407 HG12 ' HG3' ' A' ' 31' ' ' GLN . 49.6 mm -70.35 118.19 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.087 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 -179.789 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 91.5 p -107.04 -167.74 1.31 Allowed 'General case' 0 N--CA 1.423 -1.797 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 176.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.482 ' O ' ' HG ' ' A' ' 39' ' ' LEU . . . -63.07 -28.43 72.1 Favored Glycine 0 N--CA 1.43 -1.737 0 N-CA-C 110.647 -0.981 . . . . 0.0 110.647 177.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -54.64 -46.34 73.93 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.538 0.735 . . . . 0.0 110.112 178.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.84 -19.98 23.99 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 120.27 -0.572 . . . . 0.0 112.271 -177.727 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.8 tt -63.94 -48.37 76.79 Favored 'General case' 0 C--N 1.316 -0.882 0 O-C-N 124.536 1.147 . . . . 0.0 108.53 177.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 35' ' ' GLY . 21.7 mt -63.68 -37.29 86.78 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.827 -178.791 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -100.9 20.88 14.59 Favored 'General case' 0 C--N 1.309 -1.161 0 N-CA-C 114.141 1.163 . . . . 0.0 114.141 -177.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.1 mt -54.79 153.53 5.98 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 176.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.49 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 14.3 t70 -159.8 161.93 34.68 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 -176.641 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.91 -34.32 61.42 Favored Glycine 0 CA--C 1.49 -1.504 0 O-C-N 123.569 0.543 . . . . 0.0 112.032 178.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -56.72 -43.94 81.13 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-O 121.031 0.443 . . . . 0.0 110.456 176.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.2 mtpp -68.79 -48.46 63.58 Favored 'General case' 0 C--O 1.193 -1.893 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.82 176.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 80.3 mt -54.99 -35.15 64.05 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-O 121.59 0.71 . . . . 0.0 111.451 -178.129 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.46 ' HA ' HG22 ' A' ' 52' ' ' THR . 22.6 mttm -75.57 -35.72 60.55 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.167 176.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.32 -12.72 60.93 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.144 0.578 . . . . 0.0 111.35 -179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.576 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.4 mm? -74.88 -8.71 57.28 Favored 'General case' 0 C--O 1.22 -0.5 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 172.003 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 71.35 1.29 42.35 Favored Glycine 0 C--O 1.225 -0.418 0 CA-C-N 115.935 -0.575 . . . . 0.0 112.543 178.05 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.577 ' HG3' ' OG ' ' A' ' 53' ' ' SER . 12.0 tpt -87.67 -49.36 7.2 Favored 'General case' 0 N--CA 1.433 -1.314 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -177.353 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.46 HG22 ' HA ' ' A' ' 47' ' ' LYS . 70.7 p 57.93 10.23 1.1 Allowed 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.783 1.633 . . . . 0.0 114.393 172.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.577 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 16.2 m -57.29 118.41 5.07 Favored 'General case' 0 C--N 1.31 -1.135 0 C-N-CA 124.807 1.243 . . . . 0.0 112.22 -175.107 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 p -63.69 -39.93 95.53 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 -172.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.453 HE21 ' CG ' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -71.25 -32.17 68.41 Favored 'General case' 0 CA--C 1.49 -1.336 0 CA-C-O 122.338 1.066 . . . . 0.0 108.904 -179.11 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.649 ' O ' HG12 ' A' ' 60' ' ' VAL . 17.7 m-20 -74.65 -40.85 61.22 Favored 'General case' 0 N--CA 1.413 -2.282 0 CA-C-N 113.137 -1.847 . . . . 0.0 109.369 -178.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.58 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 24.7 mmm-85 -51.43 -36.35 43.42 Favored 'General case' 0 C--O 1.2 -1.519 0 C-N-CA 124.3 1.04 . . . . 0.0 111.132 175.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.44 -35.67 27.33 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.035 0.445 . . . . 0.0 111.894 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.442 HD11 ' HZ3' ' A' ' 63' ' ' LYS . 30.7 tp -80.23 -43.79 20.83 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 120.306 -0.558 . . . . 0.0 112.216 -174.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.649 HG12 ' O ' ' A' ' 56' ' ' ASP . 9.7 p -65.26 -26.1 38.82 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.737 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.178 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.58 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 55.0 tptt -70.36 -31.98 69.47 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 122.734 1.254 . . . . 0.0 108.896 -175.502 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -80.62 -44.75 18.38 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-N 113.118 -1.856 . . . . 0.0 109.026 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.442 ' HZ3' HD11 ' A' ' 59' ' ' LEU . 0.3 OUTLIER -72.31 -35.68 68.71 Favored 'General case' 0 N--CA 1.423 -1.824 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.191 -176.776 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.7 pp -70.0 -13.74 62.37 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 -176.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -98.84 -5.12 31.65 Favored 'General case' 0 C--N 1.309 -1.167 0 C-N-CA 119.026 -1.069 . . . . 0.0 112.275 175.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 . . . . . 0 N--CA 1.478 0.933 0 CA-C-O 122.159 0.98 . . . . 0.0 109.381 -179.754 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.541 HG11 ' CH2' ' A' ' 7' ' ' TRP . 3.9 m . . . . . 0 C--O 1.215 -0.728 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.5 p-80 -72.41 -6.39 43.17 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 121.467 0.651 . . . . 0.0 110.941 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -103.08 -7.01 21.69 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.822 178.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.541 ' CH2' HG11 ' A' ' 4' ' ' VAL . 54.2 m0 -79.69 156.59 27.49 Favored 'General case' 0 CA--C 1.473 -1.996 0 CA-C-O 121.821 0.82 . . . . 0.0 111.607 -178.141 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 7.8 m -111.91 -131.22 0.32 Allowed 'General case' 1 N--CA 1.37 -4.446 0 CA-C-N 113.578 -1.647 . . . . 0.0 106.866 177.037 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.557 ' O ' HG12 ' A' ' 12' ' ' VAL . 59.8 t -95.41 -52.4 9.52 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.991 0 C-N-CA 123.524 0.729 . . . . 0.0 110.628 -170.231 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.7 pm0 -71.18 -19.77 62.37 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 122.36 1.076 . . . . 0.0 109.83 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.506 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 29.3 mt-30 -86.03 -19.4 30.36 Favored 'General case' 0 N--CA 1.413 -2.297 0 CA-C-N 114.158 -1.383 . . . . 0.0 111.787 -176.771 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.557 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.3 p -78.54 -20.98 13.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.778 0.799 . . . . 0.0 109.007 -179.373 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.469 ' HA ' HD11 ' A' ' 16' ' ' LEU . 1.8 m -74.94 -23.85 58.39 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.814 -176.125 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . 0.506 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 87.2 m-70 -61.34 -36.16 79.41 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-O 120.998 0.428 . . . . 0.0 110.44 -179.03 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.436 ' O ' HD22 ' A' ' 19' ' ' LEU . 31.3 t90 -68.09 -59.3 3.35 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.698 176.226 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.497 HD12 ' CD2' ' A' ' 28' ' ' PHE . 44.9 mt -46.49 -50.61 16.77 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.283 1.033 . . . . 0.0 112.326 -177.505 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 13' ' ' SER . 94.0 t -60.55 -26.09 36.6 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.174 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.308 -178.054 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -70.91 -34.35 65.55 Favored Glycine 0 N--CA 1.449 -0.492 0 CA-C-N 116.413 -0.358 . . . . 0.0 112.332 -178.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.453 ' HG ' ' HB2' ' A' ' 21' ' ' LEU . 0.5 OUTLIER -100.52 15.71 27.09 Favored 'General case' 0 C--N 1.317 -0.841 0 O-C-N 122.731 -0.276 . . . . 0.0 111.357 -179.565 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 43.4 m 70.21 18.34 6.94 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.413 1.085 . . . . 0.0 111.415 -179.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.453 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.6 mm? -94.25 18.81 10.31 Favored 'General case' 0 C--N 1.301 -1.537 0 C-N-CA 124.17 0.988 . . . . 0.0 109.422 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -51.64 -26.63 9.38 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.341 1.056 . . . . 0.0 111.212 172.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -62.51 -26.97 68.82 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 124.098 0.959 . . . . 0.0 111.344 177.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -85.1 -19.85 31.25 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.627 -178.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 91.0 t -54.53 -33.35 26.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 122.842 0.457 . . . . 0.0 110.91 178.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 4.4 m -48.61 -39.62 24.58 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.201 1.4 . . . . 0.0 112.266 178.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.615 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 15.5 tp10 -108.59 -30.09 8.41 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.33 -177.328 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.497 ' CD2' HD12 ' A' ' 16' ' ' LEU . 2.7 m-85 -54.09 -36.89 63.67 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.356 0.598 . . . . 0.0 110.795 176.019 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.2 p -73.04 -32.28 64.98 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.359 178.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.08 -31.16 61.15 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.864 -174.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -96.82 0.93 50.09 Favored 'General case' 0 CA--C 1.509 -0.604 0 C-N-CA 119.931 -0.708 . . . . 0.0 110.246 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 62.66 40.1 10.61 Favored 'General case' 0 CA--C 1.509 -0.617 0 O-C-N 123.939 0.774 . . . . 0.0 109.988 179.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 43.7 mm -65.61 128.17 27.99 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.131 0 CA-C-N 115.12 -0.945 . . . . 0.0 108.57 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.9 p -120.14 -168.85 1.69 Allowed 'General case' 0 N--CA 1.428 -1.528 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 174.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.53 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.09 -29.62 73.28 Favored Glycine 0 CA--C 1.502 -0.781 0 N-CA-C 111.881 -0.487 . . . . 0.0 111.881 -177.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -54.47 -47.74 72.6 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 123.252 0.621 . . . . 0.0 109.657 176.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.03 -19.89 27.99 Favored 'General case' 0 C--N 1.312 -1.062 0 C-N-CA 119.535 -0.866 . . . . 0.0 111.52 -177.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.7 tt -67.66 -51.16 53.14 Favored 'General case' 0 CA--C 1.548 0.884 0 O-C-N 124.192 0.932 . . . . 0.0 109.745 -178.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 50.8 mt -62.46 -34.57 77.08 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.473 0.654 . . . . 0.0 111.592 -177.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -101.9 24.92 9.27 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.589 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.451 ' HA ' ' HD3' ' A' ' 45' ' ' LYS . 32.6 mt -63.35 153.1 36.1 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.063 173.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -157.06 172.81 18.01 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 -177.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.433 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -58.8 -40.68 95.38 Favored Glycine 0 C--O 1.204 -1.73 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -51.35 -46.95 62.86 Favored 'General case' 0 CA--C 1.507 -0.705 0 C-N-CA 123.58 0.752 . . . . 0.0 111.539 176.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.47 ' O ' HD23 ' A' ' 49' ' ' LEU . 15.0 mtpp -67.02 -44.05 81.29 Favored 'General case' 0 C--O 1.193 -1.894 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.8 176.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 98.1 mt -59.55 -27.19 65.99 Favored 'General case' 0 C--O 1.256 1.423 0 CA-C-O 121.704 0.764 . . . . 0.0 111.646 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.436 ' HA ' HG23 ' A' ' 52' ' ' THR . 56.3 mtpt -83.98 -34.37 24.4 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.157 178.079 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.67 -12.67 60.24 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 121.79 0.805 . . . . 0.0 110.263 176.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.615 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 3.7 mm? -82.14 2.17 32.72 Favored 'General case' 0 C--O 1.211 -0.949 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.009 173.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 63.06 6.04 11.77 Favored Glycine 0 C--N 1.333 0.397 0 CA-C-N 115.7 -0.682 . . . . 0.0 114.446 175.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 6.5 tpt -88.15 -48.73 7.5 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 -177.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.436 HG23 ' HA ' ' A' ' 47' ' ' LYS . 81.7 p 53.99 21.26 2.8 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 125.471 1.509 . . . . 0.0 114.618 174.449 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.9 t -66.41 117.65 8.94 Favored 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 123.536 0.734 . . . . 0.0 110.032 -179.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.2 m -67.51 -26.78 66.51 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-O 121.005 0.431 . . . . 0.0 110.449 -177.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -58.14 -53.64 55.96 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 122.11 0.957 . . . . 0.0 108.522 173.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.592 ' O ' HG11 ' A' ' 60' ' ' VAL . 67.5 m-20 -71.23 -37.17 72.03 Favored 'General case' 0 N--CA 1.427 -1.596 0 CA-C-N 114.15 -1.386 . . . . 0.0 110.78 -176.476 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -52.76 -27.15 16.58 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.674 0.79 . . . . 0.0 112.768 177.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.34 -37.79 13.79 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.973 176.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -81.21 -64.4 1.2 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.434 -172.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.592 HG11 ' O ' ' A' ' 56' ' ' ASP . 3.4 p -58.9 -23.01 22.77 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.839 0 CA-C-O 121.431 0.634 . . . . 0.0 111.249 -175.268 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -68.05 -33.25 74.22 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.809 -178.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt -84.22 -30.87 25.38 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-N 114.882 -1.054 . . . . 0.0 109.727 -178.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.404 ' CB ' HD13 ' A' ' 19' ' ' LEU . 1.4 tppt? -77.43 -41.46 39.73 Favored 'General case' 0 C--N 1.298 -1.647 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.041 -177.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 pp -61.89 -32.67 73.06 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.02 0.438 . . . . 0.0 112.049 -175.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -76.77 -28.14 55.58 Favored 'General case' 0 C--N 1.31 -1.113 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.098 -178.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 . . . . . 0 C--N 1.322 -0.614 0 CA-C-O 121.34 0.59 . . . . 0.0 110.195 -178.373 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.586 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.1 m . . . . . 0 N--CA 1.444 -0.758 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.0 p-80 -68.65 -12.05 60.88 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-O 121.272 0.558 . . . . 0.0 111.154 176.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -97.88 -0.3 45.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.127 178.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.505 ' O ' ' HB2' ' A' ' 34' ' ' SER . 52.2 m0 -82.31 143.77 31.06 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.983 -179.114 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.5 m -99.63 -73.74 0.62 Allowed 'General case' 0 N--CA 1.428 -1.538 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.355 -175.012 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.414 ' O ' HG13 ' A' ' 12' ' ' VAL . 98.4 t -143.44 -65.48 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.198 -1.615 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.483 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 -59.74 -27.24 66.33 Favored 'General case' 0 C--N 1.312 -1.024 0 C-N-CA 124.076 0.951 . . . . 0.0 112.465 -177.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.558 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 43.3 mt-30 -72.6 -18.88 61.56 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.881 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.414 HG13 ' O ' ' A' ' 9' ' ' VAL . 0.8 OUTLIER -78.83 -28.14 13.93 Favored 'Isoleucine or valine' 0 C--O 1.243 0.731 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -178.179 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.507 ' O ' HG21 ' A' ' 17' ' ' VAL . 1.2 m -67.88 -34.5 76.77 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.359 -176.599 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . 0.558 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 30.6 m-70 -59.13 -36.41 75.15 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.737 0.648 . . . . 0.0 109.631 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.447 ' O ' HD23 ' A' ' 19' ' ' LEU . 25.0 t90 -67.18 -59.04 3.78 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.74 176.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.443 HD11 ' CG ' ' A' ' 28' ' ' PHE . 31.4 mt -47.3 -48.82 24.88 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 124.441 1.088 . . . . 0.0 112.218 -177.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.507 HG21 ' O ' ' A' ' 13' ' ' SER . 64.9 t -61.2 -25.82 37.44 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.014 0 CA-C-O 120.882 0.373 . . . . 0.0 111.198 -178.062 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.76 -28.63 64.7 Favored Glycine 0 CA--C 1.505 -0.567 0 N-CA-C 111.754 -0.539 . . . . 0.0 111.754 -176.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.447 HD23 ' O ' ' A' ' 15' ' ' TRP . 1.2 pt? -105.78 16.02 25.87 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.223 178.603 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.8 m 66.59 21.69 10.65 Favored 'General case' 0 C--O 1.206 -1.197 0 C-N-CA 123.825 0.85 . . . . 0.0 112.318 -179.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.411 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 2.1 mm? -95.98 19.98 10.74 Favored 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 123.795 0.838 . . . . 0.0 109.129 178.384 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -55.22 -20.66 11.42 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.091 0.956 . . . . 0.0 111.399 175.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -69.14 -22.17 63.96 Favored 'General case' 0 C--N 1.305 -1.353 0 C-N-CA 124.065 0.946 . . . . 0.0 111.033 177.525 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.507 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 2.6 m-85 -87.5 -20.65 26.23 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.384 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 93.6 t -52.14 -38.18 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 36.7 t -54.01 -41.19 67.71 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 123.455 0.472 . . . . 0.0 111.168 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 13.1 tp10 -96.56 -31.31 12.83 Favored 'General case' 0 N--CA 1.44 -0.961 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.264 -177.279 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.443 ' CG ' HD11 ' A' ' 16' ' ' LEU . 2.7 m-85 -55.91 -39.86 72.23 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.197 0.522 . . . . 0.0 110.438 175.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.4 m -71.83 -30.78 65.84 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.336 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.11 -35.75 71.91 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.681 -175.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -98.27 2.72 48.49 Favored 'General case' 0 C--N 1.313 -1.012 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.91 -178.799 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 62.66 37.56 12.74 Favored 'General case' 0 CA--C 1.504 -0.792 0 C-N-CA 123.383 0.673 . . . . 0.0 109.553 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.7 mm -67.45 110.69 1.85 Allowed 'Isoleucine or valine' 0 N--CA 1.434 -1.246 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.505 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 84.7 p -99.3 -169.79 1.81 Allowed 'General case' 0 N--CA 1.421 -1.886 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.584 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.586 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -66.69 -23.19 72.23 Favored Glycine 0 N--CA 1.436 -1.346 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 179.216 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.53 -46.34 89.16 Favored 'General case' 0 N--CA 1.442 -0.828 0 C-N-CA 124.09 0.956 . . . . 0.0 109.546 178.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.76 -19.97 25.36 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.6 -179.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.8 tt -62.78 -50.39 71.23 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 124.492 1.117 . . . . 0.0 108.927 178.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.0 mt -58.71 -41.53 86.58 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.13 -177.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -97.07 16.17 20.39 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.443 -175.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.404 ' HB2' HD23 ' A' ' 64' ' ' LEU . 34.1 mt -57.42 154.59 10.59 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.69 0.757 . . . . 0.0 112.556 176.738 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -159.9 168.17 26.38 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -50.78 -40.09 40.69 Favored Glycine 0 C--O 1.204 -1.75 0 O-C-N 123.95 0.781 . . . . 0.0 111.739 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -51.99 -49.02 64.11 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 178.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.433 ' O ' HD23 ' A' ' 49' ' ' LEU . 12.8 mtpp -67.99 -46.86 70.12 Favored 'General case' 0 C--O 1.196 -1.724 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.259 177.577 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 74.1 mt -59.27 -26.49 64.98 Favored 'General case' 0 C--O 1.255 1.381 0 C-N-CA 123.554 0.742 . . . . 0.0 112.271 -177.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.464 ' HA ' HG22 ' A' ' 52' ' ' THR . 57.0 mtpt -79.5 -37.23 37.21 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.735 175.596 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.98 -9.88 59.2 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.532 0.682 . . . . 0.0 110.682 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.523 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.2 mm? -82.24 0.6 40.53 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.423 -0.808 . . . . 0.0 108.987 173.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 67.78 4.12 31.71 Favored Glycine 0 C--O 1.224 -0.484 0 N-CA-C 114.607 0.603 . . . . 0.0 114.607 174.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.507 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 14.5 tpt -94.76 -48.86 5.86 Favored 'General case' 0 C--N 1.311 -1.108 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.343 -178.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.464 HG22 ' HA ' ' A' ' 47' ' ' LYS . 62.3 p 59.38 2.9 0.34 Allowed 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 126.489 1.916 . . . . 0.0 115.471 174.296 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.494 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 20.3 m -55.35 123.52 14.11 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 125.191 1.397 . . . . 0.0 113.705 -174.073 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.8 t -61.76 -48.02 82.57 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 -173.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.0 pp0? -64.81 -38.35 90.69 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 122.135 0.969 . . . . 0.0 108.576 -176.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.644 ' O ' HG13 ' A' ' 60' ' ' VAL . 7.5 m-20 -70.24 -47.24 62.21 Favored 'General case' 0 N--CA 1.42 -1.934 0 CA-C-N 113.458 -1.701 . . . . 0.0 109.553 -174.086 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.478 ' HA ' ' CG1' ' A' ' 60' ' ' VAL . 44.2 mtm180 -68.28 -11.98 60.31 Favored 'General case' 0 C--O 1.213 -0.829 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 179.26 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.69 -30.04 19.42 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 174.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 36.9 tp -86.38 -44.99 11.61 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.478 -176.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.644 HG13 ' O ' ' A' ' 56' ' ' ASP . 5.0 p -61.62 -26.59 40.07 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.134 0 CA-C-O 121.405 0.622 . . . . 0.0 109.538 177.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 54.1 tptt -74.4 -27.0 60.44 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.135 -174.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -82.22 -45.87 14.48 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 113.827 -1.533 . . . . 0.0 108.478 177.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.406 ' HE3' ' CB ' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -67.01 -42.16 85.43 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.513 -175.613 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.404 HD23 ' HB2' ' A' ' 41' ' ' LEU . 3.7 pp -62.9 -30.6 71.66 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -177.234 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.3 ptmm? -87.13 -11.12 51.01 Favored 'General case' 0 C--N 1.309 -1.165 0 C-N-CA 118.927 -1.109 . . . . 0.0 111.68 -177.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 . . . . . 0 C--N 1.315 -0.932 0 C-N-CA 120.939 -0.304 . . . . 0.0 110.313 -179.985 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.532 ' HA ' ' CD2' ' A' ' 7' ' ' TRP . 3.9 m . . . . . 0 C--O 1.219 -0.516 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.2 p-80 -74.19 -9.77 58.95 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-O 121.179 0.514 . . . . 0.0 111.494 -178.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -90.42 -9.82 46.12 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 178.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.532 ' CD2' ' HA ' ' A' ' 4' ' ' VAL . 48.3 m0 -84.0 135.37 34.47 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.237 -177.047 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.421 ' O ' ' HB3' ' A' ' 34' ' ' SER . 16.1 m -93.3 -69.63 0.74 Allowed 'General case' 0 C--N 1.298 -1.631 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.638 -178.339 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.533 ' O ' HG12 ' A' ' 12' ' ' VAL . 61.4 t -143.81 -62.33 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 -179.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.35 -37.47 48.05 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 124.667 1.187 . . . . 0.0 111.952 179.217 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -78.57 -20.07 51.41 Favored 'General case' 0 N--CA 1.435 -1.177 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -174.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.533 HG12 ' O ' ' A' ' 9' ' ' VAL . 2.6 p -70.88 -22.36 23.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 CA-C-O 121.707 0.765 . . . . 0.0 109.218 -178.526 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.479 ' O ' HG21 ' A' ' 17' ' ' VAL . 1.4 m -73.76 -26.49 60.69 Favored 'General case' 0 N--CA 1.423 -1.807 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.363 -176.159 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 53.7 m-70 -60.48 -42.33 96.05 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 123.414 0.446 . . . . 0.0 110.142 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.488 ' O ' HD22 ' A' ' 19' ' ' LEU . 36.0 t90 -63.13 -59.21 5.07 Favored 'General case' 0 N--CA 1.442 -0.831 0 O-C-N 123.825 0.703 . . . . 0.0 109.749 177.329 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.416 HD11 ' CD2' ' A' ' 28' ' ' PHE . 43.9 mt -47.53 -51.21 21.46 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 124.43 1.081 . . . . 0.0 112.266 -178.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.479 HG21 ' O ' ' A' ' 13' ' ' SER . 78.1 t -61.92 -26.86 41.09 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 CA-C-O 120.822 0.344 . . . . 0.0 111.219 -177.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -71.13 -29.2 69.04 Favored Glycine 0 C--O 1.223 -0.544 0 N-CA-C 111.945 -0.462 . . . . 0.0 111.945 -177.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.488 HD22 ' O ' ' A' ' 15' ' ' TRP . 0.5 OUTLIER -104.96 16.16 26.43 Favored 'General case' 0 C--N 1.314 -0.94 0 O-C-N 122.334 -0.51 . . . . 0.0 111.04 177.649 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 62.5 m 62.65 34.3 15.02 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 122.326 1.06 . . . . 0.0 111.497 -178.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.548 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -104.02 17.14 24.72 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 125.105 1.362 . . . . 0.0 108.552 176.792 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -54.96 -25.41 29.47 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.561 178.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.548 ' NE2' ' HA ' ' A' ' 21' ' ' LEU . 0.6 OUTLIER -69.36 -20.31 63.84 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 119.996 -0.682 . . . . 0.0 111.853 177.126 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.408 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 3.8 m-85 -82.08 -19.49 40.11 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.153 -179.694 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 97.7 t -56.05 -36.32 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 O-C-N 123.212 0.32 . . . . 0.0 110.506 177.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 39.0 t -50.37 -38.75 44.05 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.246 1.018 . . . . 0.0 111.573 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.646 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 19.0 tp10 -105.12 -32.71 8.56 Favored 'General case' 0 C--N 1.312 -1.058 0 O-C-N 121.962 -0.461 . . . . 0.0 110.917 -178.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.416 ' CD2' HD11 ' A' ' 16' ' ' LEU . 2.1 m-85 -55.17 -40.6 70.86 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-O 121.72 0.771 . . . . 0.0 110.3 176.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 33.8 t -79.03 -21.81 46.37 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.52 -178.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.47 -38.41 62.93 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.0 0.429 . . . . 0.0 110.654 -177.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -101.35 16.35 25.85 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 59.03 39.56 23.26 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 121.194 0.521 . . . . 0.0 111.362 174.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.455 HG21 ' HB2' ' A' ' 37' ' ' GLN . 49.9 mm -71.44 111.43 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.385 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.473 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.421 ' HB3' ' O ' ' A' ' 8' ' ' SER . 65.9 p -105.81 -169.85 1.65 Allowed 'General case' 0 N--CA 1.418 -2.051 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.493 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.14 -25.8 66.82 Favored Glycine 0 N--CA 1.436 -1.303 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.695 176.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -59.78 -36.74 77.3 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 123.379 0.672 . . . . 0.0 109.621 179.083 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.455 ' HB2' HG21 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -89.96 -40.08 12.58 Favored 'General case' 0 C--O 1.215 -0.747 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.326 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.429 HD12 HG21 ' A' ' 12' ' ' VAL . 3.4 tt -49.7 -48.69 49.63 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.971 1.708 . . . . 0.0 111.268 -174.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 29.5 mt -61.96 -40.73 96.57 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.018 -177.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -97.14 11.37 36.52 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -176.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 46.8 mt -53.86 150.29 7.77 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 121.446 0.641 . . . . 0.0 112.618 178.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.422 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 25.8 t70 -153.82 179.51 8.8 Favored 'General case' 0 C--N 1.295 -1.793 0 N-CA-C 105.707 -1.96 . . . . 0.0 105.707 178.187 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -60.92 -35.98 91.37 Favored Glycine 0 CA--C 1.488 -1.655 0 N-CA-C 110.971 -0.852 . . . . 0.0 110.971 -179.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -52.93 -47.66 67.86 Favored 'General case' 0 CA--C 1.498 -1.036 0 C-N-CA 123.322 0.649 . . . . 0.0 111.453 177.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.4 mtpp -68.82 -44.04 74.32 Favored 'General case' 0 C--O 1.192 -1.962 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.063 177.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 90.0 mt -58.58 -31.0 67.61 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-O 121.702 0.763 . . . . 0.0 111.392 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.479 ' HA ' HG21 ' A' ' 52' ' ' THR . 74.1 mttt -77.71 -26.55 50.18 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.897 177.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.21 -5.48 58.53 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-O 121.691 0.758 . . . . 0.0 110.215 178.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.646 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.5 mm? -83.97 -5.49 59.23 Favored 'General case' 0 C--O 1.203 -1.371 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 172.768 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.21 -7.29 8.27 Favored Glycine 0 C--O 1.222 -0.626 0 CA-C-N 116.114 -0.494 . . . . 0.0 113.534 176.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.408 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 14.1 tpt -81.08 -50.42 9.66 Favored 'General case' 0 N--CA 1.432 -1.364 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 -177.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.479 HG21 ' HA ' ' A' ' 47' ' ' LYS . 80.5 p 57.3 14.37 2.1 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.422 1.489 . . . . 0.0 114.507 173.531 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 70.9 m -63.26 129.2 39.27 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 123.801 0.84 . . . . 0.0 112.238 -174.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.8 t -61.15 -47.28 86.94 Favored 'General case' 0 C--O 1.241 0.631 0 C-N-CA 124.59 1.156 . . . . 0.0 112.81 -172.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -54.22 -55.48 27.61 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 122.234 1.016 . . . . 0.0 108.983 177.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.751 ' O ' HG12 ' A' ' 60' ' ' VAL . 4.5 m-20 -60.16 -45.89 91.54 Favored 'General case' 0 N--CA 1.417 -2.121 0 CA-C-N 113.161 -1.836 . . . . 0.0 109.425 -175.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -48.52 -34.13 10.76 Favored 'General case' 0 CA--C 1.507 -0.71 0 C-N-CA 124.411 1.084 . . . . 0.0 112.958 178.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -94.47 -40.34 9.94 Favored 'General case' 0 C--N 1.306 -1.314 0 O-C-N 123.714 0.634 . . . . 0.0 110.873 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.415 HD13 ' HZ3' ' A' ' 63' ' ' LYS . 53.7 tp -68.81 -51.99 34.93 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -175.126 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.751 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.5 p -67.2 -21.84 28.48 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.249 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.9 tmtt? -70.8 -30.34 66.78 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -178.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.647 ' O ' ' HG2' ' A' ' 65' ' ' LYS . 85.8 tttt -83.17 -42.13 17.67 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 114.447 -1.252 . . . . 0.0 109.134 179.368 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.471 ' CB ' HD11 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -69.54 -28.5 66.07 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.399 -179.396 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.9 pp -79.88 -16.71 54.83 Favored 'General case' 0 C--O 1.204 -1.311 0 CA-C-O 120.971 0.415 . . . . 0.0 111.198 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.647 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 14.5 ptmm? -82.65 -17.07 45.91 Favored 'General case' 0 C--N 1.295 -1.8 0 C-N-CA 118.026 -1.47 . . . . 0.0 109.201 175.665 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 . . . . . 0 N--CA 1.439 -0.986 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.913 -179.925 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.532 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 17.2 m . . . . . 0 C--O 1.21 -0.974 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 11.3 p-80 -73.36 -11.51 60.51 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-O 121.533 0.682 . . . . 0.0 110.749 -178.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -95.42 1.46 54.17 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.133 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.505 ' CH2' HG11 ' A' ' 4' ' ' VAL . 54.5 m0 -85.64 139.85 31.05 Favored 'General case' 0 CA--C 1.492 -1.259 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 176.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.2 m -94.18 -77.48 0.46 Allowed 'General case' 0 N--CA 1.419 -1.991 0 O-C-N 123.698 0.624 . . . . 0.0 110.701 -177.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.481 ' O ' HG11 ' A' ' 12' ' ' VAL . 55.2 t -141.43 -54.23 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-O 121.601 0.715 . . . . 0.0 109.661 -176.415 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.1 pm0 -77.31 -14.9 59.65 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.644 -178.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.411 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 38.9 mt-30 -83.57 -19.55 35.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.211 179.36 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.481 HG11 ' O ' ' A' ' 9' ' ' VAL . 1.9 p -72.63 -25.39 22.56 Favored 'Isoleucine or valine' 0 C--O 1.242 0.671 0 CA-C-O 121.851 0.834 . . . . 0.0 109.489 -177.627 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.416 ' HB3' ' CG1' ' A' ' 25' ' ' VAL . 0.7 OUTLIER -71.07 -29.21 65.02 Favored 'General case' 0 N--CA 1.427 -1.623 0 CA-C-N 115.012 -0.994 . . . . 0.0 111.397 -175.497 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . 0.411 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 71.5 m-70 -59.91 -36.9 77.96 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 121.417 0.627 . . . . 0.0 109.77 -178.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.523 ' O ' HD21 ' A' ' 19' ' ' LEU . 32.6 t90 -68.04 -59.65 3.09 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.123 177.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.451 HD11 ' CD2' ' A' ' 28' ' ' PHE . 44.1 mt -48.22 -51.01 27.27 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.103 0.961 . . . . 0.0 112.231 -177.688 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 90.7 t -60.35 -24.54 31.32 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.959 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.317 -178.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.88 -37.67 50.38 Favored Glycine 0 N--CA 1.441 -1.02 0 N-CA-C 111.413 -0.675 . . . . 0.0 111.413 -177.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.523 HD21 ' O ' ' A' ' 15' ' ' TRP . 0.9 OUTLIER -98.13 18.18 16.78 Favored 'General case' 0 C--N 1.32 -0.704 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.672 -179.844 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.8 m 67.89 23.52 8.34 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-O 122.151 0.977 . . . . 0.0 111.466 179.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.441 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.3 mm? -99.94 20.06 15.04 Favored 'General case' 0 C--N 1.299 -1.611 0 C-N-CA 124.321 1.048 . . . . 0.0 109.538 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -53.08 -27.0 18.13 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.422 1.089 . . . . 0.0 110.373 174.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -61.46 -21.8 64.49 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 125.414 1.486 . . . . 0.0 111.374 178.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.567 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 5.3 m-85 -93.35 -21.02 19.8 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 116.031 -0.532 . . . . 0.0 112.152 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.416 ' CG1' ' HB3' ' A' ' 13' ' ' SER . 98.4 t -53.14 -39.53 34.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 O-C-N 123.346 0.404 . . . . 0.0 111.843 -179.389 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.2 m -52.46 -38.29 58.98 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 123.76 0.663 . . . . 0.0 112.1 -177.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 15.3 tp10 -103.93 -30.04 10.57 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.565 -177.43 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.451 ' CD2' HD11 ' A' ' 16' ' ' LEU . 1.7 m-85 -56.99 -47.55 80.56 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-O 121.529 0.68 . . . . 0.0 110.541 177.062 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.1 m -81.3 -5.26 57.62 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.351 -178.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -87.85 -41.21 13.39 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.747 178.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -91.5 8.16 37.82 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 120.088 -0.645 . . . . 0.0 110.793 -177.637 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.486 ' N ' HD21 ' A' ' 32' ' ' ASN . 0.7 OUTLIER 64.89 38.06 6.73 Favored 'General case' 0 CA--C 1.507 -0.7 0 O-C-N 124.045 0.841 . . . . 0.0 109.168 179.166 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 49.0 mm -71.64 109.52 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.311 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 -179.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.409 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 97.1 p -103.94 -167.22 1.34 Allowed 'General case' 0 N--CA 1.432 -1.367 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.574 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.532 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -63.82 -24.62 68.43 Favored Glycine 0 N--CA 1.436 -1.353 0 N-CA-C 111.685 -0.566 . . . . 0.0 111.685 178.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -60.27 -43.43 96.22 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 177.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.6 -17.74 25.11 Favored 'General case' 0 N--CA 1.436 -1.132 0 C-N-CA 119.921 -0.711 . . . . 0.0 112.489 179.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.2 tt -66.34 -49.99 65.1 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 124.18 0.992 . . . . 0.0 109.48 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.9 mt -63.9 -34.6 78.33 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.223 0.535 . . . . 0.0 112.0 -177.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -100.47 15.1 29.01 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -177.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.404 HD22 ' HD3' ' A' ' 45' ' ' LYS . 40.8 mt -53.11 152.17 4.42 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-O 121.759 0.79 . . . . 0.0 112.976 177.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -155.35 167.48 30.23 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 105.666 -1.975 . . . . 0.0 105.666 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.538 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -54.17 -38.8 62.19 Favored Glycine 0 CA--C 1.493 -1.339 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 177.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -50.9 -49.19 59.95 Favored 'General case' 0 CA--C 1.503 -0.844 0 C-N-CA 123.244 0.618 . . . . 0.0 111.843 178.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.404 ' HD3' HD22 ' A' ' 41' ' ' LEU . 13.2 mtpp -64.67 -46.48 82.26 Favored 'General case' 0 C--O 1.196 -1.762 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.119 178.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 93.3 mt -57.22 -35.41 69.63 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-O 121.735 0.779 . . . . 0.0 111.272 -179.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.538 ' HG3' ' O ' ' A' ' 43' ' ' GLY . 55.5 mtpt -71.48 -35.12 70.71 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.315 178.14 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.6 -8.73 58.93 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.254 0.55 . . . . 0.0 110.864 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.41 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.0 mm? -85.26 -2.51 58.13 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.76 0.791 . . . . 0.0 108.963 174.144 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.84 0.84 57.19 Favored Glycine 0 N--CA 1.445 -0.76 0 CA-C-N 115.202 -0.908 . . . . 0.0 114.846 174.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.567 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 16.7 tpt -83.65 -56.11 3.9 Favored 'General case' 0 CA--C 1.492 -1.277 0 C-N-CA 119.359 -0.937 . . . . 0.0 109.84 -178.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.466 HG23 ' HA ' ' A' ' 47' ' ' LYS . 76.7 p 53.02 40.73 31.67 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.086 0.954 . . . . 0.0 111.991 175.246 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.61 ' HB3' ' OD1' ' A' ' 56' ' ' ASP . 32.6 t -75.88 -179.77 5.04 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 177.116 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.3 m -107.74 -23.23 12.18 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 174.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -69.52 -42.6 74.47 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.857 -178.722 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.648 ' O ' HG12 ' A' ' 60' ' ' VAL . 8.9 p-10 -75.14 -41.38 58.44 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.065 -175.042 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 54.5 mmm-85 -55.55 -19.8 11.19 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.958 0.903 . . . . 0.0 112.357 -176.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -101.19 -35.85 9.15 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.082 175.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.442 HD13 ' HZ1' ' A' ' 63' ' ' LYS . 30.6 tp -84.01 -53.97 5.18 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 -174.051 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.648 HG12 ' O ' ' A' ' 56' ' ' ASP . 8.1 p -64.28 -24.41 35.61 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.239 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -178.693 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -69.53 -30.11 67.86 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 114.423 -1.262 . . . . 0.0 108.906 -176.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.51 ' HB2' ' HZ1' ' A' ' 62' ' ' LYS . 3.8 ttmp? -86.49 -38.52 17.18 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-N 114.026 -1.443 . . . . 0.0 109.353 -178.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.442 ' HZ1' HD13 ' A' ' 59' ' ' LEU . 0.7 OUTLIER -71.47 -41.5 69.29 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 114.954 -1.021 . . . . 0.0 111.382 -177.508 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 pp -63.49 -31.5 72.69 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.996 -175.551 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -78.84 -26.91 44.15 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 119.841 -0.743 . . . . 0.0 111.644 -177.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 . . . . . 0 N--CA 1.444 -0.772 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.037 -177.468 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.468 ' H1 ' ' CD ' ' A' ' 6' ' ' GLU . . . . . . . . 0 CA--C 1.504 -0.615 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 43.5 p-80 -152.83 11.27 0.49 Allowed 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 5.0 mpp? -80.41 161.1 25.12 Favored 'General case' 0 N--CA 1.421 -1.895 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.597 -172.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.481 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 2.7 m -74.64 -29.66 23.77 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.959 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -169.037 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -70.58 -7.72 46.12 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.751 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.468 ' CD ' ' H1 ' ' A' ' 1' ' ' GLY . 32.3 mt-10 -101.85 -7.83 22.16 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.203 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.45 ' HA ' HE21 ' A' ' 11' ' ' GLN . 53.5 m0 -71.28 144.59 49.94 Favored 'General case' 0 CA--C 1.501 -0.92 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.1 m -94.84 -71.73 0.65 Allowed 'General case' 0 N--CA 1.419 -1.98 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.615 -173.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 74.9 t -146.08 -68.13 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.203 -1.376 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.2 pm0 -63.76 -20.82 66.05 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.914 -0.585 . . . . 0.0 112.445 -175.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.483 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 28.0 mt-30 -77.71 -13.31 59.94 Favored 'General case' 0 C--O 1.217 -0.61 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.1 p -77.16 -19.58 14.36 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.379 0 CA-C-O 121.393 0.616 . . . . 0.0 109.48 178.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 83.3 p -70.81 -39.25 73.17 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.948 -175.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . 0.483 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 42.5 m-70 -50.37 -36.58 33.15 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 114.392 -1.276 . . . . 0.0 110.92 -179.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.465 ' CH2' HG23 ' A' ' 60' ' ' VAL . 24.7 t90 -71.15 -61.85 1.61 Allowed 'General case' 0 N--CA 1.423 -1.788 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.784 175.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.429 HD12 ' CD2' ' A' ' 28' ' ' PHE . 44.5 mt -46.68 -49.07 19.9 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.474 1.11 . . . . 0.0 112.419 -177.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 99.5 t -59.35 -29.53 42.19 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.321 0 C-N-CA 122.74 0.416 . . . . 0.0 111.176 -179.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -72.39 -27.37 69.87 Favored Glycine 0 N--CA 1.447 -0.621 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.179 -176.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.463 HD22 ' O ' ' A' ' 15' ' ' TRP . 1.2 pt? -106.94 15.51 25.3 Favored 'General case' 0 C--N 1.317 -0.847 0 O-C-N 122.586 -0.361 . . . . 0.0 111.064 179.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.3 t 74.46 16.42 3.28 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-O 122.178 0.989 . . . . 0.0 111.523 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -93.95 17.85 11.56 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 114.914 -1.039 . . . . 0.0 109.629 -177.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -50.94 -30.79 15.79 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-O 121.538 0.685 . . . . 0.0 111.196 174.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -59.54 -25.74 64.78 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 124.593 1.157 . . . . 0.0 110.834 178.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -88.7 -21.96 23.63 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.774 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.7 t -55.85 -35.09 38.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 122.665 0.386 . . . . 0.0 111.338 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.8 m -57.32 -30.05 64.44 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 123.815 0.846 . . . . 0.0 111.879 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.591 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 21.1 tp10 -109.55 -35.99 6.08 Favored 'General case' 0 N--CA 1.431 -1.377 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.416 -178.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.429 ' CD2' HD12 ' A' ' 16' ' ' LEU . 1.9 m-85 -53.67 -43.44 68.87 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-O 121.411 0.624 . . . . 0.0 110.795 177.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.7 m -77.07 -23.04 52.0 Favored 'General case' 0 N--CA 1.44 -0.972 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.718 -177.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.87 -39.48 69.62 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.624 -178.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.32 9.33 40.26 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.288 -178.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 61.63 42.2 11.31 Favored 'General case' 0 C--O 1.234 0.271 0 O-C-N 123.611 0.569 . . . . 0.0 110.453 177.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.9 mm -72.18 114.25 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.013 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 90.2 p -107.37 -167.85 1.32 Allowed 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 178.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.481 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.17 -27.74 69.56 Favored Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 111.311 -0.716 . . . . 0.0 111.311 178.181 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -55.34 -42.75 74.24 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.044 0.937 . . . . 0.0 110.224 178.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.544 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -94.61 -24.74 17.08 Favored 'General case' 0 N--CA 1.433 -1.286 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.218 -179.271 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.4 tt -57.2 -52.73 64.14 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.868 1.267 . . . . 0.0 109.605 177.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.8 mt -62.58 -38.71 91.17 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -175.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -99.88 10.55 41.12 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -175.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 37' ' ' GLN . 40.5 mt -50.71 135.1 24.03 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 178.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -134.21 179.48 6.24 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 176.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.407 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -55.67 -42.76 85.74 Favored Glycine 0 C--O 1.204 -1.764 0 CA-C-O 119.238 -0.757 . . . . 0.0 112.699 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -55.33 -43.33 74.85 Favored 'General case' 0 CA--C 1.488 -1.409 0 CA-C-N 117.459 0.629 . . . . 0.0 111.873 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.6 mtpp -65.23 -49.5 69.42 Favored 'General case' 0 C--O 1.196 -1.754 0 O-C-N 123.763 0.665 . . . . 0.0 110.817 176.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 91.1 mt -60.0 -30.95 69.48 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.848 0.833 . . . . 0.0 111.391 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.467 ' HA ' HG22 ' A' ' 52' ' ' THR . 58.7 mtpt -77.68 -30.24 51.84 Favored 'General case' 0 N--CA 1.426 -1.659 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.127 177.339 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.38 -4.32 47.63 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.224 0.535 . . . . 0.0 111.267 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.591 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.3 mm? -84.94 -7.56 59.11 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 171.191 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.85 -1.26 39.95 Favored Glycine 0 C--O 1.223 -0.578 0 CA-C-N 115.879 -0.601 . . . . 0.0 113.719 176.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.407 ' C ' ' HG1' ' A' ' 52' ' ' THR . 15.3 tpt -85.32 -50.18 7.55 Favored 'General case' 0 C--N 1.307 -1.239 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 -178.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.467 HG22 ' HA ' ' A' ' 47' ' ' LYS . 74.8 p 52.88 31.72 11.24 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 123.995 0.918 . . . . 0.0 112.168 174.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.2 t -73.08 129.76 38.79 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.768 -175.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.6 t -53.66 -54.86 31.78 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 125.061 1.344 . . . . 0.0 113.118 -176.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -50.65 -55.88 14.4 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-O 122.513 1.149 . . . . 0.0 109.914 177.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.766 ' O ' HG12 ' A' ' 60' ' ' VAL . 6.3 m-20 -62.0 -42.16 98.85 Favored 'General case' 0 N--CA 1.412 -2.345 0 CA-C-N 113.055 -1.884 . . . . 0.0 111.105 -173.188 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -52.79 -25.64 11.95 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 177.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -101.35 -38.47 8.03 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-O 120.879 0.371 . . . . 0.0 110.985 176.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 56.0 tp -72.67 -55.2 7.18 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -174.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.766 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.4 p -59.88 -26.4 35.47 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.032 0 CA-C-O 121.637 0.732 . . . . 0.0 109.16 -179.249 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.409 ' HA ' ' CD2' ' A' ' 64' ' ' LEU . 55.9 tptt -72.01 -28.92 63.71 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 113.655 -1.612 . . . . 0.0 110.16 -172.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -84.44 -40.21 18.03 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 114.73 -1.123 . . . . 0.0 108.655 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.0 tppt? -69.43 -42.46 74.94 Favored 'General case' 0 C--N 1.297 -1.686 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.201 -175.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.416 ' HA ' ' HG2' ' A' ' 67' ' ' MET . 3.7 pp -65.73 -30.06 70.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.343 -175.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -82.68 -22.13 34.68 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 119.701 -0.8 . . . . 0.0 111.711 -179.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -100.58 7.77 43.83 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.06 0.457 . . . . 0.0 110.205 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.438 ' SD ' ' CD1' ' A' ' 15' ' ' TRP . 49.0 mmm -53.52 -24.28 12.84 Favored 'General case' 0 CA--C 1.488 -1.428 0 N-CA-C 113.72 1.007 . . . . 0.0 113.72 -179.005 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -62.17 -28.04 69.39 Favored 'General case' 0 C--N 1.286 -2.18 0 CA-C-N 115.059 -0.973 . . . . 0.0 112.55 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 19.0 ptp -104.48 -28.18 11.46 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 174.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 18.6 m -76.86 -28.84 55.58 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.634 -173.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.0 pp -58.79 -33.9 70.86 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 121.474 0.654 . . . . 0.0 111.761 -179.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -81.32 -50.11 9.9 Favored 'General case' 0 N--CA 1.403 -2.789 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.379 -176.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 50.7 mttm -83.45 -20.58 33.8 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.087 -0.961 . . . . 0.0 111.679 -169.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.319 0 C-N-CA 125.542 1.537 . . . . 0.0 112.626 176.924 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.744 0 N-CA-C 109.908 -1.277 . . . . 0.0 109.908 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 41.3 p-80 -80.54 -3.21 49.29 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -175.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 65.2 mtt -67.3 158.06 32.45 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 121.432 0.634 . . . . 0.0 112.533 -175.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.497 HG12 ' CH2' ' A' ' 7' ' ' TRP . 4.3 m -71.02 -26.04 26.81 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.253 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -167.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 12.3 p-80 -71.12 -12.69 61.63 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-O 121.268 0.556 . . . . 0.0 110.643 178.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -91.66 -7.9 48.63 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.85 178.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.497 ' CH2' HG12 ' A' ' 4' ' ' VAL . 49.2 m0 -82.66 147.45 28.51 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 -179.345 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 58.0 m -115.75 -69.21 0.87 Allowed 'General case' 0 N--CA 1.416 -2.162 0 O-C-N 123.422 0.451 . . . . 0.0 110.917 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.401 ' O ' HG13 ' A' ' 12' ' ' VAL . 59.3 t -141.58 -60.56 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -178.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.7 pm0 -70.29 9.58 0.58 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.629 -1.168 . . . . 0.0 113.865 -177.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.418 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 18.8 mt-30 -123.15 -11.9 7.96 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 175.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.411 HG22 HD12 ' A' ' 38' ' ' LEU . 4.2 p -77.4 -19.52 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-O 122.488 1.137 . . . . 0.0 108.474 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.9 p -67.53 -40.38 85.05 Favored 'General case' 0 N--CA 1.425 -1.676 0 C-N-CA 125.692 1.597 . . . . 0.0 112.376 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . 0.418 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 45.1 m-70 -57.61 -38.57 75.15 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.266 -177.287 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.466 ' O ' HD22 ' A' ' 19' ' ' LEU . 42.5 t90 -64.94 -61.06 2.39 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.488 176.141 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.1 mt -45.37 -52.62 9.69 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.657 1.183 . . . . 0.0 112.389 -177.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 85.3 t -62.65 -27.39 42.83 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 CA-C-O 121.148 0.499 . . . . 0.0 111.489 -177.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.67 -30.76 70.57 Favored Glycine 0 C--O 1.217 -0.918 0 CA-C-N 115.914 -0.584 . . . . 0.0 112.034 -178.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.466 HD22 ' O ' ' A' ' 15' ' ' TRP . 0.4 OUTLIER -102.63 15.52 29.06 Favored 'General case' 0 C--N 1.314 -0.953 0 O-C-N 122.503 -0.41 . . . . 0.0 111.215 177.74 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.0 m 67.4 26.99 8.24 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 122.422 1.106 . . . . 0.0 111.008 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.57 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 1.2 mm? -98.0 21.28 10.92 Favored 'General case' 0 C--N 1.31 -1.114 0 C-N-CA 125.173 1.389 . . . . 0.0 108.69 178.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -60.45 -9.97 4.33 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 123.893 0.877 . . . . 0.0 112.939 176.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.57 ' NE2' ' HA ' ' A' ' 21' ' ' LEU . 0.3 OUTLIER -84.07 -18.14 37.95 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 118.957 -1.097 . . . . 0.0 111.431 172.497 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -84.75 -27.72 26.74 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -177.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.513 ' HA ' ' HB2' ' A' ' 28' ' ' PHE . 0.7 OUTLIER -58.89 -25.62 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 177.971 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.3 m -54.7 -40.78 69.53 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.836 0.854 . . . . 0.0 111.383 176.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 38.2 tp10 -105.97 -27.42 11.18 Favored 'General case' 0 C--O 1.219 -0.541 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.044 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.513 ' HB2' ' HA ' ' A' ' 25' ' ' VAL . 1.7 m-85 -53.73 -44.39 69.85 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 121.218 0.533 . . . . 0.0 110.473 176.066 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.6 m -69.5 -28.87 66.43 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.615 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -76.88 -19.82 56.99 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.949 -176.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -106.8 4.21 27.29 Favored 'General case' 0 CA--C 1.501 -0.917 0 C-N-CA 119.649 -0.82 . . . . 0.0 109.474 175.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 61.06 38.9 16.86 Favored 'General case' 0 C--O 1.245 0.868 0 O-C-N 124.087 0.867 . . . . 0.0 110.435 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 49.4 mm -67.95 114.64 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.874 0 CA-C-N 115.187 -0.915 . . . . 0.0 108.673 -179.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.467 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 89.1 p -103.49 -169.26 1.62 Allowed 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 178.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.461 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -60.96 -29.04 69.73 Favored Glycine 0 N--CA 1.439 -1.12 0 N-CA-C 111.42 -0.672 . . . . 0.0 111.42 178.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -58.4 -44.8 89.16 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.39 0.614 . . . . 0.0 109.631 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.94 -4.46 49.75 Favored 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -179.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.411 HD12 HG22 ' A' ' 12' ' ' VAL . 3.3 tt -80.57 -49.47 11.27 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 178.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.5 mt -61.38 -39.52 90.97 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.524 -178.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -93.47 15.4 16.0 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -178.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.8 mt -55.64 160.49 2.48 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.704 0.764 . . . . 0.0 112.674 178.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.434 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 15.5 t70 -162.08 172.36 16.0 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 105.784 -1.932 . . . . 0.0 105.784 -177.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.41 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -61.04 -34.73 89.05 Favored Glycine 0 C--O 1.204 -1.748 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 175.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -51.1 -48.55 61.68 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 123.455 0.702 . . . . 0.0 111.16 176.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.447 ' O ' HD22 ' A' ' 49' ' ' LEU . 14.0 mtpp -69.07 -43.08 75.32 Favored 'General case' 0 C--O 1.197 -1.702 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.266 176.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 91.0 mt -59.84 -27.23 66.47 Favored 'General case' 0 C--O 1.255 1.349 0 CA-C-O 121.603 0.716 . . . . 0.0 111.244 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.498 ' HA ' HG21 ' A' ' 52' ' ' THR . 58.4 mtpt -80.8 -40.34 25.19 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.701 175.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.26 -11.26 60.45 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.512 0.672 . . . . 0.0 111.59 179.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.454 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.0 mm? -78.21 -3.23 41.62 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 123.179 0.591 . . . . 0.0 110.029 171.22 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 70.57 8.99 64.22 Favored Glycine 0 C--N 1.341 0.845 0 CA-C-O 121.259 0.366 . . . . 0.0 112.665 177.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 22.0 mmt -92.13 -59.06 2.19 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 115.418 -0.391 . . . . 0.0 110.929 -178.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.498 HG21 ' HA ' ' A' ' 47' ' ' LYS . 25.5 p 57.68 25.57 11.92 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 124.588 1.155 . . . . 0.0 112.588 175.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.414 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 14.8 m -69.74 118.99 13.29 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 123.19 0.596 . . . . 0.0 111.559 -176.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.0 m -63.2 -34.42 77.61 Favored 'General case' 0 C--O 1.244 0.77 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -177.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.464 ' HG3' ' N ' ' A' ' 56' ' ' ASP . 5.3 pt20 -59.24 -45.26 91.63 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.548 0.689 . . . . 0.0 110.198 176.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.545 ' O ' HG13 ' A' ' 60' ' ' VAL . 70.9 m-20 -74.76 -35.08 62.58 Favored 'General case' 0 N--CA 1.425 -1.724 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.666 -175.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.414 ' HG2' ' O ' ' A' ' 53' ' ' SER . 49.0 mmm-85 -55.22 -25.81 35.51 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.684 0.394 . . . . 0.0 111.548 175.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -98.28 -17.69 18.79 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.889 0.375 . . . . 0.0 111.279 178.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.401 HD12 ' C ' ' A' ' 59' ' ' LEU . 1.8 tm? -96.39 -66.55 0.9 Allowed 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 120.641 0.258 . . . . 0.0 110.801 -175.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.545 HG13 ' O ' ' A' ' 56' ' ' ASP . 3.9 p -61.55 -24.57 34.22 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.849 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.769 -174.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -63.59 -36.25 83.17 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 122.107 0.956 . . . . 0.0 109.442 -179.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 65' ' ' LYS . 82.5 tttt -81.98 -34.76 29.53 Favored 'General case' 0 C--N 1.29 -2.016 0 CA-C-N 114.163 -1.381 . . . . 0.0 109.571 -177.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.477 ' O ' ' HB3' ' A' ' 67' ' ' MET . 0.5 OUTLIER -74.54 -38.57 62.73 Favored 'General case' 0 C--O 1.191 -1.989 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.229 -176.99 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 pp -64.36 -29.96 71.02 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -176.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 21.6 pttp -75.25 -34.97 61.44 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 119.933 -0.707 . . . . 0.0 110.309 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -100.52 1.5 41.08 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.15 0.5 . . . . 0.0 111.062 -175.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.477 ' HB3' ' O ' ' A' ' 63' ' ' LYS . 2.6 ppp? -70.83 -22.71 62.29 Favored 'General case' 0 C--O 1.195 -1.788 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.224 -176.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 54.4 pttt -71.67 -17.54 62.23 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.358 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 48.1 mtt -100.94 -34.45 9.77 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 172.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 22.8 m -82.91 -12.87 57.01 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.928 -1.033 . . . . 0.0 113.542 -172.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.5 HD13 ' N ' ' A' ' 72' ' ' GLU . 4.5 pp -55.98 -31.57 63.13 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.939 0.876 . . . . 0.0 110.857 176.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.5 ' N ' HD13 ' A' ' 71' ' ' LEU . 10.3 tt0 -70.81 -37.22 73.24 Favored 'General case' 0 N--CA 1.416 -2.167 0 CA-C-N 114.051 -1.431 . . . . 0.0 111.727 -179.568 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.452 ' HZ3' ' HB2' ' A' ' 73' ' ' LYS . 0.1 OUTLIER -99.78 24.34 8.51 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.892 0.853 . . . . 0.0 110.614 -175.222 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.279 -2.465 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.436 -178.158 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.38 0 N-CA-C 111.74 -0.544 . . . . 0.0 111.74 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 27.6 p80 -116.51 3.39 13.19 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -174.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 96.0 mmm -67.93 169.25 10.24 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 177.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.591 HG11 ' CH2' ' A' ' 7' ' ' TRP . 15.2 m -66.04 -34.99 73.96 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.799 0 O-C-N 121.831 -0.543 . . . . 0.0 112.311 -173.171 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.4 p-80 -73.37 -9.11 58.35 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.843 0.83 . . . . 0.0 110.725 179.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -98.74 -11.27 22.07 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.149 177.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.591 ' CH2' HG11 ' A' ' 4' ' ' VAL . 54.1 m0 -72.53 150.77 42.9 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 177.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.2 m -104.48 -75.0 0.63 Allowed 'General case' 0 N--CA 1.424 -1.759 0 CA-C-O 121.082 0.468 . . . . 0.0 109.992 -178.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.504 ' O ' HG13 ' A' ' 12' ' ' VAL . 94.5 t -139.06 -65.67 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.203 -1.353 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 -175.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -66.71 -14.04 62.06 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.153 0.501 . . . . 0.0 112.301 -176.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.477 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 26.3 mt-30 -88.34 -15.75 34.83 Favored 'General case' 0 N--CA 1.433 -1.299 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 178.038 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.504 HG13 ' O ' ' A' ' 9' ' ' VAL . 2.9 p -75.67 -25.76 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-O 122.028 0.918 . . . . 0.0 109.294 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.408 ' O ' HG23 ' A' ' 17' ' ' VAL . 0.8 OUTLIER -67.09 -28.38 68.13 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 114.6 -1.182 . . . . 0.0 111.654 -177.039 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . 0.477 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 83.6 m-70 -59.5 -41.68 90.41 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 -178.078 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.52 ' O ' HD22 ' A' ' 19' ' ' LEU . 38.0 t90 -64.51 -57.46 9.13 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.819 177.517 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.477 HD11 ' CG ' ' A' ' 28' ' ' PHE . 48.5 mt -48.96 -51.24 31.44 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.104 0.962 . . . . 0.0 112.738 -178.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 13' ' ' SER . 88.2 t -62.47 -24.78 36.15 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.033 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.022 -178.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -75.03 -24.13 72.56 Favored Glycine 0 N--CA 1.444 -0.775 0 N-CA-C 112.017 -0.433 . . . . 0.0 112.017 -177.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.52 HD22 ' O ' ' A' ' 15' ' ' TRP . 0.7 OUTLIER -105.56 15.98 26.15 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.143 0.496 . . . . 0.0 110.482 174.818 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.1 m 64.67 28.92 13.09 Favored 'General case' 0 C--O 1.213 -0.862 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.804 178.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.597 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 0.6 OUTLIER -100.51 20.86 14.19 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 126.851 2.06 . . . . 0.0 108.856 -179.593 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -49.59 -29.97 7.97 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.595 0.758 . . . . 0.0 112.242 176.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.597 ' NE2' ' HA ' ' A' ' 21' ' ' LEU . 2.6 pm0 -61.75 -22.37 65.33 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 176.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.403 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 8.4 m-85 -85.97 -22.87 27.14 Favored 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 86.9 t -54.86 -38.71 45.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 O-C-N 123.383 0.427 . . . . 0.0 111.254 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.8 m -50.86 -39.46 53.83 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.283 1.033 . . . . 0.0 111.745 -178.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.614 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 35.4 tp10 -103.34 -30.66 10.47 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.747 -178.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.477 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.6 m-85 -55.26 -41.13 71.8 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 121.389 0.614 . . . . 0.0 109.884 176.467 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 47.1 t -69.37 -34.81 75.1 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.911 178.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.52 -32.51 71.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.129 -173.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -99.33 6.44 46.15 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.124 -179.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 59.47 39.15 22.18 Favored 'General case' 0 C--O 1.244 0.783 0 O-C-N 123.867 0.729 . . . . 0.0 110.118 178.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.4 mm -67.76 112.54 2.98 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.219 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.34 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.407 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 87.6 p -107.13 -168.23 1.37 Allowed 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.488 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.9 -25.37 67.71 Favored Glycine 0 N--CA 1.441 -0.975 0 N-CA-C 111.458 -0.657 . . . . 0.0 111.458 177.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -56.26 -39.57 72.83 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.265 1.026 . . . . 0.0 108.955 178.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.1 -20.71 16.54 Favored 'General case' 0 N--CA 1.434 -1.27 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 179.211 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.6 tt -64.75 -51.47 62.16 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.915 0.886 . . . . 0.0 109.856 -179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 25.6 mt -62.31 -34.32 76.38 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.547 0.689 . . . . 0.0 111.718 -175.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -101.56 13.59 34.51 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -177.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.3 mt -55.03 155.19 4.73 Favored 'General case' 0 C--O 1.24 0.588 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 177.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -159.38 -176.66 5.92 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 176.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.95 -39.25 93.88 Favored Glycine 0 N--CA 1.429 -1.791 0 CA-C-O 118.982 -0.899 . . . . 0.0 113.014 -179.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 -57.55 -45.15 85.47 Favored 'General case' 0 CA--C 1.481 -1.686 0 CA-C-N 117.845 0.822 . . . . 0.0 111.896 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 mtpp -63.77 -46.31 85.82 Favored 'General case' 0 C--O 1.199 -1.58 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.999 177.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 83.8 mt -60.14 -32.48 71.07 Favored 'General case' 0 C--O 1.244 0.779 0 CA-C-O 121.679 0.752 . . . . 0.0 111.352 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.483 ' HA ' HG21 ' A' ' 52' ' ' THR . 40.9 mtpt -72.11 -34.74 68.83 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.922 175.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.07 -13.26 61.17 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 123.12 0.568 . . . . 0.0 111.434 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.614 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.3 mm? -77.71 -7.66 56.81 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-O 121.449 0.642 . . . . 0.0 109.544 173.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.89 -1.43 46.93 Favored Glycine 0 C--O 1.222 -0.614 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.955 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.403 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 37.6 tpp -85.15 -48.27 9.33 Favored 'General case' 0 N--CA 1.441 -0.885 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -178.395 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.483 HG21 ' HA ' ' A' ' 47' ' ' LYS . 70.5 p 55.72 17.02 2.21 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 125.579 1.552 . . . . 0.0 114.274 172.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.45 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 40.5 t -65.14 118.75 9.66 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 122.669 0.388 . . . . 0.0 111.25 -176.19 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.5 t -59.61 -46.46 88.89 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 123.745 0.818 . . . . 0.0 110.56 -177.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -57.13 -48.53 78.44 Favored 'General case' 0 C--O 1.241 0.619 0 O-C-N 123.427 0.455 . . . . 0.0 111.434 178.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.669 ' O ' HG12 ' A' ' 60' ' ' VAL . 29.0 m-20 -66.9 -44.81 79.84 Favored 'General case' 0 CA--C 1.474 -1.969 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.576 -177.449 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.66 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 28.5 mtm180 -58.15 -35.66 71.87 Favored 'General case' 0 C--O 1.196 -1.735 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 -178.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.81 -27.49 62.0 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.315 0.579 . . . . 0.0 110.648 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 47.8 tp -85.58 -51.57 6.4 Favored 'General case' 0 C--O 1.247 0.945 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.891 -177.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.669 HG12 ' O ' ' A' ' 56' ' ' ASP . 4.4 p -60.67 -22.52 26.31 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.513 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.003 178.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.66 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 26.5 tptp -70.55 -33.84 71.58 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 122.082 0.944 . . . . 0.0 108.877 -174.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -82.76 -43.28 16.94 Favored 'General case' 0 C--N 1.288 -2.103 0 CA-C-N 114.221 -1.354 . . . . 0.0 108.974 -178.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.447 ' CB ' HD12 ' A' ' 19' ' ' LEU . 0.8 OUTLIER -69.98 -36.31 75.09 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 114.734 -1.121 . . . . 0.0 112.198 -175.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.0 pp -69.7 -17.17 63.45 Favored 'General case' 0 C--O 1.205 -1.285 0 CA-C-N 116.757 -0.202 . . . . 0.0 111.303 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -98.47 0.57 45.45 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 119.719 -0.792 . . . . 0.0 112.342 176.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -128.34 12.05 6.46 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 122.82 1.295 . . . . 0.0 108.538 177.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.486 ' SD ' ' N ' ' A' ' 67' ' ' MET . 0.0 OUTLIER -58.21 -26.16 62.5 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 126.649 1.979 . . . . 0.0 110.142 179.428 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -58.12 -34.34 70.11 Favored 'General case' 0 C--N 1.304 -1.392 0 C-N-CA 126.021 1.729 . . . . 0.0 111.676 177.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.452 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 18.2 ptp -98.82 -26.83 14.18 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 176.253 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 16.6 t -65.02 -40.68 95.23 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.825 -177.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.1 pp -60.0 -30.23 69.0 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.27 0.557 . . . . 0.0 111.343 178.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -83.63 -45.7 13.18 Favored 'General case' 0 N--CA 1.397 -3.08 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.747 -172.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' A' ' 69' ' ' MET . 56.1 mtpt -63.01 -77.95 0.05 OUTLIER 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.287 -169.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.997 0 C-N-CA 126.811 2.044 . . . . 0.0 105.597 -177.593 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.534 0 N-CA-C 110.751 -0.94 . . . . 0.0 110.751 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -97.96 -6.25 32.54 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 117.703 0.752 . . . . 0.0 110.557 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 78.2 mtm -79.88 154.63 28.23 Favored 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.624 178.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.609 HG13 ' CH2' ' A' ' 7' ' ' TRP . 10.2 m -67.32 -30.6 49.66 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.355 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 -166.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.4 p-80 -70.98 -12.98 61.84 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-O 121.39 0.615 . . . . 0.0 110.488 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -95.46 -2.18 49.29 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 123.908 0.883 . . . . 0.0 110.132 178.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.609 ' CH2' HG13 ' A' ' 4' ' ' VAL . 52.1 m0 -84.75 131.09 34.6 Favored 'General case' 0 N--CA 1.433 -1.304 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 179.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.2 m -87.57 -72.98 0.5 Allowed 'General case' 0 C--N 1.296 -1.754 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.801 -175.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.429 ' O ' HG13 ' A' ' 12' ' ' VAL . 66.7 t -143.49 -63.71 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.2 -1.514 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -179.617 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.412 ' NE2' ' HG3' ' A' ' 11' ' ' GLN . 4.3 pm0 -64.38 -24.7 67.73 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.051 -177.352 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.523 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 23.4 mt-30 -79.01 -14.51 59.15 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.429 HG13 ' O ' ' A' ' 9' ' ' VAL . 1.8 p -73.12 -26.19 22.58 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 CA-C-O 121.666 0.746 . . . . 0.0 109.688 179.445 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.424 ' HA ' HD13 ' A' ' 16' ' ' LEU . 1.5 m -71.62 -26.4 62.56 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.538 -174.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . 0.523 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 78.5 m-70 -61.72 -34.48 75.87 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.194 0.521 . . . . 0.0 110.348 -178.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.492 ' O ' HD21 ' A' ' 19' ' ' LEU . 40.3 t90 -68.05 -61.44 1.86 Allowed 'General case' 0 N--CA 1.433 -1.287 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 174.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.496 HD11 ' CG ' ' A' ' 28' ' ' PHE . 46.9 mt -45.43 -51.75 11.03 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.67 1.188 . . . . 0.0 112.676 -177.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 13' ' ' SER . 93.1 t -59.5 -31.51 46.84 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.261 -177.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.7 -35.9 86.57 Favored Glycine 0 N--CA 1.438 -1.229 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.342 -176.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.492 HD21 ' O ' ' A' ' 15' ' ' TRP . 0.5 OUTLIER -100.19 20.54 14.43 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 121.297 -0.161 . . . . 0.0 111.414 -179.214 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.5 m 68.43 20.3 8.58 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-O 121.638 0.732 . . . . 0.0 111.679 178.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.437 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -102.33 20.91 16.0 Favored 'General case' 0 C--N 1.294 -1.828 0 C-N-CA 123.961 0.904 . . . . 0.0 110.15 -178.745 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -52.8 -24.33 8.7 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.533 0.733 . . . . 0.0 110.964 174.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -60.68 -25.14 66.15 Favored 'General case' 0 C--N 1.301 -1.502 0 C-N-CA 125.338 1.455 . . . . 0.0 111.692 176.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.535 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 3.9 m-85 -89.17 -20.24 24.47 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 88.5 t -54.15 -38.58 39.13 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 O-C-N 123.553 0.533 . . . . 0.0 111.95 -179.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.2 m -52.1 -37.25 53.42 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.505 0.722 . . . . 0.0 112.324 -177.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 12.9 tp10 -105.18 -30.11 9.91 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.431 -178.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.496 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.4 m-85 -54.74 -42.97 72.26 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.177 0.513 . . . . 0.0 110.894 177.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.9 m -73.57 -25.17 60.24 Favored 'General case' 0 N--CA 1.435 -1.221 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.531 -179.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -76.22 -33.39 59.22 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.482 -175.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -95.95 7.27 46.83 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 119.825 -0.75 . . . . 0.0 110.073 -179.093 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 60.29 37.11 20.55 Favored 'General case' 0 CA--C 1.505 -0.752 0 O-C-N 123.861 0.726 . . . . 0.0 109.569 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 50.0 mm -68.5 113.62 4.47 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 179.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.502 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 99.0 p -104.74 -170.74 1.81 Allowed 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 178.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.494 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.47 -28.26 70.89 Favored Glycine 0 C--O 1.224 -0.522 0 N-CA-C 110.895 -0.882 . . . . 0.0 110.895 179.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -54.64 -44.89 73.59 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 125.027 1.331 . . . . 0.0 110.282 177.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.78 -1.07 50.48 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.432 HD22 ' HE2' ' A' ' 67' ' ' MET . 2.9 tt -84.07 -43.03 15.49 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 9.4 mt -58.82 -40.43 84.1 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.542 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -100.96 18.25 20.14 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -175.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.443 HD23 ' HD3' ' A' ' 45' ' ' LYS . 40.5 mt -53.74 146.67 13.12 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 178.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -153.08 172.33 17.04 Favored 'General case' 0 C--N 1.297 -1.674 0 N-CA-C 106.592 -1.632 . . . . 0.0 106.592 178.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -57.64 -30.92 62.99 Favored Glycine 0 CA--C 1.481 -2.076 0 N-CA-C 111.29 -0.724 . . . . 0.0 111.29 177.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -53.36 -47.44 69.41 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.443 ' HD3' HD23 ' A' ' 41' ' ' LEU . 14.5 mtpp -72.73 -43.96 62.3 Favored 'General case' 0 C--O 1.186 -2.255 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.378 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 91.8 mt -55.55 -37.55 68.14 Favored 'General case' 0 N--CA 1.485 1.317 0 CA-C-O 122.142 0.972 . . . . 0.0 110.835 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.487 ' HA ' HG21 ' A' ' 52' ' ' THR . 41.4 mttm -71.49 -38.73 71.16 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 114.867 -1.061 . . . . 0.0 111.106 175.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.51 -13.04 60.35 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.475 0.655 . . . . 0.0 111.357 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.459 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.0 mm? -84.09 -1.78 55.54 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 174.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 69.84 6.57 56.43 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 115.516 -0.765 . . . . 0.0 114.956 174.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.535 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 13.5 tpt -85.34 -50.92 6.93 Favored 'General case' 0 CA--C 1.494 -1.183 0 C-N-CA 118.708 -1.197 . . . . 0.0 108.007 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.487 HG21 ' HA ' ' A' ' 47' ' ' LYS . 68.5 p 54.07 28.94 9.46 Favored 'General case' 0 C--O 1.25 1.091 0 C-N-CA 125.007 1.323 . . . . 0.0 113.252 170.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.552 ' HB2' ' OD1' ' A' ' 56' ' ' ASP . 58.5 m -72.99 -166.43 0.3 Allowed 'General case' 0 N--CA 1.425 -1.695 0 C-N-CA 123.228 0.611 . . . . 0.0 112.158 -176.626 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.0 t -117.93 -38.57 3.22 Favored 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 121.802 -0.561 . . . . 0.0 111.13 -177.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -72.94 -32.43 65.25 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-O 121.312 0.577 . . . . 0.0 110.99 -175.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.675 ' O ' HG13 ' A' ' 60' ' ' VAL . 10.4 p-10 -70.85 -40.31 72.43 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 -176.511 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.9 mmm180 -57.98 -14.7 6.93 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 125.161 1.384 . . . . 0.0 112.203 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -106.02 -38.39 6.33 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.396 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.407 HD13 ' HE2' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -75.3 -63.09 1.35 Allowed 'General case' 0 C--O 1.243 0.745 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.467 -176.17 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.675 HG13 ' O ' ' A' ' 56' ' ' ASP . 11.8 p -62.98 -24.39 35.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 122.083 0.944 . . . . 0.0 109.977 -174.204 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 51.8 tptt -68.87 -28.24 66.53 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 113.893 -1.503 . . . . 0.0 110.088 -175.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -89.98 -32.79 16.63 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.508 179.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.422 ' O ' ' HB2' ' A' ' 67' ' ' MET . 0.5 OUTLIER -75.11 -39.89 60.32 Favored 'General case' 0 C--N 1.294 -1.843 0 CA-C-N 114.95 -1.023 . . . . 0.0 112.049 -177.06 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.1 pp -65.41 -28.31 69.16 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.184 0.516 . . . . 0.0 110.977 -176.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -83.81 -10.76 57.83 Favored 'General case' 0 C--N 1.316 -0.885 0 C-N-CA 120.665 -0.414 . . . . 0.0 111.894 -178.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -112.93 -9.54 13.61 Favored 'General case' 0 CA--C 1.489 -1.384 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.603 ' SD ' HG11 ' A' ' 4' ' ' VAL . 7.1 tmm? -54.04 -37.35 64.05 Favored 'General case' 0 C--N 1.296 -1.736 0 C-N-CA 127.209 2.204 . . . . 0.0 109.515 -174.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -62.92 -17.38 61.72 Favored 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 114.532 -1.213 . . . . 0.0 114.201 178.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 27.0 ptm -115.51 -23.23 8.89 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 108.914 -0.772 . . . . 0.0 108.914 173.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 49.1 m -81.02 -27.91 35.64 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.758 -176.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.1 pp -59.71 -31.0 69.2 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.795 0.807 . . . . 0.0 110.555 176.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -67.99 -33.06 73.9 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.202 -178.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -83.87 -13.57 53.29 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.215 -176.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.261 1.67 0 C-N-CA 125.123 1.369 . . . . 0.0 112.349 178.472 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.69 0 N-CA-C 111.773 -0.531 . . . . 0.0 111.773 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 42.3 p-80 -96.07 -7.55 35.84 Favored 'General case' 0 C--N 1.321 -0.642 0 O-C-N 122.899 -0.177 . . . . 0.0 111.3 -175.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.424 ' HB2' ' CE1' ' A' ' 5' ' ' HIS . 58.6 mtt -73.8 169.79 16.66 Favored 'General case' 0 N--CA 1.437 -1.077 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -172.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.52 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 4.4 m -68.07 -28.3 40.57 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.049 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 -167.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.424 ' CE1' ' HB2' ' A' ' 3' ' ' MET . 9.6 p-80 -67.79 -17.93 64.69 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 120.977 0.418 . . . . 0.0 110.775 179.403 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -91.6 -12.36 34.52 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 123.224 0.61 . . . . 0.0 110.117 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.475 ' O ' ' HB2' ' A' ' 34' ' ' SER . 51.4 m0 -65.84 140.17 58.36 Favored 'General case' 0 CA--C 1.494 -1.206 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.33 -178.279 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.52 -89.28 0.16 Allowed 'General case' 0 N--CA 1.412 -2.333 0 CA-C-N 114.992 -1.004 . . . . 0.0 111.501 -178.275 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.525 ' O ' HG13 ' A' ' 12' ' ' VAL . 91.9 t -137.36 -59.88 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.284 -2.254 0 CA-C-N 114.2 -1.364 . . . . 0.0 108.145 -177.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -71.85 -14.73 62.04 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-O 121.246 0.546 . . . . 0.0 111.697 -178.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.533 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 47.2 mt-30 -78.68 -22.67 46.41 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.109 176.609 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.525 HG13 ' O ' ' A' ' 9' ' ' VAL . 1.4 p -75.28 -27.02 19.11 Favored 'Isoleucine or valine' 0 C--O 1.244 0.781 0 CA-C-O 121.761 0.791 . . . . 0.0 109.029 -177.277 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.2 -29.21 67.13 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 114.823 -1.08 . . . . 0.0 110.574 -178.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . 0.533 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 67.4 m-70 -60.19 -36.38 77.5 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.508 ' O ' HD21 ' A' ' 19' ' ' LEU . 37.6 t90 -69.41 -61.21 1.88 Allowed 'General case' 0 N--CA 1.426 -1.632 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.564 176.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.412 HD12 ' CD2' ' A' ' 28' ' ' PHE . 32.6 mt -47.53 -50.9 22.45 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.137 0.975 . . . . 0.0 112.466 -176.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.5 t -60.85 -28.74 43.89 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 C-N-CA 122.311 0.244 . . . . 0.0 111.092 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -72.37 -23.16 78.4 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 116.177 -0.465 . . . . 0.0 112.147 -176.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.508 HD21 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -110.55 19.59 18.56 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 121.009 -0.276 . . . . 0.0 110.933 176.623 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.4 m 66.81 24.42 9.83 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.384 0.673 . . . . 0.0 112.139 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.474 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -99.72 19.81 15.25 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 124.978 1.311 . . . . 0.0 108.836 -179.02 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -52.6 -28.41 21.05 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 124.228 1.011 . . . . 0.0 111.773 176.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.474 ' NE2' ' HA ' ' A' ' 21' ' ' LEU . 0.4 OUTLIER -70.23 -14.67 62.72 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 120.071 -0.652 . . . . 0.0 112.468 177.901 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.414 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 2.3 m-85 -88.53 -20.69 24.76 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.114 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 96.8 t -58.0 -34.19 48.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.344 178.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.7 m -48.41 -42.11 31.11 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.701 1.2 . . . . 0.0 111.457 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 10.9 tp10 -106.52 -29.62 9.56 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.569 -177.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.412 ' CD2' HD12 ' A' ' 16' ' ' LEU . 1.9 m-85 -55.0 -42.2 72.23 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-O 121.524 0.678 . . . . 0.0 110.316 176.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.7 t -71.96 -24.68 61.64 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.158 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -80.13 -31.37 39.09 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.531 -174.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -99.1 3.47 46.68 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 119.734 -0.787 . . . . 0.0 110.266 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 60.46 41.37 15.98 Favored 'General case' 0 C--O 1.243 0.743 0 O-C-N 123.881 0.738 . . . . 0.0 109.398 -179.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 42.7 mm -70.4 108.79 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.097 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.475 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 80.7 p -100.57 -170.43 1.86 Allowed 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 108.496 -0.928 . . . . 0.0 108.496 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.52 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -61.49 -27.05 67.3 Favored Glycine 0 N--CA 1.448 -0.552 0 N-CA-C 111.468 -0.653 . . . . 0.0 111.468 178.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -56.27 -43.94 79.27 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 124.548 1.139 . . . . 0.0 109.598 177.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.63 -5.5 35.29 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.427 -179.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.418 HD13 HG23 ' A' ' 12' ' ' VAL . 3.4 tt -78.78 -49.65 12.65 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 124.368 1.067 . . . . 0.0 108.86 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 54.7 mt -59.54 -35.83 74.96 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.698 -178.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.6 pp0? -97.01 11.77 34.92 Favored 'General case' 0 C--N 1.297 -1.699 0 CA-C-N 115.348 -0.842 . . . . 0.0 112.955 -176.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.3 mt -54.64 154.96 4.46 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 178.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -157.73 168.91 25.89 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 -178.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.81 -36.96 67.49 Favored Glycine 0 CA--C 1.496 -1.124 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -54.47 -46.57 73.4 Favored 'General case' 0 CA--C 1.5 -0.973 0 C-N-CA 122.965 0.506 . . . . 0.0 111.988 178.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 11.8 mtpp -66.48 -45.78 78.49 Favored 'General case' 0 C--O 1.195 -1.791 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.993 175.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 82.2 mt -59.6 -24.98 64.25 Favored 'General case' 0 C--O 1.254 1.319 0 C-N-CA 123.192 0.597 . . . . 0.0 111.954 -178.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.48 ' HA ' HG22 ' A' ' 52' ' ' THR . 23.4 mtpp -81.19 -31.2 34.1 Favored 'General case' 0 N--CA 1.437 -1.105 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.391 176.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.28 -4.73 57.74 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 123.253 0.621 . . . . 0.0 111.205 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.455 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.5 mm? -85.01 -3.89 58.95 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 173.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.18 -8.13 7.07 Favored Glycine 0 C--N 1.333 0.369 0 CA-C-N 115.708 -0.678 . . . . 0.0 113.842 176.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.467 ' HA ' ' HE1' ' A' ' 51' ' ' MET . 4.9 tpt -77.69 -48.28 17.12 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.48 HG22 ' HA ' ' A' ' 47' ' ' LYS . 67.9 p 52.3 26.31 3.96 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.323 1.449 . . . . 0.0 113.1 174.55 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.437 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 45.2 t -66.66 117.5 8.91 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 120.909 0.385 . . . . 0.0 110.994 -175.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.1 m -61.6 -39.18 90.28 Favored 'General case' 0 C--O 1.248 1.008 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.262 -176.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -68.37 -45.31 73.1 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.145 179.241 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.571 ' O ' HG11 ' A' ' 60' ' ' VAL . 36.5 m-20 -71.18 -40.46 71.22 Favored 'General case' 0 CA--C 1.487 -1.462 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.488 -177.196 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.443 ' HA ' HG11 ' A' ' 60' ' ' VAL . 31.0 mtm180 -60.72 -31.44 70.74 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -78.46 -2.56 39.12 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.138 0.494 . . . . 0.0 110.88 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.427 HD11 ' HZ2' ' A' ' 63' ' ' LYS . 40.5 tp -115.64 -47.99 2.79 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 120.96 0.409 . . . . 0.0 110.968 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.571 HG11 ' O ' ' A' ' 56' ' ' ASP . 5.2 p -60.4 -27.23 39.4 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.209 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.817 178.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -68.16 -36.45 79.65 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 122.005 0.907 . . . . 0.0 109.269 -175.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.409 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 23.8 ttmm -77.99 -41.81 34.72 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 113.724 -1.58 . . . . 0.0 108.776 -177.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 67' ' ' MET . 0.5 OUTLIER -69.67 -41.97 74.79 Favored 'General case' 0 C--O 1.186 -2.266 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.61 -177.65 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.2 pp -65.63 -30.88 71.65 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 120.828 0.347 . . . . 0.0 111.411 -176.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -81.79 -18.91 42.43 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.162 -0.615 . . . . 0.0 111.307 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 11.6 pt-20 -103.28 -15.76 15.87 Favored 'General case' 0 C--O 1.212 -0.883 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.356 177.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.463 ' HB3' ' O ' ' A' ' 63' ' ' LYS . 2.1 ppp? -60.66 -33.69 73.19 Favored 'General case' 0 C--O 1.194 -1.85 0 CA-C-O 121.2 0.524 . . . . 0.0 109.777 -175.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -70.33 -13.07 62.0 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.733 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 23.2 ptp -120.8 5.4 10.49 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 177.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.4 t -121.11 -33.53 3.69 Favored 'General case' 0 C--O 1.191 -2.018 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.486 -176.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -46.35 -36.39 6.34 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 114.363 1.245 . . . . 0.0 114.363 -171.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -75.16 -50.57 15.88 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 121.618 0.723 . . . . 0.0 111.582 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -86.12 -34.57 20.58 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.65 -167.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.419 -1.994 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 -176.852 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.914 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 38.0 p-80 -147.88 -16.09 0.36 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 117.152 0.476 . . . . 0.0 110.666 -179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 66.1 mtt -77.49 162.17 27.36 Favored 'General case' 0 N--CA 1.438 -1.063 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 -175.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.588 HG13 ' CH2' ' A' ' 7' ' ' TRP . 9.4 m -61.41 -37.26 77.3 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.523 0 CA-C-O 121.133 0.492 . . . . 0.0 112.316 -171.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.1 p-80 -70.91 -9.59 58.06 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.382 -177.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -102.73 -0.82 31.04 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.487 179.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.588 ' CH2' HG13 ' A' ' 4' ' ' VAL . 54.5 m0 -79.5 149.82 31.37 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.098 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.9 m -102.1 -79.49 0.52 Allowed 'General case' 0 N--CA 1.419 -2.023 0 O-C-N 123.469 0.481 . . . . 0.0 109.779 -177.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.472 ' O ' HG11 ' A' ' 12' ' ' VAL . 57.9 t -139.38 -60.46 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.3 5.19 5.9 Favored 'General case' 0 C--O 1.215 -0.76 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -176.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.483 HE21 ' HA ' ' A' ' 7' ' ' TRP . 25.9 mt-30 -103.62 -13.08 16.66 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.602 175.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.472 HG11 ' O ' ' A' ' 9' ' ' VAL . 2.4 p -81.08 -24.46 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 CA-C-O 121.811 0.815 . . . . 0.0 109.406 -179.186 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.471 ' HB3' ' CG1' ' A' ' 25' ' ' VAL . 0.3 OUTLIER -67.61 -36.15 80.3 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.449 -178.557 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 80.9 m-70 -57.77 -32.15 67.21 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.084 0.469 . . . . 0.0 110.486 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.511 ' O ' HD22 ' A' ' 19' ' ' LEU . 30.2 t90 -72.83 -60.97 1.98 Allowed 'General case' 0 N--CA 1.426 -1.658 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.202 174.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.574 HD11 ' CD2' ' A' ' 28' ' ' PHE . 44.2 mt -47.04 -51.96 16.14 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.132 0.973 . . . . 0.0 112.656 -177.431 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.408 HG21 ' O ' ' A' ' 13' ' ' SER . 77.4 t -61.69 -24.75 34.95 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 C-N-CA 122.896 0.478 . . . . 0.0 111.0 -177.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.11 -34.92 54.49 Favored Glycine 0 N--CA 1.436 -1.31 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 -177.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.511 HD22 ' O ' ' A' ' 15' ' ' TRP . 1.2 pt? -97.83 16.03 22.0 Favored 'General case' 0 C--O 1.214 -0.802 0 C-N-CA 121.071 -0.252 . . . . 0.0 111.107 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.0 m 73.81 14.49 4.09 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.146 0.978 . . . . 0.0 112.156 178.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -93.16 21.97 5.47 Favored 'General case' 0 C--N 1.292 -1.895 0 C-N-CA 124.55 1.14 . . . . 0.0 108.928 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -51.75 -32.82 32.29 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 124.165 0.986 . . . . 0.0 110.554 174.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -63.12 -22.71 67.05 Favored 'General case' 0 CA--C 1.548 0.88 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.757 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -86.84 -22.37 25.84 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.76 -178.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.471 ' CG1' ' HB3' ' A' ' 13' ' ' SER . 35.0 t -57.8 -34.06 47.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 O-C-N 123.101 0.25 . . . . 0.0 110.518 179.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.1 t -51.0 -35.56 34.59 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.995 0.918 . . . . 0.0 111.487 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 19.2 tp10 -108.15 -32.43 7.52 Favored 'General case' 0 N--CA 1.432 -1.346 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.916 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.574 ' CD2' HD11 ' A' ' 16' ' ' LEU . 2.1 m-85 -53.95 -40.34 66.72 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-O 121.214 0.53 . . . . 0.0 110.793 175.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 33.7 t -73.23 -25.56 60.79 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.594 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.56 -34.1 53.87 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 121.965 -0.459 . . . . 0.0 110.909 -175.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -95.63 -3.29 46.53 Favored 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 120.397 -0.521 . . . . 0.0 109.98 -178.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.1 m-80 62.85 45.08 5.82 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 121.799 0.809 . . . . 0.0 109.139 -178.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.4 mm -68.87 110.29 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.195 0 CA-C-N 114.358 -1.292 . . . . 0.0 108.638 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 89.8 p -102.53 -169.26 1.64 Allowed 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.565 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -63.49 -22.46 65.76 Favored Glycine 0 N--CA 1.439 -1.117 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.955 177.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -59.29 -42.46 91.36 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 177.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.52 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -93.93 -22.29 18.69 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.813 -179.415 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.429 HD12 HG23 ' A' ' 12' ' ' VAL . 3.0 tt -62.51 -50.41 71.49 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 124.587 1.155 . . . . 0.0 109.65 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 67.8 mt -64.14 -38.51 91.31 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.235 -0.438 . . . . 0.0 112.128 -177.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -96.23 11.05 35.9 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -177.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 37' ' ' GLN . 29.0 mt -50.5 136.61 20.62 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 122.322 1.058 . . . . 0.0 113.444 178.507 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -137.5 165.56 25.99 Favored 'General case' 0 C--N 1.285 -2.231 0 N-CA-C 107.34 -1.355 . . . . 0.0 107.34 -179.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -53.46 -39.46 59.87 Favored Glycine 0 C--O 1.212 -1.232 0 O-C-N 123.732 0.645 . . . . 0.0 111.774 178.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -53.01 -44.72 67.51 Favored 'General case' 0 CA--C 1.496 -1.111 0 C-N-CA 122.669 0.387 . . . . 0.0 111.23 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 11.4 mtpp -67.83 -50.05 58.81 Favored 'General case' 0 C--O 1.201 -1.48 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.664 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.8 mt -56.88 -31.12 64.53 Favored 'General case' 0 C--O 1.256 1.441 0 C-N-CA 123.645 0.778 . . . . 0.0 112.072 -177.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.497 ' HA ' HG21 ' A' ' 52' ' ' THR . 57.0 mtpt -80.08 -37.81 33.02 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.981 178.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.85 -15.4 62.64 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 122.99 0.516 . . . . 0.0 111.218 178.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.424 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.3 mm? -72.47 -4.78 32.39 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.245 0.618 . . . . 0.0 110.143 173.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 71.02 20.28 77.75 Favored Glycine 0 CA--C 1.501 -0.815 0 CA-C-N 116.416 -0.356 . . . . 0.0 112.524 177.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 23.2 mmt -105.71 -63.81 1.21 Allowed 'General case' 0 C--N 1.304 -1.389 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.795 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.497 HG21 ' HA ' ' A' ' 47' ' ' LYS . 20.2 p 64.15 13.33 7.75 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.697 1.599 . . . . 0.0 113.301 173.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.6 m -58.92 122.48 13.75 Favored 'General case' 0 N--CA 1.433 -1.314 0 C-N-CA 123.914 0.886 . . . . 0.0 111.143 -176.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.8 m -55.53 -35.13 65.33 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 -174.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -79.87 -33.7 39.85 Favored 'General case' 0 CA--C 1.497 -1.064 0 C-N-CA 119.255 -0.978 . . . . 0.0 111.207 -178.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.688 ' O ' HG11 ' A' ' 60' ' ' VAL . 1.7 m-20 -68.35 -44.9 74.25 Favored 'General case' 0 CA--C 1.477 -1.828 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -50.21 -29.4 9.33 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 124.75 1.22 . . . . 0.0 113.168 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -98.0 -37.5 9.75 Favored 'General case' 0 C--N 1.307 -1.279 0 O-C-N 123.578 0.549 . . . . 0.0 111.134 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 43.0 tp -74.4 -51.54 14.69 Favored 'General case' 0 C--O 1.243 0.715 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -175.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.688 HG11 ' O ' ' A' ' 56' ' ' ASP . 10.7 p -62.51 -24.62 35.78 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.986 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -179.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.418 ' HA ' ' CD2' ' A' ' 64' ' ' LEU . 56.5 tptt -73.57 -27.07 61.13 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.971 -1.468 . . . . 0.0 110.054 -173.394 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -88.41 -37.03 16.2 Favored 'General case' 0 C--N 1.291 -1.937 0 CA-C-N 114.956 -1.02 . . . . 0.0 108.834 178.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.423 ' HE3' ' CB ' ' A' ' 19' ' ' LEU . 2.6 tppt? -69.33 -41.33 76.8 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.165 -177.314 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.471 HD21 ' HB2' ' A' ' 41' ' ' LEU . 4.1 pp -64.42 -30.93 71.96 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 122.919 0.488 . . . . 0.0 112.263 -177.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -82.44 -27.24 32.06 Favored 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 119.784 -0.766 . . . . 0.0 111.642 -178.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -95.34 1.32 54.31 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.529 -0.468 . . . . 0.0 109.826 178.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.49 ' HA ' ' CE ' ' A' ' 67' ' ' MET . 0.0 OUTLIER -53.67 -38.75 64.49 Favored 'General case' 0 C--O 1.189 -2.116 0 CA-C-O 121.653 0.739 . . . . 0.0 111.057 178.382 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 45.9 pttt -79.46 2.08 23.19 Favored 'General case' 0 C--N 1.272 -2.771 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -174.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 23.0 ptp -128.33 5.13 5.74 Favored 'General case' 0 C--N 1.286 -2.156 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 174.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.6 t -143.4 -6.89 0.8 Allowed 'General case' 0 N--CA 1.441 -0.922 0 C-N-CA 119.507 -0.877 . . . . 0.0 112.591 -175.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.521 HD11 ' N ' ' A' ' 72' ' ' GLU . 4.4 pp -50.99 -35.98 36.78 Favored 'General case' 0 CA--C 1.503 -0.849 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.521 ' N ' HD11 ' A' ' 71' ' ' LEU . 20.9 tt0 -68.68 -45.04 72.74 Favored 'General case' 0 C--N 1.301 -1.504 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.925 178.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -89.4 -58.97 2.34 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -170.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.236 -0.887 . . . . 0.0 108.639 -174.638 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.376 0 N-CA-C 112.098 -0.401 . . . . 0.0 112.098 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 41.9 p-80 -95.05 -12.04 27.29 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 111.616 0.228 . . . . 0.0 111.616 -174.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.471 ' O ' ' HB2' ' A' ' 6' ' ' GLU . 59.2 mtt -68.74 164.81 20.91 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 -174.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.458 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 4.2 m -72.61 -29.5 30.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -170.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 9.3 p-80 -71.44 -9.8 58.75 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.527 0.68 . . . . 0.0 110.444 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' A' ' 3' ' ' MET . 12.9 mm-40 -93.09 -10.3 36.49 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.94 179.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.403 ' CH2' HG12 ' A' ' 4' ' ' VAL . 54.8 m0 -80.98 146.94 30.45 Favored 'General case' 0 CA--C 1.498 -1.045 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 -179.274 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 70.2 m -104.62 -73.83 0.66 Allowed 'General case' 0 N--CA 1.413 -2.289 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.475 ' O ' HG13 ' A' ' 12' ' ' VAL . 55.6 t -140.79 -50.31 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.096 0 CA-C-O 121.918 0.866 . . . . 0.0 110.497 -174.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -75.61 -21.74 57.5 Favored 'General case' 0 C--N 1.282 -2.336 0 CA-C-N 114.503 -1.226 . . . . 0.0 111.348 -177.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.47 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 27.1 mt-30 -91.94 -11.42 36.27 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -176.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.475 HG13 ' O ' ' A' ' 9' ' ' VAL . 3.8 p -74.36 -25.83 19.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 CA-C-O 122.026 0.917 . . . . 0.0 108.545 178.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.404 ' HA ' HD12 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -69.76 -28.95 66.19 Favored 'General case' 0 N--CA 1.427 -1.583 0 CA-C-N 114.505 -1.225 . . . . 0.0 111.519 -176.139 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . 0.47 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 37.8 m-70 -63.61 -32.51 74.0 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.946 0.403 . . . . 0.0 110.15 -177.403 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.489 ' O ' HD23 ' A' ' 19' ' ' LEU . 27.5 t90 -69.41 -58.49 3.93 Favored 'General case' 0 N--CA 1.436 -1.147 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.46 175.317 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.467 HD13 ' CG ' ' A' ' 28' ' ' PHE . 48.3 mt -46.84 -50.39 18.57 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.307 1.043 . . . . 0.0 112.539 -177.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.0 t -60.2 -30.19 45.46 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.1 0 CA-C-O 120.822 0.344 . . . . 0.0 111.135 -178.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.01 -27.04 74.27 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 116.027 -0.533 . . . . 0.0 112.148 -176.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.489 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -107.28 15.93 24.52 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 178.845 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.5 m 70.64 25.62 4.09 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-O 121.694 0.759 . . . . 0.0 111.589 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.407 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.2 mm? -102.74 19.46 19.17 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 124.828 1.251 . . . . 0.0 110.516 -179.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -51.92 -30.6 25.03 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.214 0.531 . . . . 0.0 111.243 175.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -58.74 -23.13 59.36 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.87 0.868 . . . . 0.0 111.84 177.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -88.45 -22.98 23.4 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 94.8 t -54.44 -36.39 34.29 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 CA-C-O 120.885 0.374 . . . . 0.0 110.889 -178.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 22.7 t -46.62 -40.98 13.93 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.585 1.554 . . . . 0.0 111.649 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 39.2 tp10 -108.17 -28.93 9.2 Favored 'General case' 0 N--CA 1.438 -1.027 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.676 -179.024 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.467 ' CG ' HD13 ' A' ' 16' ' ' LEU . 1.1 m-85 -54.39 -46.1 73.02 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-O 121.432 0.634 . . . . 0.0 110.775 177.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 41.3 m -83.43 -6.33 59.43 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.038 -178.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.93 -37.14 20.89 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -91.4 0.79 57.46 Favored 'General case' 0 CA--C 1.506 -0.725 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.223 -178.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 66.17 38.64 4.57 Favored 'General case' 0 CA--C 1.512 -0.507 0 O-C-N 124.059 0.849 . . . . 0.0 109.731 -178.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.3 mm -67.75 116.06 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 178.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 90.8 p -105.94 -166.71 1.23 Allowed 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.458 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -63.35 -25.02 68.06 Favored Glycine 0 N--CA 1.439 -1.154 0 N-CA-C 110.956 -0.858 . . . . 0.0 110.956 177.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -56.65 -45.98 81.3 Favored 'General case' 0 CA--C 1.508 -0.635 0 C-N-CA 123.474 0.71 . . . . 0.0 109.786 177.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.555 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -92.61 -14.85 27.62 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.925 -177.485 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.7 tt -69.2 -50.41 47.65 Favored 'General case' 0 C--N 1.311 -1.076 0 O-C-N 123.955 0.784 . . . . 0.0 109.092 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 37.8 mt -63.92 -42.71 97.32 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.454 -177.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -91.8 14.97 13.9 Favored 'General case' 0 CA--C 1.564 1.519 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -176.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 37' ' ' GLN . 35.4 mt -57.01 158.42 4.98 Favored 'General case' 0 C--O 1.246 0.909 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 176.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.41 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 3.1 p-10 -165.4 -178.67 5.1 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 177.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.81 -41.28 83.09 Favored Glycine 0 C--O 1.214 -1.154 0 CA-C-O 119.256 -0.747 . . . . 0.0 113.464 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -55.63 -46.09 77.47 Favored 'General case' 0 CA--C 1.485 -1.521 0 CA-C-N 117.355 0.578 . . . . 0.0 111.376 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.449 ' O ' HD21 ' A' ' 49' ' ' LEU . 14.5 mtpp -66.12 -45.67 80.27 Favored 'General case' 0 C--O 1.198 -1.652 0 O-C-N 123.522 0.514 . . . . 0.0 110.724 177.2 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 92.2 mt -60.85 -24.1 65.64 Favored 'General case' 0 C--O 1.258 1.548 0 CA-C-O 121.391 0.615 . . . . 0.0 111.601 -178.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.471 ' HA ' HG21 ' A' ' 52' ' ' THR . 58.1 mtpt -85.16 -39.54 17.75 Favored 'General case' 0 N--CA 1.433 -1.285 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.044 176.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.23 -14.15 61.28 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.744 0.783 . . . . 0.0 110.956 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.539 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 3.6 mm? -75.74 3.27 10.13 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.296 172.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 63.75 19.22 62.71 Favored Glycine 0 C--N 1.342 0.891 0 CA-C-O 121.283 0.38 . . . . 0.0 112.506 177.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 23.1 mmt -103.57 -63.1 1.22 Allowed 'General case' 0 N--CA 1.421 -1.921 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -176.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.471 HG21 ' HA ' ' A' ' 47' ' ' LYS . 29.5 p 57.64 22.25 8.09 Favored 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 124.447 1.099 . . . . 0.0 112.24 176.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 35.6 t -61.08 118.74 7.17 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 124.47 1.108 . . . . 0.0 111.248 -174.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.9 m -53.29 -41.24 65.41 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 124.414 1.086 . . . . 0.0 113.609 -176.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -65.77 -51.91 55.29 Favored 'General case' 0 CA--C 1.5 -0.945 0 CA-C-O 122.295 1.045 . . . . 0.0 109.922 177.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.64 ' O ' HG11 ' A' ' 60' ' ' VAL . 63.7 m-20 -66.66 -35.92 81.32 Favored 'General case' 0 N--CA 1.419 -2.013 0 CA-C-N 113.734 -1.575 . . . . 0.0 111.364 -170.703 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.7 mmm180 -58.53 -14.68 8.6 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 175.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -107.56 -35.57 6.7 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-O 120.656 0.265 . . . . 0.0 110.965 174.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 48.8 tp -81.14 -57.57 3.45 Favored 'General case' 0 C--O 1.241 0.612 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -176.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.64 HG11 ' O ' ' A' ' 56' ' ' ASP . 7.7 p -61.31 -21.03 23.94 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.801 0 CA-C-O 121.535 0.683 . . . . 0.0 110.31 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -70.22 -26.17 63.74 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.579 -179.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.468 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 51.5 tttp -86.98 -40.58 14.63 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 114.939 -1.028 . . . . 0.0 108.828 178.095 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.464 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.6 OUTLIER -69.76 -43.63 71.83 Favored 'General case' 0 C--O 1.19 -2.065 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.801 -175.054 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.418 HD22 ' CB ' ' A' ' 41' ' ' LEU . 3.7 pp -61.58 -30.03 70.41 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.028 0.442 . . . . 0.0 111.805 -175.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 53.7 pttt -84.98 -18.97 32.85 Favored 'General case' 0 C--N 1.315 -0.93 0 C-N-CA 119.675 -0.81 . . . . 0.0 112.504 -178.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 12.0 pt-20 -111.65 -3.54 15.02 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-O 121.169 0.509 . . . . 0.0 111.116 178.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.46 ' HB3' ' O ' ' A' ' 63' ' ' LYS . 2.6 ppp? -66.41 -28.55 68.71 Favored 'General case' 0 C--O 1.202 -1.435 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -179.264 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -70.76 -9.5 57.49 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.943 178.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 48.6 mtp -109.93 -18.49 13.38 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.433 175.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 23.1 t -103.34 -26.11 13.05 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -171.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.5 -33.33 53.97 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -175.03 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -68.01 -37.19 81.14 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 121.514 0.673 . . . . 0.0 110.795 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -85.7 -22.18 27.96 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 114.92 -1.036 . . . . 0.0 109.992 -170.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.483 0 C-N-CA 125.414 1.485 . . . . 0.0 111.588 178.445 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.618 0 N-CA-C 110.764 -0.934 . . . . 0.0 110.764 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.1 p80 -168.15 10.86 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.911 0.386 . . . . 0.0 110.428 -176.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 62.9 mtt -84.27 168.44 15.68 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 120.656 0.265 . . . . 0.0 111.106 -171.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.557 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.5 m -67.4 -29.79 46.84 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.003 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 -169.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -72.89 -4.54 32.57 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-O 121.445 0.64 . . . . 0.0 110.828 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -103.36 -2.47 26.98 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.291 178.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.55 ' HA ' HE21 ' A' ' 11' ' ' GLN . 53.2 m0 -83.19 136.99 34.22 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.327 -177.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.7 m -90.69 -72.88 0.55 Allowed 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.899 -176.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.44 ' O ' HG11 ' A' ' 12' ' ' VAL . 79.4 t -143.56 -65.91 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.199 -1.564 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 -179.476 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 -66.91 -17.92 65.13 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.153 0.501 . . . . 0.0 112.349 -175.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.55 HE21 ' HA ' ' A' ' 7' ' ' TRP . 27.1 mt-30 -81.05 -17.75 49.09 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.98 178.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.483 ' HA ' ' CE3' ' A' ' 7' ' ' TRP . 2.2 p -69.45 -24.95 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-O 121.912 0.863 . . . . 0.0 109.47 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.58 -23.87 62.67 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-N 114.609 -1.178 . . . . 0.0 111.449 -176.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 51.5 m-70 -62.19 -39.19 91.89 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 110.285 -0.265 . . . . 0.0 110.285 -178.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.511 ' O ' HD23 ' A' ' 19' ' ' LEU . 32.6 t90 -67.91 -58.29 4.8 Favored 'General case' 0 N--CA 1.44 -0.94 0 O-C-N 123.816 0.697 . . . . 0.0 109.827 176.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.523 HD12 ' CD2' ' A' ' 28' ' ' PHE . 43.9 mt -47.1 -50.17 20.48 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.141 0.976 . . . . 0.0 112.511 -177.369 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 86.1 t -61.5 -26.38 39.36 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.076 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.463 -178.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.76 -26.09 68.06 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 116.33 -0.396 . . . . 0.0 112.197 -177.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.511 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -105.6 13.68 29.59 Favored 'General case' 0 C--N 1.321 -0.666 0 O-C-N 122.405 -0.467 . . . . 0.0 111.349 177.89 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.6 m 70.74 21.45 5.24 Favored 'General case' 0 C--O 1.211 -0.94 0 CA-C-O 121.866 0.841 . . . . 0.0 111.611 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.413 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.9 mm? -98.52 19.8 13.91 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.984 178.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -53.04 -25.76 13.51 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.829 0.852 . . . . 0.0 111.163 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -69.63 -18.77 63.62 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 123.504 0.722 . . . . 0.0 110.723 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -85.92 -22.06 27.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.526 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 89.3 t -54.49 -37.98 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 O-C-N 123.633 0.583 . . . . 0.0 111.132 -179.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.3 m -52.31 -33.09 40.76 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.077 0.951 . . . . 0.0 112.296 -177.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 53.3 tp10 -111.63 -27.69 8.44 Favored 'General case' 0 N--CA 1.444 -0.732 0 O-C-N 122.358 -0.214 . . . . 0.0 110.802 179.122 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.523 ' CD2' HD12 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -56.68 -42.29 78.79 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 121.677 0.751 . . . . 0.0 109.884 175.138 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 31.0 t -73.73 -21.56 60.17 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.709 -1.132 . . . . 0.0 109.605 -179.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.54 -39.79 24.1 Favored 'General case' 0 N--CA 1.436 -1.132 0 O-C-N 121.905 -0.497 . . . . 0.0 110.907 -176.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -87.36 2.51 50.15 Favored 'General case' 0 CA--C 1.501 -0.94 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.182 -177.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 65.07 34.94 8.34 Favored 'General case' 0 CA--C 1.501 -0.922 0 O-C-N 124.322 1.014 . . . . 0.0 109.713 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.8 mm -66.32 112.41 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.529 0 CA-C-N 114.7 -1.136 . . . . 0.0 108.244 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.463 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 97.5 p -103.46 -170.33 1.77 Allowed 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 178.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.557 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.43 -30.04 75.15 Favored Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -51.7 -48.0 63.69 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 123.986 0.914 . . . . 0.0 110.02 175.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.09 -22.51 25.36 Favored 'General case' 0 CA--C 1.502 -0.894 0 C-N-CA 120.49 -0.484 . . . . 0.0 111.786 -177.197 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.4 tt -61.33 -48.63 80.44 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 124.84 1.256 . . . . 0.0 109.272 178.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 35' ' ' GLY . 28.2 mt -65.89 -39.61 90.79 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.604 -178.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -95.55 22.17 7.38 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -177.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.435 HD21 ' HD3' ' A' ' 45' ' ' LYS . 59.7 mt -64.04 158.85 21.5 Favored 'General case' 0 C--O 1.247 0.923 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 176.025 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.468 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 2.8 p30 -164.52 178.28 7.5 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 175.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.51 -38.35 70.27 Favored Glycine 0 C--O 1.218 -0.883 0 O-C-N 123.764 0.665 . . . . 0.0 113.898 -177.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -59.89 -42.56 94.06 Favored 'General case' 0 CA--C 1.483 -1.603 0 CA-C-N 117.39 0.595 . . . . 0.0 111.325 -178.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.435 ' HD3' HD21 ' A' ' 41' ' ' LEU . 11.6 mtpp -66.45 -45.01 81.25 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.929 178.127 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 78.3 mt -61.1 -25.28 66.86 Favored 'General case' 0 C--O 1.256 1.419 0 CA-C-O 121.599 0.714 . . . . 0.0 110.966 -179.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.469 ' HA ' HG22 ' A' ' 52' ' ' THR . 7.3 mtpm? -82.63 -41.39 19.51 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 114.782 -1.099 . . . . 0.0 110.297 176.016 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.73 -13.44 62.29 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.462 0.705 . . . . 0.0 111.396 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.479 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 3.9 mm? -75.33 -2.36 27.98 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.52 172.289 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 70.65 16.06 73.82 Favored Glycine 0 C--N 1.342 0.864 0 CA-C-O 121.774 0.652 . . . . 0.0 111.598 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 97.7 mmm -100.97 -67.58 0.85 Allowed 'General case' 0 N--CA 1.423 -1.821 0 CA-C-N 114.782 -0.709 . . . . 0.0 110.002 -176.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.469 HG22 ' HA ' ' A' ' 47' ' ' LYS . 20.9 p 65.64 -3.41 0.71 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.863 1.665 . . . . 0.0 113.938 175.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.6 m -50.75 121.39 5.82 Favored 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 126.665 1.986 . . . . 0.0 112.427 -173.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.1 p -54.31 -48.77 70.96 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -173.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -56.05 -50.06 72.02 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-O 121.844 0.83 . . . . 0.0 109.832 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.692 ' O ' HG12 ' A' ' 60' ' ' VAL . 4.8 m-20 -63.39 -47.95 79.91 Favored 'General case' 0 CA--C 1.486 -1.485 0 CA-C-N 113.874 -1.512 . . . . 0.0 109.622 -176.114 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.457 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 39.1 mmm-85 -49.05 -38.49 24.09 Favored 'General case' 0 CA--C 1.506 -0.721 0 C-N-CA 124.587 1.155 . . . . 0.0 112.44 -179.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -83.11 -33.74 26.25 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-O 121.197 0.523 . . . . 0.0 111.402 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.402 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 45.9 tp -80.36 -51.08 9.29 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -174.689 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.692 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.4 p -64.25 -21.26 28.61 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.217 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 4.9 tppp? -69.28 -35.95 76.57 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.149 -178.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 59' ' ' LEU . 19.1 ptmt -90.2 -18.75 25.15 Favored 'General case' 0 N--CA 1.419 -1.99 0 CA-C-N 115.089 -0.96 . . . . 0.0 109.507 -176.057 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.4 ' CB ' HD13 ' A' ' 19' ' ' LEU . 1.8 tppt? -84.56 -38.79 19.55 Favored 'General case' 0 C--O 1.199 -1.588 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.035 177.166 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.6 pp -66.42 -14.55 62.33 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.619 0.368 . . . . 0.0 111.731 -176.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 59.4 pttt -90.03 -12.99 36.94 Favored 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.477 176.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.483 ' O ' ' HG2' ' A' ' 69' ' ' MET . 11.7 pt-20 -135.02 18.93 3.45 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-O 123.041 1.4 . . . . 0.0 109.985 -176.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.524 ' SD ' ' N ' ' A' ' 67' ' ' MET . 0.0 OUTLIER -59.66 -20.68 57.79 Favored 'General case' 0 C--N 1.293 -1.869 0 C-N-CA 127.162 2.185 . . . . 0.0 110.245 178.246 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -68.33 -23.7 64.74 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.689 178.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.483 ' HG2' ' O ' ' A' ' 66' ' ' GLU . 23.0 ptp -102.42 -30.67 10.88 Favored 'General case' 0 C--O 1.248 0.983 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 174.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 38.0 m -71.85 -27.18 62.71 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.655 -177.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.478 HD13 ' N ' ' A' ' 72' ' ' GLU . 4.5 pp -54.12 -33.61 58.21 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-O 121.419 0.628 . . . . 0.0 112.056 176.101 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.478 ' N ' HD13 ' A' ' 71' ' ' LEU . 18.7 tt0 -84.41 -44.61 13.55 Favored 'General case' 0 N--CA 1.4 -2.958 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.822 -175.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -80.32 -51.93 8.3 Favored 'General case' 0 N--CA 1.432 -1.329 0 C-N-CA 119.898 -0.721 . . . . 0.0 111.407 -172.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.257 1.489 0 C-N-CA 125.362 1.465 . . . . 0.0 112.702 179.399 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.056 0 N-CA-C 112.228 -0.349 . . . . 0.0 112.228 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -124.87 -29.3 3.39 Favored 'General case' 0 C--N 1.314 -0.955 0 O-C-N 122.521 -0.4 . . . . 0.0 110.352 -178.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.436 ' HB3' ' CE1' ' A' ' 5' ' ' HIS . 23.0 mmt -84.87 154.3 22.36 Favored 'General case' 0 N--CA 1.427 -1.596 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.477 HG13 ' CH2' ' A' ' 7' ' ' TRP . 6.8 m -74.09 -28.7 23.89 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.991 0 CA-C-N 116.03 -0.532 . . . . 0.0 112.311 -171.377 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.436 ' CE1' ' HB3' ' A' ' 3' ' ' MET . 20.5 p-80 -71.67 -12.8 61.51 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-O 120.97 0.414 . . . . 0.0 110.801 178.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -91.03 -19.43 23.2 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.625 177.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.477 ' CH2' HG13 ' A' ' 4' ' ' VAL . 50.7 m0 -58.36 145.38 38.39 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -174.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.4 m -95.43 -80.36 0.42 Allowed 'General case' 0 N--CA 1.415 -2.184 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.465 -175.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.494 ' O ' HG11 ' A' ' 12' ' ' VAL . 73.8 t -146.03 -61.85 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.554 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 -178.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.5 pm0 -67.34 -17.69 64.85 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.542 -177.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -80.02 -17.68 52.16 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.402 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.494 HG11 ' O ' ' A' ' 9' ' ' VAL . 2.6 p -74.27 -21.86 17.78 Favored 'Isoleucine or valine' 0 C--O 1.245 0.847 0 CA-C-O 121.908 0.861 . . . . 0.0 109.096 -177.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.87 -26.58 64.26 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.957 -177.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 -62.47 -32.59 73.51 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.332 0.587 . . . . 0.0 109.7 -177.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.481 ' O ' HD21 ' A' ' 19' ' ' LEU . 28.4 t90 -74.24 -58.82 3.04 Favored 'General case' 0 N--CA 1.427 -1.591 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.473 175.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.446 HD11 ' CG ' ' A' ' 28' ' ' PHE . 38.8 mt -48.05 -48.85 32.97 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.261 1.024 . . . . 0.0 112.5 -176.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 77.2 t -60.5 -29.25 44.18 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 CA-C-O 120.769 0.319 . . . . 0.0 110.97 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -71.72 -22.2 78.74 Favored Glycine 0 N--CA 1.442 -0.952 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.406 -176.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.481 HD21 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -113.7 17.8 17.91 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 117.076 0.438 . . . . 0.0 111.716 177.791 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.5 m 68.84 20.82 7.87 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.699 0.8 . . . . 0.0 112.063 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.466 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.8 mm? -98.94 18.34 17.42 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.963 179.573 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.404 ' HA ' HG21 ' A' ' 25' ' ' VAL . 8.7 p-10 -52.34 -25.2 9.03 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.912 0.885 . . . . 0.0 111.216 175.284 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -64.47 -23.75 67.39 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 124.023 0.929 . . . . 0.0 111.373 178.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.486 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 3.0 m-85 -86.57 -20.79 27.43 Favored 'General case' 0 N--CA 1.437 -1.087 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.87 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.404 HG21 ' HA ' ' A' ' 22' ' ' ASP . 90.7 t -53.08 -40.87 39.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 C-N-CA 123.495 0.718 . . . . 0.0 111.404 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.9 m -53.7 -35.49 61.19 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.237 0.615 . . . . 0.0 112.163 -177.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.604 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 21.2 tp10 -103.7 -28.94 11.37 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.851 -179.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.446 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.9 m-85 -56.22 -32.99 64.94 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-O 121.851 0.834 . . . . 0.0 109.965 176.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.414 ' HA ' HG11 ' A' ' 9' ' ' VAL . 21.6 p -80.76 -31.73 35.79 Favored 'General case' 0 N--CA 1.423 -1.823 0 CA-C-N 114.809 -1.087 . . . . 0.0 111.722 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.36 -45.5 76.15 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-O 121.819 0.819 . . . . 0.0 110.441 -176.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -94.72 14.72 20.29 Favored 'General case' 0 C--N 1.299 -1.617 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.815 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . 0.285 4.3 p30 46.05 60.92 2.93 Favored 'General case' 0 CA--C 1.502 -0.892 0 CA-C-O 122.476 1.132 . . . . 0.0 113.429 177.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 49.5 mm -85.11 117.51 30.43 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.846 0 CA-C-N 113.86 -1.518 . . . . 0.0 107.024 176.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.6 p -106.59 -166.03 1.14 Allowed 'General case' 0 C--N 1.293 -1.861 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 177.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.472 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -64.15 -25.81 69.91 Favored Glycine 0 N--CA 1.441 -1.007 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 178.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -57.38 -45.21 84.7 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 123.693 0.797 . . . . 0.0 109.381 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.57 -3.22 43.42 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.539 -179.2 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.5 tt -81.85 -51.11 8.44 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 46.6 mt -61.08 -30.85 70.59 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.473 -176.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -103.09 13.63 33.7 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 37.8 mt -47.32 148.39 1.31 Allowed 'General case' 0 C--O 1.246 0.872 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.448 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 12.8 t70 -143.9 165.44 27.71 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 106.368 -1.716 . . . . 0.0 106.368 -175.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -57.28 -38.23 85.29 Favored Glycine 0 C--O 1.214 -1.143 0 N-CA-C 109.646 -1.382 . . . . 0.0 109.646 175.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -54.28 -47.98 71.75 Favored 'General case' 0 CA--C 1.495 -1.146 0 C-N-CA 123.806 0.843 . . . . 0.0 111.168 177.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.425 ' O ' HD22 ' A' ' 49' ' ' LEU . 14.2 mtpp -63.97 -46.64 83.71 Favored 'General case' 0 C--O 1.199 -1.555 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.531 177.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 83.4 mt -58.73 -25.49 63.02 Favored 'General case' 0 C--O 1.256 1.435 0 CA-C-O 121.604 0.716 . . . . 0.0 111.181 -179.272 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.474 ' HA ' HG23 ' A' ' 52' ' ' THR . 23.8 mtpp -83.43 -36.62 24.08 Favored 'General case' 0 N--CA 1.432 -1.357 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.467 176.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.34 -16.38 61.88 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.541 0.686 . . . . 0.0 111.127 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.604 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.6 mm? -73.68 -6.66 48.19 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.631 0.729 . . . . 0.0 109.094 172.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 69.87 4.52 48.16 Favored Glycine 0 CA--C 1.502 -0.779 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.512 177.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.591 ' HG3' ' OG ' ' A' ' 53' ' ' SER . 30.2 tpp -88.0 -51.16 5.97 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 -176.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.474 HG23 ' HA ' ' A' ' 47' ' ' LYS . 62.0 p 51.66 23.45 1.96 Allowed 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 125.257 1.423 . . . . 0.0 113.826 174.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.591 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 12.9 m -62.27 127.02 29.35 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 124.29 1.036 . . . . 0.0 111.939 -174.264 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.1 m -55.2 -51.25 67.15 Favored 'General case' 0 CA--C 1.553 1.079 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -172.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -58.33 -54.27 48.95 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 122.836 1.303 . . . . 0.0 109.634 178.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.702 ' O ' HG13 ' A' ' 60' ' ' VAL . 6.2 m-20 -59.57 -44.16 93.38 Favored 'General case' 0 C--N 1.282 -2.368 0 CA-C-N 112.279 -2.237 . . . . 0.0 111.026 -172.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.1 mmm180 -54.26 -23.17 13.88 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 177.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -100.18 -34.16 10.14 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.962 0.41 . . . . 0.0 110.78 176.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.407 HD13 ' HZ3' ' A' ' 63' ' ' LYS . 48.7 tp -77.22 -57.29 3.92 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -176.35 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.702 HG13 ' O ' ' A' ' 56' ' ' ASP . 4.8 p -60.15 -21.01 21.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 CA-C-O 121.729 0.776 . . . . 0.0 110.628 -179.292 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 15.1 tppt? -65.62 -35.03 79.62 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 114.296 -1.32 . . . . 0.0 109.846 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -91.68 -30.25 16.41 Favored 'General case' 0 C--N 1.292 -1.897 0 CA-C-N 114.788 -1.097 . . . . 0.0 109.989 -177.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.41 ' HG2' HD13 ' A' ' 19' ' ' LEU . 2.8 tppt? -72.08 -40.73 68.03 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 115.067 -0.969 . . . . 0.0 111.29 -178.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 pp -59.2 -30.09 67.97 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.884 0.373 . . . . 0.0 111.677 -176.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -82.63 -22.27 34.78 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 120.37 -0.532 . . . . 0.0 111.901 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -101.03 -13.6 18.17 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 121.062 0.458 . . . . 0.0 110.178 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.429 ' HA ' ' HB3' ' A' ' 70' ' ' SER . 1.9 ppp? -60.85 -25.51 66.71 Favored 'General case' 0 C--O 1.195 -1.779 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.905 -173.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.458 ' HA ' HD21 ' A' ' 71' ' ' LEU . 17.3 ptmt -71.02 -18.87 62.57 Favored 'General case' 0 C--N 1.294 -1.847 0 CA-C-O 121.05 0.452 . . . . 0.0 112.116 -178.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 54.5 mtm -100.48 -33.4 10.36 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 122.257 1.027 . . . . 0.0 108.279 174.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.429 ' HB3' ' HA ' ' A' ' 67' ' ' MET . 32.4 t -81.85 -23.93 36.11 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 114.189 -1.369 . . . . 0.0 112.453 -171.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.474 HD12 ' N ' ' A' ' 72' ' ' GLU . 4.5 pp -49.42 -34.67 17.03 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.579 1.152 . . . . 0.0 112.322 -177.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.474 ' N ' HD12 ' A' ' 71' ' ' LEU . 20.8 tt0 -69.59 -47.46 63.46 Favored 'General case' 0 N--CA 1.421 -1.89 0 CA-C-N 114.422 -1.263 . . . . 0.0 112.678 -178.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 43.3 mtpt -95.61 -44.1 7.64 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.189 -166.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.163 0 C-N-CA 125.256 1.422 . . . . 0.0 109.89 -172.816 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.883 0 N-CA-C 109.98 -1.248 . . . . 0.0 109.98 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -100.88 -12.63 18.83 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 117.389 0.594 . . . . 0.0 110.72 -178.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 67.7 mtt -78.66 158.49 28.37 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.224 -178.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.573 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 4.4 m -65.02 -31.18 52.81 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.022 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -167.611 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.43 ' CD2' ' HG2' ' A' ' 6' ' ' GLU . 9.3 p-80 -70.62 -13.39 62.07 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 121.478 0.656 . . . . 0.0 110.719 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.43 ' HG2' ' CD2' ' A' ' 5' ' ' HIS . 18.3 mm-40 -96.17 -4.27 42.9 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.138 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.522 ' CD2' ' HA ' ' A' ' 4' ' ' VAL . 52.3 m0 -83.77 142.16 30.88 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.62 -178.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 21.3 m -103.58 -72.14 0.71 Allowed 'General case' 0 N--CA 1.423 -1.813 0 CA-C-O 121.195 0.522 . . . . 0.0 110.918 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.527 ' O ' HG13 ' A' ' 12' ' ' VAL . 69.9 t -139.57 -61.7 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.208 -1.12 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 -176.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.7 pm0 -66.01 -19.86 66.0 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.305 -176.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -86.23 -17.74 33.96 Favored 'General case' 0 N--CA 1.435 -1.212 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.477 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.527 HG13 ' O ' ' A' ' 9' ' ' VAL . 3.2 p -72.39 -24.27 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 CA-C-O 121.79 0.805 . . . . 0.0 109.785 -177.513 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.419 ' O ' HG22 ' A' ' 17' ' ' VAL . 1.1 m -71.22 -27.89 63.81 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.357 -177.19 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -59.54 -40.57 87.66 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-O 120.978 0.418 . . . . 0.0 110.095 -178.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.443 ' O ' HD21 ' A' ' 19' ' ' LEU . 35.6 t90 -64.65 -57.22 9.65 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.51 177.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.462 HD13 ' CG ' ' A' ' 28' ' ' PHE . 41.4 mt -49.02 -46.32 43.91 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.932 0.893 . . . . 0.0 112.138 -177.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.419 HG22 ' O ' ' A' ' 13' ' ' SER . 98.1 t -61.2 -26.21 38.58 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.208 0 CA-C-O 121.208 0.528 . . . . 0.0 111.114 -179.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.95 -24.84 73.04 Favored Glycine 0 N--CA 1.438 -1.198 0 C-N-CA 121.32 -0.467 . . . . 0.0 112.491 -177.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.502 HD13 ' CB ' ' A' ' 63' ' ' LYS . 0.7 OUTLIER -114.49 21.97 14.08 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -179.06 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.1 m 71.49 17.5 5.69 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.756 0.789 . . . . 0.0 111.266 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.441 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.3 mm? -100.54 15.12 29.05 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.311 -177.15 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -56.02 -19.6 13.34 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 121.253 0.549 . . . . 0.0 111.6 174.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -68.38 -23.72 64.7 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 124.125 0.97 . . . . 0.0 111.112 176.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -86.86 -19.81 28.38 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.592 -179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 88.7 t -52.21 -39.24 26.76 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 C-N-CA 123.117 0.567 . . . . 0.0 111.654 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.1 m -51.25 -37.63 48.18 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.085 0.954 . . . . 0.0 112.166 -178.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 14.9 tp10 -103.28 -31.73 9.93 Favored 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.112 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.462 ' CG ' HD13 ' A' ' 16' ' ' LEU . 1.3 m-85 -54.49 -45.33 73.23 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 121.198 0.523 . . . . 0.0 111.618 178.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 35.2 m -76.32 -16.88 59.67 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.71 -178.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -79.69 -35.04 39.68 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.699 -178.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -90.87 2.56 56.05 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 119.844 -0.742 . . . . 0.0 110.04 -177.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.493 ' N ' HD21 ' A' ' 32' ' ' ASN . 0.6 OUTLIER 67.0 32.84 6.08 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.105 178.896 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.3 mm -64.39 118.73 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.051 -178.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.474 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 93.3 p -107.07 -172.35 2.06 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 176.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.573 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -64.43 -22.77 67.9 Favored Glycine 0 N--CA 1.439 -1.164 0 N-CA-C 111.184 -0.767 . . . . 0.0 111.184 179.38 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -59.5 -45.78 90.7 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 123.219 0.608 . . . . 0.0 109.366 176.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.416 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -88.48 -17.05 31.17 Favored 'General case' 0 CA--C 1.494 -1.21 0 C-N-CA 120.413 -0.515 . . . . 0.0 111.47 -178.447 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.417 HD21 ' HE3' ' A' ' 67' ' ' MET . 2.1 tt -69.51 -49.59 53.17 Favored 'General case' 0 C--N 1.308 -1.198 0 O-C-N 124.367 1.042 . . . . 0.0 108.802 -179.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.9 mt -59.6 -42.54 92.8 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.551 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -94.57 25.84 3.77 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -178.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.456 ' CB ' HD23 ' A' ' 64' ' ' LEU . 28.2 mt -65.74 161.4 20.85 Favored 'General case' 0 C--O 1.247 0.924 0 CA-C-O 121.173 0.511 . . . . 0.0 111.869 175.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -167.94 176.73 6.03 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.79 -39.09 93.32 Favored Glycine 0 CA--C 1.497 -1.07 0 CA-C-O 119.608 -0.551 . . . . 0.0 112.193 -178.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -51.12 -48.18 61.81 Favored 'General case' 0 CA--C 1.506 -0.731 0 C-N-CA 123.331 0.652 . . . . 0.0 110.667 178.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.402 ' HD3' HD22 ' A' ' 41' ' ' LEU . 11.2 mtpp -67.65 -44.88 76.85 Favored 'General case' 0 C--O 1.197 -1.67 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.297 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 91.3 mt -59.46 -28.84 67.35 Favored 'General case' 0 C--O 1.255 1.343 0 CA-C-O 121.488 0.661 . . . . 0.0 111.734 -179.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.499 ' HA ' HG21 ' A' ' 52' ' ' THR . 22.2 mtpp -76.77 -33.07 58.08 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.906 176.593 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.03 -12.78 60.02 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.685 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.515 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.5 mm? -78.56 -2.16 37.46 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.347 0.594 . . . . 0.0 109.421 173.11 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.07 -0.72 37.03 Favored Glycine 0 C--O 1.216 -1.017 0 CA-C-N 115.832 -0.622 . . . . 0.0 113.185 176.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 24.6 mmt -85.33 -53.72 5.04 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 120.721 0.296 . . . . 0.0 111.365 -177.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.499 HG21 ' HA ' ' A' ' 47' ' ' LYS . 20.0 p 56.11 25.22 8.75 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.584 1.154 . . . . 0.0 112.547 174.1 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 47.4 t -68.28 127.66 33.74 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 123.289 0.636 . . . . 0.0 111.158 -174.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.6 m -58.01 -44.33 87.21 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -175.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -58.94 -55.34 36.44 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.969 0.89 . . . . 0.0 109.658 178.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.695 ' O ' HG13 ' A' ' 60' ' ' VAL . 48.5 m-20 -62.33 -38.58 90.03 Favored 'General case' 0 N--CA 1.42 -1.967 0 CA-C-N 113.838 -1.528 . . . . 0.0 111.245 -173.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 46.9 mmm-85 -56.53 -15.7 4.74 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 176.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -108.57 -39.29 5.44 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-O 121.042 0.449 . . . . 0.0 110.169 175.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.487 HD13 ' HZ2' ' A' ' 63' ' ' LYS . 47.6 tp -73.68 -54.93 6.97 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -173.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.695 HG13 ' O ' ' A' ' 56' ' ' ASP . 7.0 p -64.64 -25.13 37.12 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.02 0 CA-C-O 121.352 0.596 . . . . 0.0 110.195 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.1 mmmt -70.91 -23.75 62.33 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.662 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.471 ' O ' ' HG2' ' A' ' 65' ' ' LYS . 22.5 ttmm -87.39 -40.88 14.02 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 114.656 -1.156 . . . . 0.0 108.964 178.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.502 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -72.6 -34.11 67.16 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-N 115.344 -0.844 . . . . 0.0 112.699 -178.344 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.456 HD23 ' CB ' ' A' ' 41' ' ' LEU . 3.2 pp -72.34 -24.56 61.31 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.003 0.43 . . . . 0.0 111.352 -177.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 21.5 ptmt -83.98 -9.33 58.76 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 120.465 -0.494 . . . . 0.0 111.339 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -119.9 7.77 10.98 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.436 ' HE1' HG22 ' A' ' 4' ' ' VAL . 3.8 tmm? -60.59 -31.07 70.23 Favored 'General case' 0 C--O 1.188 -2.147 0 CA-C-N 114.291 -1.322 . . . . 0.0 111.181 -170.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -68.63 -16.19 63.76 Favored 'General case' 0 C--N 1.282 -2.34 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 178.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 27.4 ptm -112.62 -11.18 13.59 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.421 0.629 . . . . 0.0 109.342 174.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 67.1 m -107.77 -11.02 15.48 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -176.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.5 HD13 ' N ' ' A' ' 72' ' ' GLU . 4.4 pp -54.63 -31.6 57.53 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.874 0.845 . . . . 0.0 111.353 173.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.5 ' N ' HD13 ' A' ' 71' ' ' LEU . 6.8 tt0 -68.31 -29.5 68.28 Favored 'General case' 0 N--CA 1.427 -1.617 0 CA-C-N 114.12 -1.4 . . . . 0.0 111.303 179.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -98.7 26.02 6.0 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 121.678 0.751 . . . . 0.0 110.437 -169.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.28 -2.446 0 CA-C-N 114.432 -1.258 . . . . 0.0 108.638 -178.062 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.555 0 N-CA-C 111.114 -0.794 . . . . 0.0 111.114 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -116.64 -0.29 12.43 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -176.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 78.0 mtm -76.84 167.77 21.26 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.564 -179.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.516 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.5 m -64.21 -29.93 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 N-CA-C 113.842 1.052 . . . . 0.0 113.842 -167.594 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 15.6 p-80 -70.77 -8.47 52.55 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-O 121.175 0.512 . . . . 0.0 111.223 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -99.75 -8.02 24.78 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.631 0.772 . . . . 0.0 109.862 177.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.507 ' CH2' HG13 ' A' ' 4' ' ' VAL . 50.1 m0 -74.53 133.01 42.32 Favored 'General case' 0 CA--C 1.489 -1.373 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -178.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.402 ' O ' ' HB3' ' A' ' 34' ' ' SER . 3.3 m -91.3 -75.51 0.47 Allowed 'General case' 0 N--CA 1.428 -1.56 0 CA-C-O 121.317 0.579 . . . . 0.0 110.156 -175.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.458 ' O ' HG12 ' A' ' 12' ' ' VAL . 97.9 t -140.83 -63.83 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.2 -1.535 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 179.129 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -62.88 -18.79 63.46 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.98 -177.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.458 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 47.0 mt-30 -82.13 -20.97 36.92 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.142 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.458 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.3 p -76.49 -26.42 16.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 CA-C-O 122.114 0.959 . . . . 0.0 108.652 -178.119 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.404 ' HA ' HD12 ' A' ' 16' ' ' LEU . 2.5 m -66.05 -33.41 75.73 Favored 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 114.479 -1.237 . . . . 0.0 112.342 -176.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . 0.458 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 44.6 m-70 -59.35 -37.67 78.45 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.666 0.746 . . . . 0.0 109.028 -178.013 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.52 ' O ' HD22 ' A' ' 19' ' ' LEU . 42.3 t90 -67.67 -58.89 3.87 Favored 'General case' 0 N--CA 1.424 -1.766 0 CA-C-N 114.374 -1.285 . . . . 0.0 109.983 176.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.44 HD13 ' CD2' ' A' ' 28' ' ' PHE . 46.8 mt -47.99 -49.83 29.49 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 124.181 0.992 . . . . 0.0 111.945 -178.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 94.5 t -67.21 -18.09 23.59 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.225 -178.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -86.79 -33.13 13.25 Favored Glycine 0 N--CA 1.438 -1.213 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 -176.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.52 HD22 ' O ' ' A' ' 15' ' ' TRP . 1.8 pt? -95.09 12.19 29.48 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.207 178.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.7 m 66.06 40.58 3.93 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 122.295 1.045 . . . . 0.0 110.29 -178.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.443 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.7 mm? -119.63 20.04 12.44 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 113.947 -1.479 . . . . 0.0 109.36 177.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.443 ' HA ' HG11 ' A' ' 25' ' ' VAL . 4.6 p-10 -55.57 -14.74 2.26 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-O 121.57 0.7 . . . . 0.0 112.139 174.189 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -65.97 -26.13 67.42 Favored 'General case' 0 C--N 1.293 -1.879 0 C-N-CA 123.978 0.911 . . . . 0.0 110.343 174.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.562 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 6.8 m-85 -89.77 -25.13 21.28 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -177.534 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.537 ' HA ' ' HB2' ' A' ' 28' ' ' PHE 0.325 1.4 p -59.64 -26.6 35.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 178.81 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.2 m -59.15 -27.88 66.06 Favored 'General case' 0 CA--C 1.562 1.439 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.887 177.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 16.0 tp10 -112.02 -33.31 6.31 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 179.305 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.537 ' HB2' ' HA ' ' A' ' 25' ' ' VAL . 3.5 m-85 -54.39 -40.96 68.7 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 121.011 0.434 . . . . 0.0 110.407 175.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.1 t -72.37 -22.91 61.07 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.252 -178.441 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -80.03 -37.56 33.79 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.611 -177.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -94.88 4.83 53.36 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 119.844 -0.743 . . . . 0.0 111.291 -178.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 61.1 39.13 16.49 Favored 'General case' 0 C--N 1.351 0.65 0 C-N-CA 123.148 0.579 . . . . 0.0 109.586 179.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.2 mm -66.37 110.02 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.049 0 CA-C-N 115.304 -0.862 . . . . 0.0 108.698 -179.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.497 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 78.5 p -105.76 -169.68 1.62 Allowed 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.516 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -58.73 -31.83 68.41 Favored Glycine 0 N--CA 1.445 -0.716 0 O-C-N 123.575 0.547 . . . . 0.0 112.102 -179.557 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -53.49 -50.12 66.05 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 123.678 0.791 . . . . 0.0 110.075 176.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.519 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -86.79 -17.3 33.85 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.229 -177.799 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.416 HD11 HG21 ' A' ' 12' ' ' VAL . 2.1 tt -70.51 -51.38 29.29 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.924 0.89 . . . . 0.0 109.171 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 47.1 mt -61.01 -36.05 78.47 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-O 121.341 0.591 . . . . 0.0 112.419 -176.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -102.76 17.63 23.38 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.05 -177.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 37' ' ' GLN . 21.4 mt -54.6 154.94 4.42 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 121.789 0.804 . . . . 0.0 112.203 176.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -161.89 168.24 23.32 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 -175.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.15 -38.05 65.88 Favored Glycine 0 C--O 1.209 -1.41 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 177.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -51.48 -48.48 62.85 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 122.674 0.389 . . . . 0.0 111.093 176.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.3 mtpp -70.06 -45.31 67.35 Favored 'General case' 0 C--O 1.193 -1.915 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.89 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 94.3 mt -56.61 -38.04 71.5 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-O 121.825 0.821 . . . . 0.0 110.751 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.475 ' HA ' HG22 ' A' ' 52' ' ' THR . 24.5 mtpp -69.73 -36.58 75.98 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.161 177.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.85 -10.68 59.73 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 123.223 0.609 . . . . 0.0 111.378 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.515 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.2 mm? -84.55 -1.94 56.61 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.522 0.677 . . . . 0.0 109.286 173.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 70.62 7.11 60.59 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.761 -0.654 . . . . 0.0 114.284 174.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.562 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 40.3 tpp -90.29 -53.93 4.24 Favored 'General case' 0 C--N 1.311 -1.078 0 C-N-CA 119.07 -1.052 . . . . 0.0 109.3 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.475 HG22 ' HA ' ' A' ' 47' ' ' LYS . 63.7 p 54.9 33.25 19.57 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 124.586 1.154 . . . . 0.0 112.714 172.118 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.51 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 60.5 m -70.66 -174.68 0.93 Allowed 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 123.473 0.709 . . . . 0.0 112.909 -178.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.1 p -102.01 -41.18 6.54 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -60.8 -45.36 94.72 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.498 0.666 . . . . 0.0 111.036 -177.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.626 ' O ' HG12 ' A' ' 60' ' ' VAL . 11.5 p-10 -66.01 -45.21 82.37 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.89 -172.445 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 56.6 mmm-85 -56.33 -18.59 11.28 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 123.332 0.653 . . . . 0.0 111.954 -176.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -104.15 -44.26 5.03 Favored 'General case' 0 N--CA 1.419 -1.994 0 CA-C-O 121.048 0.451 . . . . 0.0 110.213 174.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.425 HD12 ' HZ1' ' A' ' 63' ' ' LYS . 23.4 tp -76.84 -55.99 5.0 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -172.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.626 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.6 p -65.51 -22.04 30.24 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.779 0 CA-C-O 121.419 0.628 . . . . 0.0 109.37 -178.483 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -68.92 -31.21 69.94 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 114.254 -1.339 . . . . 0.0 108.8 -177.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -86.41 -42.14 13.88 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.425 -1.261 . . . . 0.0 109.39 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.425 ' HZ1' HD12 ' A' ' 59' ' ' LEU . 0.9 OUTLIER -65.29 -40.84 94.37 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.213 -176.785 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.455 ' HA ' ' HG2' ' A' ' 67' ' ' MET . 3.6 pp -64.1 -32.36 73.89 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.163 -177.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -80.81 -18.88 46.04 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.287 -0.565 . . . . 0.0 111.999 -178.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -108.3 9.98 27.78 Favored 'General case' 0 C--N 1.318 -0.775 0 O-C-N 122.474 -0.141 . . . . 0.0 111.082 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.455 ' HG2' ' HA ' ' A' ' 64' ' ' LEU . 89.6 mmm -51.09 -41.11 59.77 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 121.091 0.472 . . . . 0.0 112.066 -178.434 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 14.6 ptpt -64.12 -22.46 66.94 Favored 'General case' 0 C--N 1.291 -1.943 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -174.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 27.3 ptt? -112.17 9.13 20.1 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-O 121.248 0.547 . . . . 0.0 109.939 178.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 40.0 m -122.51 -32.85 3.53 Favored 'General case' 0 C--O 1.209 -1.06 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.276 -178.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.465 HD11 ' N ' ' A' ' 72' ' ' GLU . 4.5 pp -51.56 -30.17 19.83 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 -174.146 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.465 ' N ' HD11 ' A' ' 71' ' ' LEU . 11.8 tt0 -98.27 -36.2 10.1 Favored 'General case' 0 N--CA 1.414 -2.243 0 CA-C-O 121.382 0.61 . . . . 0.0 111.492 178.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -84.52 -37.73 20.91 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.401 -169.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.429 -1.494 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -176.465 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.324 0 N-CA-C 111.648 -0.581 . . . . 0.0 111.648 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 50.2 p-80 -95.21 -8.22 36.82 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 122.959 0.504 . . . . 0.0 110.452 -175.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.445 ' O ' ' HB2' ' A' ' 6' ' ' GLU . 66.5 mtt -70.31 165.04 23.16 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.544 -173.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.521 HG13 ' CH2' ' A' ' 7' ' ' TRP . 3.6 m -68.24 -30.34 47.46 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -168.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.2 p-80 -70.54 -7.27 42.52 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-O 121.498 0.666 . . . . 0.0 110.783 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 3' ' ' MET . 9.1 mm-40 -99.61 -9.41 23.23 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 124.268 1.027 . . . . 0.0 110.298 178.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.538 ' HA ' ' NE2' ' A' ' 11' ' ' GLN . 54.4 m0 -76.03 142.35 41.85 Favored 'General case' 0 CA--C 1.504 -0.794 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.307 -175.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.9 m -94.81 -79.42 0.43 Allowed 'General case' 0 N--CA 1.418 -2.039 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.862 -178.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.49 ' O ' HG13 ' A' ' 12' ' ' VAL . 94.9 t -141.77 -59.66 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -179.46 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.6 pm0 -60.46 -26.45 66.78 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.03 -0.987 . . . . 0.0 111.437 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.538 ' NE2' ' HA ' ' A' ' 7' ' ' TRP . 23.8 mt-30 -81.31 -16.99 50.8 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 115.01 -0.995 . . . . 0.0 112.356 -175.425 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.49 HG13 ' O ' ' A' ' 9' ' ' VAL . 1.7 p -79.91 -20.17 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 121.894 0.854 . . . . 0.0 109.073 -179.379 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.418 ' HA ' HD12 ' A' ' 16' ' ' LEU . 2.5 m -77.15 -23.51 51.64 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.461 -174.306 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . 0.516 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 97.6 m-70 -60.63 -41.01 94.01 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.491 ' O ' HD23 ' A' ' 19' ' ' LEU . 31.3 t90 -61.99 -60.03 4.22 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 114.649 -1.16 . . . . 0.0 110.163 177.699 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.469 HD13 ' CG ' ' A' ' 28' ' ' PHE . 43.3 mt -47.97 -47.61 32.72 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.262 1.025 . . . . 0.0 112.441 -177.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 89.4 t -64.43 -22.55 31.46 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.168 0 CA-C-O 121.257 0.551 . . . . 0.0 111.018 -179.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.11 -29.84 61.95 Favored Glycine 0 N--CA 1.442 -0.913 0 CA-C-N 116.23 -0.441 . . . . 0.0 112.105 -179.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.506 HD13 ' CB ' ' A' ' 63' ' ' LYS . 0.6 OUTLIER -108.69 17.67 21.66 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -178.821 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.2 m 68.17 25.28 7.36 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 121.845 0.831 . . . . 0.0 111.169 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.458 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.1 mm? -103.62 16.29 26.79 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 124.247 1.019 . . . . 0.0 109.383 178.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -51.5 -26.51 8.52 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.078 0.951 . . . . 0.0 111.606 175.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -64.38 -23.52 67.32 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 124.066 0.946 . . . . 0.0 111.129 178.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.425 ' CE1' ' HG2' ' A' ' 51' ' ' MET . 2.0 m-85 -85.89 -19.01 31.19 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.34 -178.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 95.7 t -53.64 -38.56 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.863 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.9 t -50.01 -39.23 40.69 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.774 0.829 . . . . 0.0 111.734 -179.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 12.3 tp10 -104.22 -30.53 10.12 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 120.978 -0.289 . . . . 0.0 110.829 -178.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.469 ' CG ' HD13 ' A' ' 16' ' ' LEU . 1.7 m-85 -56.18 -39.22 72.05 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 121.48 0.657 . . . . 0.0 110.238 176.656 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.8 t -76.05 -30.16 58.31 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.403 179.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.76 -45.18 72.06 Favored 'General case' 0 CA--C 1.504 -0.817 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.01 -176.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -94.7 13.94 22.78 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 -178.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 57.57 39.91 27.32 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.857 0.863 . . . . 0.0 111.837 174.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 49.9 mm -68.84 115.47 7.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.456 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 89.6 p -108.7 -170.21 1.63 Allowed 'General case' 0 N--CA 1.423 -1.789 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 178.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.475 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -60.04 -32.72 76.51 Favored Glycine 0 CA--C 1.507 -0.406 0 N-CA-C 111.379 -0.688 . . . . 0.0 111.379 -179.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -50.28 -45.27 54.32 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 125.146 1.378 . . . . 0.0 110.387 176.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.449 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -96.79 -14.8 21.69 Favored 'General case' 0 C--O 1.214 -0.765 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 179.778 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.6 tt -69.03 -53.06 22.47 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 -179.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 36.3 mt -60.3 -36.23 77.4 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.949 -176.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -97.36 10.51 39.45 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 113.755 1.021 . . . . 0.0 113.755 -175.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 37' ' ' GLN . 41.0 mt -54.51 136.14 45.01 Favored 'General case' 0 C--O 1.243 0.745 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 179.28 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -134.78 -177.77 4.77 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 177.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.18 -41.99 95.05 Favored Glycine 0 C--O 1.211 -1.338 0 CA-C-O 119.169 -0.795 . . . . 0.0 113.412 -178.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -62.52 -37.43 86.0 Favored 'General case' 0 CA--C 1.475 -1.932 0 CA-C-N 117.654 0.727 . . . . 0.0 112.442 -177.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.5 mtpp -63.48 -49.6 72.97 Favored 'General case' 0 C--N 1.299 -1.6 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.791 175.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.6 mt -60.99 -22.58 64.64 Favored 'General case' 0 C--O 1.261 1.694 0 CA-C-O 121.328 0.585 . . . . 0.0 111.725 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.447 ' HA ' HG21 ' A' ' 52' ' ' THR . 62.2 mtpt -82.98 -41.67 18.48 Favored 'General case' 0 N--CA 1.433 -1.304 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.966 176.699 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.37 -11.23 60.79 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.554 0.693 . . . . 0.0 110.795 177.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.464 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 3.7 mm? -77.01 -3.28 38.24 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 172.37 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.14 1.85 51.0 Favored Glycine 0 CA--C 1.506 -0.506 0 CA-C-N 116.226 -0.443 . . . . 0.0 113.591 175.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.425 ' HG2' ' CE1' ' A' ' 24' ' ' TYR . 15.7 tpt -91.89 -50.89 5.48 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.367 -177.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.447 HG21 ' HA ' ' A' ' 47' ' ' LYS . 68.6 p 53.51 20.17 1.98 Allowed 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 124.959 1.304 . . . . 0.0 113.736 176.161 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 42.4 t -68.78 130.19 42.09 Favored 'General case' 0 C--N 1.31 -1.122 0 C-N-CA 123.057 0.543 . . . . 0.0 111.472 -172.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 31.7 t -56.38 -47.57 78.65 Favored 'General case' 0 C--O 1.247 0.931 0 C-N-CA 124.633 1.173 . . . . 0.0 111.631 -175.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 -53.88 -58.2 8.12 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-O 122.165 0.984 . . . . 0.0 110.471 177.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.693 ' O ' HG12 ' A' ' 60' ' ' VAL . 7.7 m-20 -63.15 -40.85 98.76 Favored 'General case' 0 N--CA 1.422 -1.869 0 CA-C-N 113.451 -1.704 . . . . 0.0 110.592 -171.736 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -54.06 -26.3 26.08 Favored 'General case' 0 C--O 1.218 -0.571 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 178.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -104.79 -14.92 15.37 Favored 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 121.134 -0.226 . . . . 0.0 111.504 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.408 HD13 ' C ' ' A' ' 59' ' ' LEU . 3.4 tm? -96.57 -59.01 1.91 Allowed 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 -175.12 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.693 HG12 ' O ' ' A' ' 56' ' ' ASP . 4.8 p -57.41 -26.77 27.17 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.553 0 CA-C-O 120.805 0.336 . . . . 0.0 110.865 -177.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.465 ' HD2' HD21 ' A' ' 64' ' ' LEU . 24.7 mmmt -62.12 -30.53 71.09 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.84 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.422 ' HA ' ' HE2' ' A' ' 65' ' ' LYS . 37.9 ttmt -79.25 -44.69 21.25 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 121.952 0.882 . . . . 0.0 109.114 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.506 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -70.54 -31.74 68.92 Favored 'General case' 0 C--N 1.295 -1.795 0 CA-C-N 114.01 -1.45 . . . . 0.0 112.404 -174.356 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.465 HD21 ' HD2' ' A' ' 61' ' ' LYS . 3.9 pp -75.05 -32.15 61.47 Favored 'General case' 0 N--CA 1.437 -1.107 0 N-CA-C 112.0 0.371 . . . . 0.0 112.0 179.507 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.422 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 64.2 pttt -80.07 -29.2 39.13 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 119.491 -0.884 . . . . 0.0 111.022 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.403 ' HG2' ' HA ' ' A' ' 63' ' ' LYS . 12.1 pt-20 -84.12 -2.54 56.96 Favored 'General case' 0 C--O 1.242 0.677 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 178.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.411 ' HA ' ' CE ' ' A' ' 67' ' ' MET . 0.0 OUTLIER -46.68 -36.8 7.48 Favored 'General case' 0 CA--C 1.488 -1.408 0 C-N-CA 123.597 0.759 . . . . 0.0 112.654 -178.457 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -55.13 -30.49 59.88 Favored 'General case' 0 C--N 1.309 -1.186 0 O-C-N 124.05 0.844 . . . . 0.0 112.622 -175.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 25.9 ptt? -107.79 -32.0 7.81 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.227 0.537 . . . . 0.0 110.029 177.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 49.2 m -78.53 -19.75 52.22 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -173.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.3 pp -68.98 -32.01 71.28 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-O 121.463 0.649 . . . . 0.0 109.941 176.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -87.25 -51.17 6.12 Favored 'General case' 0 N--CA 1.413 -2.319 0 CA-C-N 114.584 -1.189 . . . . 0.0 112.283 -174.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.438 ' HB2' ' NZ ' ' A' ' 73' ' ' LYS . 6.8 mtmp? -80.61 -73.97 0.34 Allowed 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 121.613 0.721 . . . . 0.0 109.147 -174.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.416 -2.141 1 N-CA-C 99.948 -4.093 . . . . 0.0 99.948 -175.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.174 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 29.5 p80 53.05 16.23 0.71 Allowed 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 126.682 1.993 . . . . 0.0 115.124 177.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 67.4 mtt -85.41 156.5 20.83 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 178.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.574 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.4 m -70.79 -28.63 34.6 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.249 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -167.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 22.8 p-80 -73.38 -6.77 48.36 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 121.044 0.45 . . . . 0.0 110.606 178.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -105.25 -2.22 24.33 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.611 178.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.495 ' HA ' ' NE2' ' A' ' 11' ' ' GLN . 53.5 m0 -78.74 142.12 37.29 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.337 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.9 m -96.41 -81.92 0.41 Allowed 'General case' 0 N--CA 1.415 -2.222 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.98 -177.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.543 ' O ' HG12 ' A' ' 12' ' ' VAL . 87.2 t -139.71 -58.62 0.31 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.951 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 -178.426 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.4 pm0 -63.07 -29.47 70.84 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.523 0.678 . . . . 0.0 111.356 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.495 ' NE2' ' HA ' ' A' ' 7' ' ' TRP . 20.4 mt-30 -75.66 -15.63 60.29 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.802 -176.712 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.543 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.9 p -80.73 -18.32 12.06 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-O 121.285 0.564 . . . . 0.0 109.789 -179.423 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.425 ' O ' HG21 ' A' ' 17' ' ' VAL . 86.1 p -73.6 -39.27 64.72 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.448 -174.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -50.69 -41.07 55.49 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 114.831 -1.077 . . . . 0.0 110.842 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.469 ' O ' HD23 ' A' ' 19' ' ' LEU . 28.6 t90 -65.52 -58.81 4.9 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.988 176.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 40.4 mt -48.66 -48.28 39.99 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.963 0.905 . . . . 0.0 112.189 -178.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.425 HG21 ' O ' ' A' ' 13' ' ' SER . 60.6 t -65.68 -16.34 20.26 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.393 0 CA-C-O 121.069 0.462 . . . . 0.0 111.162 -178.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -85.81 -21.26 53.86 Favored Glycine 0 N--CA 1.444 -0.807 0 N-CA-C 112.336 -0.306 . . . . 0.0 112.336 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.469 HD23 ' O ' ' A' ' 15' ' ' TRP . 1.3 pt? -112.45 21.66 15.46 Favored 'General case' 0 C--O 1.213 -0.839 0 O-C-N 122.154 -0.615 . . . . 0.0 111.572 177.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.4 m 68.82 22.26 7.33 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.613 0.765 . . . . 0.0 111.747 -179.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -103.11 17.74 23.36 Favored 'General case' 0 C--N 1.3 -1.564 0 C-N-CA 123.905 0.882 . . . . 0.0 110.55 -178.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -54.68 -26.82 35.92 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.468 0.707 . . . . 0.0 111.312 176.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -64.88 -21.66 66.85 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 124.599 1.16 . . . . 0.0 111.327 177.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.448 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 3.2 m-85 -89.65 -20.63 23.44 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.784 -179.097 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.1 t -55.73 -38.15 49.78 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 O-C-N 123.321 0.388 . . . . 0.0 111.532 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.4 m -51.12 -41.09 59.83 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.812 0.845 . . . . 0.0 111.282 -178.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 16.1 tp10 -99.31 -34.58 10.26 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.267 -177.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -54.21 -48.19 71.31 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-O 121.297 0.57 . . . . 0.0 110.919 178.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 45.8 m -77.81 -11.23 59.86 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.516 -178.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.22 -29.63 26.38 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.878 0.371 . . . . 0.0 110.401 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.74 2.45 47.02 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 120.132 -0.627 . . . . 0.0 109.871 178.718 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 65.53 32.44 9.38 Favored 'General case' 0 CA--C 1.514 -0.439 0 C-N-CA 123.981 0.912 . . . . 0.0 110.826 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.9 mm -62.63 113.13 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 O-C-N 123.643 0.589 . . . . 0.0 109.628 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 71.1 p -100.09 -172.09 2.16 Favored 'General case' 0 N--CA 1.423 -1.822 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.574 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -65.17 -23.05 69.54 Favored Glycine 0 N--CA 1.439 -1.159 0 N-CA-C 111.513 -0.635 . . . . 0.0 111.513 178.331 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -62.45 -40.44 96.62 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 123.641 0.776 . . . . 0.0 109.917 179.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.411 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -93.04 -17.37 23.94 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.909 179.743 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.43 HD12 HG23 ' A' ' 12' ' ' VAL . 3.2 tt -69.0 -51.48 38.84 Favored 'General case' 0 C--N 1.314 -0.96 0 C-N-CA 124.593 1.157 . . . . 0.0 109.217 179.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 63.5 mt -58.63 -38.91 79.07 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.369 0.604 . . . . 0.0 111.776 -178.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -97.77 13.73 29.4 Favored 'General case' 0 C--N 1.299 -1.611 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.715 -176.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.464 ' CB ' HD21 ' A' ' 64' ' ' LEU . 31.4 mt -54.22 139.22 36.56 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.801 0.81 . . . . 0.0 112.271 177.443 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -139.39 170.62 15.59 Favored 'General case' 0 C--N 1.284 -2.264 0 N-CA-C 106.296 -1.742 . . . . 0.0 106.296 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -53.3 -37.56 55.41 Favored Glycine 0 C--O 1.211 -1.324 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 177.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -49.56 -49.87 44.59 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.834 0.853 . . . . 0.0 110.352 178.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.3 mtpp -71.31 -44.04 65.92 Favored 'General case' 0 N--CA 1.421 -1.879 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.624 -177.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 88.2 mt -60.17 -28.38 67.89 Favored 'General case' 0 C--O 1.255 1.387 0 CA-C-O 121.49 0.662 . . . . 0.0 111.121 -179.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.488 ' HA ' HG21 ' A' ' 52' ' ' THR . 54.3 mtpt -78.92 -33.13 45.72 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 115.151 -0.932 . . . . 0.0 109.952 176.762 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.98 -4.89 46.35 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 123.127 0.571 . . . . 0.0 111.574 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.571 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.4 mm? -87.53 -2.15 58.42 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 173.17 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.06 -9.76 6.46 Favored Glycine 0 C--O 1.222 -0.602 0 CA-C-N 115.713 -0.676 . . . . 0.0 114.128 175.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.768 ' SD ' ' HB2' ' A' ' 53' ' ' SER . 0.0 OUTLIER -79.49 -50.36 10.88 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -176.336 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.488 HG21 ' HA ' ' A' ' 47' ' ' LYS . 70.1 p 53.21 27.44 6.0 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.833 1.253 . . . . 0.0 113.103 175.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.768 ' HB2' ' SD ' ' A' ' 51' ' ' MET . 40.0 t -65.7 123.55 20.02 Favored 'General case' 0 C--N 1.313 -1.015 0 C-N-CA 123.532 0.733 . . . . 0.0 111.944 -174.6 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.1 m -54.6 -41.72 70.27 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.958 0.903 . . . . 0.0 113.198 -177.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -61.07 -55.83 28.09 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.982 0.896 . . . . 0.0 109.557 176.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.691 ' O ' HG13 ' A' ' 60' ' ' VAL . 67.0 m-20 -62.61 -40.55 97.31 Favored 'General case' 0 N--CA 1.427 -1.577 0 CA-C-N 113.593 -1.64 . . . . 0.0 111.135 -171.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.1 mmm180 -53.79 -22.39 9.38 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 124.058 0.943 . . . . 0.0 113.045 177.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -106.8 -26.2 11.37 Favored 'General case' 0 N--CA 1.444 -0.752 0 O-C-N 123.138 0.274 . . . . 0.0 111.425 177.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.425 HD13 ' HZ1' ' A' ' 63' ' ' LYS . 47.8 tp -86.42 -52.57 5.52 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -176.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.691 HG13 ' O ' ' A' ' 56' ' ' ASP . 6.5 p -62.77 -22.88 31.36 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.244 0 CA-C-O 121.414 0.625 . . . . 0.0 109.485 178.063 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.427 ' HA ' ' CD2' ' A' ' 64' ' ' LEU . 26.7 tptp -71.22 -27.53 63.56 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 114.422 -1.263 . . . . 0.0 108.797 -176.594 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -83.44 -46.78 12.11 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.909 -1.496 . . . . 0.0 108.995 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.453 ' HE3' ' CB ' ' A' ' 19' ' ' LEU . 0.9 OUTLIER -67.58 -40.01 84.84 Favored 'General case' 0 N--CA 1.426 -1.657 0 CA-C-N 114.143 -1.39 . . . . 0.0 110.933 -174.885 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.464 HD21 ' CB ' ' A' ' 41' ' ' LEU . 3.9 pp -64.05 -30.72 71.77 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.012 -176.279 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -87.29 -10.17 53.03 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 118.078 -1.449 . . . . 0.0 111.639 -178.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -113.45 15.76 19.02 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 120.364 -0.534 . . . . 0.0 109.605 178.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.451 ' HG2' ' O ' ' A' ' 64' ' ' LEU . 90.6 mmm -47.49 -33.12 5.88 Favored 'General case' 0 C--O 1.19 -2.069 0 C-N-CA 123.567 0.747 . . . . 0.0 112.291 177.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.1 ptpt -52.35 -28.81 20.84 Favored 'General case' 0 C--N 1.283 -2.304 0 C-N-CA 124.804 1.242 . . . . 0.0 112.781 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 23.0 ptp -113.08 -27.28 8.09 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 174.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.5 t -74.19 -29.0 61.54 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.751 -175.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.1 pp -63.62 -31.8 73.08 Favored 'General case' 0 CA--C 1.491 -1.323 0 CA-C-O 121.101 0.477 . . . . 0.0 110.988 179.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -68.81 -50.01 53.72 Favored 'General case' 0 N--CA 1.409 -2.495 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.707 -178.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -65.95 -56.76 10.05 Favored 'General case' 0 N--CA 1.427 -1.621 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.448 -176.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.633 0 O-C-N 124.598 1.186 . . . . 0.0 110.029 -177.309 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.171 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.1 p80 -118.71 -5.02 10.7 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 111.725 0.268 . . . . 0.0 111.725 -177.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 94.4 mmm -82.7 156.83 23.58 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.529 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.4 m -69.85 -30.02 42.84 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -169.126 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 18.0 p-80 -71.55 -12.85 61.58 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-O 121.292 0.568 . . . . 0.0 110.969 178.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -96.73 -12.6 23.53 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.994 178.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.413 ' CH2' HG11 ' A' ' 4' ' ' VAL . 51.0 m0 -66.45 141.03 58.06 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.171 -178.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.1 m -94.54 -80.06 0.41 Allowed 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.647 -178.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.538 ' O ' HG13 ' A' ' 12' ' ' VAL . 91.9 t -141.12 -60.43 0.22 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.143 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 -176.351 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.1 pm0 -64.01 -23.29 67.28 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 115.186 -0.916 . . . . 0.0 112.265 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.521 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 34.6 mt-30 -81.16 -18.26 46.94 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 179.375 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.538 HG13 ' O ' ' A' ' 9' ' ' VAL . 2.0 p -73.77 -24.34 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-O 121.63 0.728 . . . . 0.0 109.699 -179.102 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.452 ' O ' HG23 ' A' ' 17' ' ' VAL . 0.7 OUTLIER -70.8 -30.1 66.46 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.195 -176.214 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . 0.521 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 94.8 m-70 -58.09 -39.33 78.33 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-O 121.037 0.446 . . . . 0.0 110.039 -178.258 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.567 ' O ' HD23 ' A' ' 19' ' ' LEU . 35.4 t90 -65.17 -60.47 2.98 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.936 176.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.505 HD13 ' CG ' ' A' ' 28' ' ' PHE . 50.3 mt -48.59 -51.08 29.7 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.103 0.961 . . . . 0.0 112.441 -177.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 13' ' ' SER . 59.2 t -66.22 -20.78 27.78 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 CA-C-O 121.044 0.449 . . . . 0.0 110.572 -177.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -76.6 -30.33 56.53 Favored Glycine 0 N--CA 1.439 -1.158 0 N-CA-C 111.174 -0.77 . . . . 0.0 111.174 -177.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.567 HD23 ' O ' ' A' ' 15' ' ' TRP . 1.0 OUTLIER -102.11 14.11 32.87 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.995 -0.282 . . . . 0.0 110.579 177.197 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.9 m 65.03 37.82 6.57 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-O 121.591 0.71 . . . . 0.0 112.255 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.701 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -109.82 22.31 15.82 Favored 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 127.082 2.153 . . . . 0.0 107.889 176.61 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -53.24 -27.77 23.93 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.321 0.648 . . . . 0.0 112.621 177.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.701 ' NE2' ' HA ' ' A' ' 21' ' ' LEU . 3.5 pm0 -66.39 -18.38 65.32 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 175.653 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -87.45 -21.53 25.49 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.225 178.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 90.8 t -57.48 -37.96 60.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 122.508 0.323 . . . . 0.0 110.705 179.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 7.2 m -49.66 -36.76 25.87 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 124.81 1.244 . . . . 0.0 111.929 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.476 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 19.8 tp10 -106.62 -34.06 7.45 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.507 -178.531 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.505 ' CG ' HD13 ' A' ' 16' ' ' LEU . 1.2 m-85 -53.02 -48.14 67.81 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 121.37 0.605 . . . . 0.0 110.811 177.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.4 m -76.83 -21.17 55.45 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.385 -177.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.69 -31.82 63.62 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.818 0.342 . . . . 0.0 111.273 -178.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.74 7.58 44.96 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 119.78 -0.768 . . . . 0.0 111.94 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 65.24 36.98 6.72 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.68 0.792 . . . . 0.0 110.695 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.448 HG21 ' HB2' ' A' ' 37' ' ' GLN . 45.0 mm -69.04 119.2 14.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 178.467 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 63.1 p -106.33 -172.31 2.06 Favored 'General case' 0 N--CA 1.419 -2.003 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 179.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.529 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -64.48 -22.96 68.17 Favored Glycine 0 N--CA 1.447 -0.592 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 177.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -60.08 -44.29 94.88 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 123.673 0.789 . . . . 0.0 109.791 177.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.448 ' HB2' HG21 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -83.96 -26.25 29.41 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 -177.703 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.1 tt -62.79 -50.64 70.2 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.007 1.323 . . . . 0.0 110.724 -174.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 38.6 mt -62.96 -31.47 72.58 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.161 -177.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -103.41 13.08 34.41 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-N 115.575 -0.738 . . . . 0.0 112.553 -177.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.7 mt -53.49 145.67 14.3 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.409 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 24.5 t70 -142.39 169.04 18.33 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 105.827 -1.916 . . . . 0.0 105.827 179.016 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.502 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -54.03 -36.32 55.97 Favored Glycine 0 CA--C 1.487 -1.705 0 N-CA-C 110.502 -1.039 . . . . 0.0 110.502 176.286 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.409 ' HA ' ' HD3' ' A' ' 47' ' ' LYS . 66.1 t30 -50.67 -51.25 50.99 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-O 121.748 0.785 . . . . 0.0 110.238 178.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.446 ' O ' HD23 ' A' ' 49' ' ' LEU . 13.5 mtpp -68.27 -39.8 82.06 Favored 'General case' 0 C--O 1.198 -1.64 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.3 -177.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 81.6 mt -62.89 -24.7 67.95 Favored 'General case' 0 C--O 1.254 1.299 0 CA-C-O 121.452 0.644 . . . . 0.0 110.767 179.211 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.502 ' HG3' ' O ' ' A' ' 43' ' ' GLY . 6.8 mtpm? -80.11 -35.78 36.31 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.067 -0.97 . . . . 0.0 108.931 175.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.45 -9.24 58.29 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 123.63 0.772 . . . . 0.0 111.581 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.476 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 2.9 mm? -86.06 -4.49 59.18 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 172.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 69.71 -0.07 22.34 Favored Glycine 0 C--N 1.328 0.135 0 CA-C-N 116.088 -0.506 . . . . 0.0 114.11 176.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.454 ' HA ' ' HE1' ' A' ' 51' ' ' MET . 0.6 OUTLIER -84.37 -43.6 14.57 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 179.212 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.495 HG22 ' HA ' ' A' ' 47' ' ' LYS . 72.0 p 50.39 21.09 0.77 Allowed 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 125.721 1.608 . . . . 0.0 114.406 172.49 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.1 t -73.04 121.92 20.94 Favored 'General case' 0 C--N 1.3 -1.565 0 C-N-CA 122.428 0.291 . . . . 0.0 111.331 -174.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.2 m -63.59 -28.74 70.14 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -178.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.93 -54.59 24.36 Favored 'General case' 0 CA--C 1.503 -0.839 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 176.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.602 ' O ' HG12 ' A' ' 60' ' ' VAL . 4.6 m-20 -61.13 -45.71 93.55 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.182 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.507 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 12.0 mtm180 -63.51 -17.4 62.73 Favored 'General case' 0 C--O 1.207 -1.152 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.7 -15.5 30.21 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 121.373 0.606 . . . . 0.0 110.332 177.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.514 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 39.3 tp -100.81 -49.06 4.27 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.181 -178.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.602 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.5 p -60.62 -25.81 35.98 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.767 0 CA-C-O 121.727 0.775 . . . . 0.0 109.998 179.16 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 56.8 tptt -71.85 -34.03 68.92 Favored 'General case' 0 C--N 1.295 -1.776 0 CA-C-N 114.246 -1.343 . . . . 0.0 109.701 -172.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.514 ' HG2' ' O ' ' A' ' 59' ' ' LEU . 21.0 ptmt -87.9 -31.86 19.24 Favored 'General case' 0 N--CA 1.418 -2.061 0 CA-C-N 114.78 -1.1 . . . . 0.0 108.306 -177.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.452 ' O ' ' HB3' ' A' ' 67' ' ' MET . 2.6 tppt? -70.98 -44.87 65.06 Favored 'General case' 0 N--CA 1.417 -2.09 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.854 -178.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.7 pp -59.15 -31.42 68.95 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.959 0.409 . . . . 0.0 111.858 -176.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -87.86 -5.04 58.79 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -177.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -118.35 -13.17 9.82 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 120.268 -0.573 . . . . 0.0 109.685 174.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.452 ' HB3' ' O ' ' A' ' 63' ' ' LYS . 2.5 ppp? -61.2 -18.81 60.14 Favored 'General case' 0 C--O 1.191 -1.989 0 C-N-CA 124.021 0.928 . . . . 0.0 111.8 -172.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -68.85 -23.58 64.26 Favored 'General case' 0 C--N 1.29 -1.997 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.772 178.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 39.4 mtt -106.39 -35.06 7.24 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 107.775 -1.195 . . . . 0.0 107.775 174.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.445 ' HB2' ' HA ' ' A' ' 67' ' ' MET . 19.0 m -75.43 -21.29 58.3 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 -175.444 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.3 pp -57.21 -33.65 67.74 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-O 122.039 0.923 . . . . 0.0 109.245 178.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -78.73 -52.26 8.64 Favored 'General case' 0 N--CA 1.403 -2.82 0 CA-C-N 114.209 -1.36 . . . . 0.0 111.979 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 55.8 pttt -82.95 -31.89 27.42 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -171.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.392 0 CA-C-O 119.413 -0.327 . . . . 0.0 110.952 -173.69 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.625 0 N-CA-C 111.091 -0.804 . . . . 0.0 111.091 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 34.7 p80 -82.61 0.74 41.6 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 121.163 0.506 . . . . 0.0 111.327 -179.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -73.67 154.48 39.68 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.126 -176.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.503 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 10.9 m -69.0 -33.0 56.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -171.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -69.37 -13.08 62.18 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-O 121.603 0.716 . . . . 0.0 110.75 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -88.95 -12.45 41.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.671 178.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.501 ' CH2' HG13 ' A' ' 4' ' ' VAL . 50.2 m0 -79.12 142.84 36.07 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 -179.525 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 13.1 m -99.83 -72.16 0.67 Allowed 'General case' 0 C--N 1.294 -1.819 0 O-C-N 123.657 0.598 . . . . 0.0 110.374 -178.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.513 ' O ' HG13 ' A' ' 12' ' ' VAL . 54.6 t -141.48 -65.76 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.209 -1.076 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 -179.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -62.4 -22.86 66.49 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -176.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.44 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 18.3 mt-30 -80.32 -18.47 49.09 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 176.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.513 HG13 ' O ' ' A' ' 9' ' ' VAL . 1.4 p -75.25 -23.0 16.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 179.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.419 ' HA ' HD13 ' A' ' 16' ' ' LEU . 1.4 m -76.04 -27.56 57.36 Favored 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.246 -176.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . 0.44 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 84.4 m-70 -63.16 -34.82 78.45 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.491 ' O ' HD22 ' A' ' 19' ' ' LEU . 30.4 t90 -66.38 -62.21 1.59 Allowed 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.483 175.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.509 HD11 ' CG ' ' A' ' 28' ' ' PHE . 56.8 mt -44.83 -50.18 10.4 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.354 1.061 . . . . 0.0 112.946 -177.527 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 99.0 t -62.01 -27.73 42.99 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.277 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.688 -178.052 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.63 -35.44 74.39 Favored Glycine 0 N--CA 1.444 -0.831 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 -177.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.491 HD22 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -98.55 10.0 41.96 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 -179.305 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.3 m 75.59 19.47 2.06 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 124.206 1.002 . . . . 0.0 112.301 179.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -95.99 19.32 11.75 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.103 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -48.21 -33.56 8.73 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.231 1.412 . . . . 0.0 111.187 173.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -62.56 -22.05 66.05 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.77 -1.105 . . . . 0.0 111.124 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.454 ' HB3' ' CD1' ' A' ' 28' ' ' PHE . 13.4 m-85 -90.77 -20.24 22.59 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.877 -178.209 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 99.0 t -52.84 -37.62 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 C-N-CA 123.055 0.542 . . . . 0.0 111.855 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 29.7 t -57.58 -33.27 67.99 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 122.902 0.481 . . . . 0.0 111.923 -177.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -106.91 -28.21 10.22 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 121.176 -0.21 . . . . 0.0 110.898 -179.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.574 ' CE1' HD11 ' A' ' 49' ' ' LEU . 2.1 m-85 -54.79 -38.76 67.68 Favored 'General case' 0 C--N 1.347 0.476 0 CA-C-O 121.829 0.823 . . . . 0.0 109.462 174.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 31.1 p -74.17 -27.56 60.89 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 114.841 -1.072 . . . . 0.0 111.887 -179.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.09 -31.95 64.68 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-O 121.166 0.508 . . . . 0.0 110.387 -175.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.469 ' NE2' HD21 ' A' ' 49' ' ' LEU . 5.6 mt-30 -95.16 -1.39 51.95 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 119.815 -0.754 . . . . 0.0 110.41 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 63.58 38.69 9.45 Favored 'General case' 0 CA--C 1.512 -0.486 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -179.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.46 HG22 ' HB2' ' A' ' 37' ' ' GLN . 44.7 mm -65.01 114.75 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.603 -179.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.4 p -97.34 -175.53 3.24 Favored 'General case' 0 N--CA 1.407 -2.584 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 176.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.503 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -65.25 -21.46 68.31 Favored Glycine 0 N--CA 1.433 -1.533 0 N-CA-C 111.563 -0.615 . . . . 0.0 111.563 178.126 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -65.49 -38.7 90.54 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.46 ' HB2' HG22 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -84.85 -28.39 26.07 Favored 'General case' 0 CA--C 1.507 -0.685 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 -179.227 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.416 HD13 HG21 ' A' ' 12' ' ' VAL . 2.6 tt -58.56 -51.05 71.54 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 125.196 1.398 . . . . 0.0 109.654 -178.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 21.7 mt -57.37 -37.94 73.43 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.366 -178.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -100.48 21.49 13.16 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -177.718 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.414 ' HB2' HD21 ' A' ' 64' ' ' LEU . 27.9 mt -62.37 139.02 58.55 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.116 0.484 . . . . 0.0 111.786 175.253 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.466 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 0.6 OUTLIER -138.95 178.05 7.44 Favored 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 177.656 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.59 -37.93 69.45 Favored Glycine 0 C--O 1.203 -1.815 0 CA-C-O 119.322 -0.71 . . . . 0.0 113.209 178.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -62.35 -41.67 98.77 Favored 'General case' 0 CA--C 1.482 -1.636 0 CA-C-N 117.747 0.774 . . . . 0.0 112.666 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.51 ' O ' ' HG ' ' A' ' 49' ' ' LEU . 16.5 mtpp -66.02 -40.6 91.2 Favored 'General case' 0 C--N 1.31 -1.141 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.087 175.662 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.483 ' HA ' HD12 ' A' ' 49' ' ' LEU . 87.5 mt -63.96 -34.16 77.35 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-O 121.773 0.797 . . . . 0.0 110.548 178.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.511 ' HA ' HG22 ' A' ' 52' ' ' THR . 43.1 mtpt -71.39 -37.1 71.58 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.242 176.634 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.11 3.74 16.65 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.455 0.645 . . . . 0.0 110.87 -179.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.574 HD11 ' CE1' ' A' ' 28' ' ' PHE . 72.4 mt -95.94 -0.84 50.26 Favored 'General case' 0 N--CA 1.428 -1.535 0 CA-C-O 121.663 0.744 . . . . 0.0 109.215 176.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 81.14 -23.26 4.63 Favored Glycine 0 CA--C 1.501 -0.79 0 CA-C-N 115.271 -0.877 . . . . 0.0 113.58 173.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 16.4 mmt -74.97 -55.4 5.8 Favored 'General case' 0 C--N 1.296 -1.742 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 -176.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.511 HG22 ' HA ' ' A' ' 47' ' ' LYS . 14.7 p 60.49 23.37 13.01 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.312 1.045 . . . . 0.0 110.922 174.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.8 m -68.38 126.11 28.58 Favored 'General case' 0 N--CA 1.421 -1.877 0 C-N-CA 124.531 1.133 . . . . 0.0 112.426 -173.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.9 m -58.98 -40.85 86.09 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.391 1.077 . . . . 0.0 113.398 -175.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -55.23 -57.87 10.01 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 122.817 1.294 . . . . 0.0 109.072 177.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.739 ' O ' HG12 ' A' ' 60' ' ' VAL . 9.8 m-20 -60.42 -42.53 96.18 Favored 'General case' 0 N--CA 1.415 -2.219 0 CA-C-N 112.462 -2.154 . . . . 0.0 110.961 -174.198 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.5 mmm-85 -52.35 -24.48 7.68 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 177.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -104.08 -36.56 7.67 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-O 120.97 0.414 . . . . 0.0 111.081 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.418 ' C ' HD11 ' A' ' 59' ' ' LEU . 2.1 tm? -72.59 -60.67 2.12 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.301 -176.249 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.739 HG12 ' O ' ' A' ' 56' ' ' ASP . 8.2 p -60.63 -25.28 34.42 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.72 0 CA-C-O 121.837 0.827 . . . . 0.0 109.417 -176.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -71.02 -25.92 62.88 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.059 -175.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.3 tttm -85.14 -39.56 17.75 Favored 'General case' 0 N--CA 1.424 -1.769 0 CA-C-N 115.428 -0.806 . . . . 0.0 109.057 176.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.06 -40.76 87.13 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.408 -176.086 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.446 ' O ' ' HG2' ' A' ' 67' ' ' MET . 4.1 pp -66.36 -29.02 69.12 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.934 -177.133 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -88.24 -1.87 58.27 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 120.099 -0.64 . . . . 0.0 111.773 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.488 ' O ' ' HG2' ' A' ' 69' ' ' MET . 12.8 pt-20 -124.52 15.86 8.88 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 176.664 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.446 ' HG2' ' O ' ' A' ' 64' ' ' LEU . 89.0 mmm -49.54 -36.99 25.3 Favored 'General case' 0 CA--C 1.469 -2.154 0 CA-C-O 121.319 0.581 . . . . 0.0 111.739 179.419 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -61.59 -20.18 63.03 Favored 'General case' 0 C--N 1.277 -2.556 0 CA-C-N 114.658 -1.156 . . . . 0.0 113.015 -176.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.488 ' HG2' ' O ' ' A' ' 66' ' ' GLU . 23.4 ptp -113.77 -3.96 13.43 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 120.611 -0.436 . . . . 0.0 109.9 178.367 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 22.7 t -107.92 -33.31 7.26 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.192 -175.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.557 HD11 ' N ' ' A' ' 72' ' ' GLU . 3.8 pp -47.96 -35.09 10.19 Favored 'General case' 0 CA--C 1.501 -0.923 0 N-CA-C 115.244 1.572 . . . . 0.0 115.244 -174.461 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.557 ' N ' HD11 ' A' ' 71' ' ' LEU . 16.8 tt0 -63.28 -39.46 94.65 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.005 -179.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -90.37 -69.95 0.7 Allowed 'General case' 0 N--CA 1.415 -2.211 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 -175.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.815 0 C-N-CA 127.638 2.375 . . . . 0.0 105.031 178.447 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.718 0 N-CA-C 111.122 -0.791 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . 0.447 ' NE2' ' HA ' ' A' ' 72' ' ' GLU . 46.4 p-80 -96.22 -9.01 31.47 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.804 0.302 . . . . 0.0 110.611 -178.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -65.99 165.12 13.87 Favored 'General case' 0 C--N 1.322 -0.603 0 O-C-N 124.326 1.016 . . . . 0.0 111.877 -173.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.492 ' HA ' ' CD2' ' A' ' 7' ' ' TRP . 4.5 m -70.58 -30.2 41.54 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -170.381 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 11.1 p-80 -68.34 -15.91 63.74 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.338 0.589 . . . . 0.0 110.895 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -86.48 -11.85 50.61 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.555 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.492 ' CD2' ' HA ' ' A' ' 4' ' ' VAL . 51.2 m0 -78.8 142.32 37.04 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-O 121.436 0.636 . . . . 0.0 111.132 -176.517 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.98 -80.66 0.33 Allowed 'General case' 0 N--CA 1.417 -2.1 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.104 -178.567 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.47 ' O ' HG11 ' A' ' 12' ' ' VAL . 59.5 t -143.27 -60.76 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.839 0 CA-C-N 113.82 -1.537 . . . . 0.0 108.882 -177.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.0 pm0 -74.12 -10.94 60.12 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.296 0.57 . . . . 0.0 112.091 -175.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -86.32 -17.46 34.5 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.72 176.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.47 HG11 ' O ' ' A' ' 9' ' ' VAL . 2.5 p -70.66 -24.12 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-O 122.125 0.964 . . . . 0.0 108.979 -178.565 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.462 ' HA ' HD11 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -70.06 -26.24 63.93 Favored 'General case' 0 N--CA 1.418 -2.064 0 CA-C-N 114.425 -1.261 . . . . 0.0 111.31 -176.733 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 29.3 m-70 -63.67 -39.36 94.14 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -177.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.493 ' O ' HD23 ' A' ' 19' ' ' LEU . 28.0 t90 -63.93 -55.83 19.67 Favored 'General case' 0 CA--C 1.511 -0.544 0 O-C-N 123.814 0.696 . . . . 0.0 109.743 176.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.462 HD11 ' HA ' ' A' ' 13' ' ' SER . 46.4 mt -48.11 -48.71 33.64 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.269 1.028 . . . . 0.0 112.458 -178.213 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.459 HG21 ' O ' ' A' ' 13' ' ' SER . 86.7 t -61.16 -27.08 41.01 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 C-N-CA 122.471 0.308 . . . . 0.0 111.381 -178.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.24 -28.73 65.56 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.735 -0.546 . . . . 0.0 111.735 -176.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.493 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.9 OUTLIER -106.34 17.95 22.68 Favored 'General case' 0 C--O 1.212 -0.87 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.336 179.114 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.5 t 65.91 29.88 10.12 Favored 'General case' 0 C--O 1.208 -1.111 0 CA-C-O 121.575 0.702 . . . . 0.0 110.55 179.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.407 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.7 mm? -107.71 18.79 20.97 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 123.552 0.741 . . . . 0.0 109.989 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -48.91 -32.09 8.39 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.921 0.889 . . . . 0.0 111.444 174.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -59.51 -20.67 57.13 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 124.686 1.195 . . . . 0.0 112.014 178.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -90.45 -19.9 23.35 Favored 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 179.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.414 HG13 ' HG ' ' A' ' 13' ' ' SER . 92.6 t -53.13 -38.01 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 C-N-CA 122.798 0.439 . . . . 0.0 110.722 179.061 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.1 m -50.63 -29.38 10.86 Favored 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 125.706 1.602 . . . . 0.0 112.881 -179.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 18.3 tp10 -117.49 -30.47 5.52 Favored 'General case' 0 N--CA 1.432 -1.359 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.289 178.347 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.44 ' CG ' HD12 ' A' ' 16' ' ' LEU . 1.6 m-85 -54.61 -42.83 71.63 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-O 121.508 0.671 . . . . 0.0 110.938 177.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 45.8 m -84.36 -9.44 58.44 Favored 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.87 -178.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -83.07 -41.24 18.86 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.674 0.75 . . . . 0.0 110.059 179.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.407 ' HG3' HG12 ' A' ' 33' ' ' ILE . 3.7 pt20 -93.21 17.0 11.78 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 59.84 36.57 21.99 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.668 174.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.407 HG12 ' HG3' ' A' ' 31' ' ' GLN . 49.6 mm -70.35 118.19 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.087 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 -179.789 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 91.5 p -107.04 -167.74 1.31 Allowed 'General case' 0 N--CA 1.423 -1.797 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 176.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.482 ' O ' ' HG ' ' A' ' 39' ' ' LEU . . . -63.07 -28.43 72.1 Favored Glycine 0 N--CA 1.43 -1.737 0 N-CA-C 110.647 -0.981 . . . . 0.0 110.647 177.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -54.64 -46.34 73.93 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.538 0.735 . . . . 0.0 110.112 178.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.84 -19.98 23.99 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 120.27 -0.572 . . . . 0.0 112.271 -177.727 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.8 tt -63.94 -48.37 76.79 Favored 'General case' 0 C--N 1.316 -0.882 0 O-C-N 124.536 1.147 . . . . 0.0 108.53 177.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 35' ' ' GLY . 21.7 mt -63.68 -37.29 86.78 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.827 -178.791 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -100.9 20.88 14.59 Favored 'General case' 0 C--N 1.309 -1.161 0 N-CA-C 114.141 1.163 . . . . 0.0 114.141 -177.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.1 mt -54.79 153.53 5.98 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 176.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.49 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 14.3 t70 -159.8 161.93 34.68 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 -176.641 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.91 -34.32 61.42 Favored Glycine 0 CA--C 1.49 -1.504 0 O-C-N 123.569 0.543 . . . . 0.0 112.032 178.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -56.72 -43.94 81.13 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-O 121.031 0.443 . . . . 0.0 110.456 176.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.2 mtpp -68.79 -48.46 63.58 Favored 'General case' 0 C--O 1.193 -1.893 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.82 176.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 80.3 mt -54.99 -35.15 64.05 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-O 121.59 0.71 . . . . 0.0 111.451 -178.129 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.46 ' HA ' HG22 ' A' ' 52' ' ' THR . 22.6 mttm -75.57 -35.72 60.55 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.167 176.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.32 -12.72 60.93 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.144 0.578 . . . . 0.0 111.35 -179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.576 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.4 mm? -74.88 -8.71 57.28 Favored 'General case' 0 C--O 1.22 -0.5 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 172.003 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 71.35 1.29 42.35 Favored Glycine 0 C--O 1.225 -0.418 0 CA-C-N 115.935 -0.575 . . . . 0.0 112.543 178.05 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.577 ' HG3' ' OG ' ' A' ' 53' ' ' SER . 12.0 tpt -87.67 -49.36 7.2 Favored 'General case' 0 N--CA 1.433 -1.314 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -177.353 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.46 HG22 ' HA ' ' A' ' 47' ' ' LYS . 70.7 p 57.93 10.23 1.1 Allowed 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.783 1.633 . . . . 0.0 114.393 172.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.577 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 16.2 m -57.29 118.41 5.07 Favored 'General case' 0 C--N 1.31 -1.135 0 C-N-CA 124.807 1.243 . . . . 0.0 112.22 -175.107 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 p -63.69 -39.93 95.53 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 -172.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.453 HE21 ' CG ' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -71.25 -32.17 68.41 Favored 'General case' 0 CA--C 1.49 -1.336 0 CA-C-O 122.338 1.066 . . . . 0.0 108.904 -179.11 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.649 ' O ' HG12 ' A' ' 60' ' ' VAL . 17.7 m-20 -74.65 -40.85 61.22 Favored 'General case' 0 N--CA 1.413 -2.282 0 CA-C-N 113.137 -1.847 . . . . 0.0 109.369 -178.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.58 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 24.7 mmm-85 -51.43 -36.35 43.42 Favored 'General case' 0 C--O 1.2 -1.519 0 C-N-CA 124.3 1.04 . . . . 0.0 111.132 175.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.44 -35.67 27.33 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.035 0.445 . . . . 0.0 111.894 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.442 HD11 ' HZ3' ' A' ' 63' ' ' LYS . 30.7 tp -80.23 -43.79 20.83 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 120.306 -0.558 . . . . 0.0 112.216 -174.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.649 HG12 ' O ' ' A' ' 56' ' ' ASP . 9.7 p -65.26 -26.1 38.82 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.737 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.178 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.58 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 55.0 tptt -70.36 -31.98 69.47 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 122.734 1.254 . . . . 0.0 108.896 -175.502 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -80.62 -44.75 18.38 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-N 113.118 -1.856 . . . . 0.0 109.026 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.442 ' HZ3' HD11 ' A' ' 59' ' ' LEU . 0.3 OUTLIER -72.31 -35.68 68.71 Favored 'General case' 0 N--CA 1.423 -1.824 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.191 -176.776 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.7 pp -70.0 -13.74 62.37 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 -176.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -98.84 -5.12 31.65 Favored 'General case' 0 C--N 1.309 -1.167 0 C-N-CA 119.026 -1.069 . . . . 0.0 112.275 175.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -125.78 4.47 7.4 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 122.159 0.98 . . . . 0.0 109.381 -179.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.492 ' SD ' ' N ' ' A' ' 67' ' ' MET . 0.0 OUTLIER -54.24 -24.74 19.78 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 127.585 2.354 . . . . 0.0 112.173 -176.532 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -69.88 -20.46 63.38 Favored 'General case' 0 C--N 1.298 -1.631 0 CA-C-N 115.087 -0.961 . . . . 0.0 111.854 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 25.9 ptt? -110.11 -14.59 14.18 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 173.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 9.0 m -76.95 -36.07 56.81 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.937 178.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.534 HD13 ' N ' ' A' ' 72' ' ' GLU . 4.3 pp -53.16 -29.17 29.91 Favored 'General case' 0 CA--C 1.495 -1.149 0 C-N-CA 124.01 0.924 . . . . 0.0 112.825 179.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.534 ' N ' HD13 ' A' ' 71' ' ' LEU . 10.2 tt0 -70.69 -31.17 67.97 Favored 'General case' 0 N--CA 1.402 -2.863 0 CA-C-N 114.073 -1.421 . . . . 0.0 111.99 -174.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 57.3 mttp -99.53 -87.97 0.35 Allowed 'General case' 0 N--CA 1.405 -2.713 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.654 -169.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.012 0 N-CA-C 107.807 -1.182 . . . . 0.0 107.807 -178.971 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.759 0 N-CA-C 111.611 -0.595 . . . . 0.0 111.611 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 25.3 p80 -113.56 5.29 16.53 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 121.112 0.482 . . . . 0.0 110.259 -178.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -72.6 174.78 7.05 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.367 -176.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.541 HG11 ' CH2' ' A' ' 7' ' ' TRP . 3.9 m -68.48 -29.81 45.32 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.158 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 -169.344 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.5 p-80 -72.41 -6.39 43.17 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 121.467 0.651 . . . . 0.0 110.941 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -103.08 -7.01 21.69 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.822 178.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.541 ' CH2' HG11 ' A' ' 4' ' ' VAL . 54.2 m0 -79.69 156.59 27.49 Favored 'General case' 0 CA--C 1.473 -1.996 0 CA-C-O 121.821 0.82 . . . . 0.0 111.607 -178.141 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 7.8 m -111.91 -131.22 0.32 Allowed 'General case' 1 N--CA 1.37 -4.446 0 CA-C-N 113.578 -1.647 . . . . 0.0 106.866 177.037 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.557 ' O ' HG12 ' A' ' 12' ' ' VAL . 59.8 t -95.41 -52.4 9.52 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.991 0 C-N-CA 123.524 0.729 . . . . 0.0 110.628 -170.231 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.7 pm0 -71.18 -19.77 62.37 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 122.36 1.076 . . . . 0.0 109.83 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.506 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 29.3 mt-30 -86.03 -19.4 30.36 Favored 'General case' 0 N--CA 1.413 -2.297 0 CA-C-N 114.158 -1.383 . . . . 0.0 111.787 -176.771 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.557 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.3 p -78.54 -20.98 13.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.778 0.799 . . . . 0.0 109.007 -179.373 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.469 ' HA ' HD11 ' A' ' 16' ' ' LEU . 1.8 m -74.94 -23.85 58.39 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.814 -176.125 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . 0.506 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 87.2 m-70 -61.34 -36.16 79.41 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-O 120.998 0.428 . . . . 0.0 110.44 -179.03 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.436 ' O ' HD22 ' A' ' 19' ' ' LEU . 31.3 t90 -68.09 -59.3 3.35 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.698 176.226 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.497 HD12 ' CD2' ' A' ' 28' ' ' PHE . 44.9 mt -46.49 -50.61 16.77 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.283 1.033 . . . . 0.0 112.326 -177.505 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 13' ' ' SER . 94.0 t -60.55 -26.09 36.6 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.174 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.308 -178.054 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -70.91 -34.35 65.55 Favored Glycine 0 N--CA 1.449 -0.492 0 CA-C-N 116.413 -0.358 . . . . 0.0 112.332 -178.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.453 ' HG ' ' HB2' ' A' ' 21' ' ' LEU . 0.5 OUTLIER -100.52 15.71 27.09 Favored 'General case' 0 C--N 1.317 -0.841 0 O-C-N 122.731 -0.276 . . . . 0.0 111.357 -179.565 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 43.4 m 70.21 18.34 6.94 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.413 1.085 . . . . 0.0 111.415 -179.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.453 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.6 mm? -94.25 18.81 10.31 Favored 'General case' 0 C--N 1.301 -1.537 0 C-N-CA 124.17 0.988 . . . . 0.0 109.422 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -51.64 -26.63 9.38 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.341 1.056 . . . . 0.0 111.212 172.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -62.51 -26.97 68.82 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 124.098 0.959 . . . . 0.0 111.344 177.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -85.1 -19.85 31.25 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.627 -178.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 91.0 t -54.53 -33.35 26.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 122.842 0.457 . . . . 0.0 110.91 178.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 4.4 m -48.61 -39.62 24.58 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.201 1.4 . . . . 0.0 112.266 178.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.615 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 15.5 tp10 -108.59 -30.09 8.41 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.33 -177.328 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.497 ' CD2' HD12 ' A' ' 16' ' ' LEU . 2.7 m-85 -54.09 -36.89 63.67 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.356 0.598 . . . . 0.0 110.795 176.019 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.2 p -73.04 -32.28 64.98 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.359 178.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.08 -31.16 61.15 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.864 -174.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -96.82 0.93 50.09 Favored 'General case' 0 CA--C 1.509 -0.604 0 C-N-CA 119.931 -0.708 . . . . 0.0 110.246 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 62.66 40.1 10.61 Favored 'General case' 0 CA--C 1.509 -0.617 0 O-C-N 123.939 0.774 . . . . 0.0 109.988 179.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 43.7 mm -65.61 128.17 27.99 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.131 0 CA-C-N 115.12 -0.945 . . . . 0.0 108.57 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.9 p -120.14 -168.85 1.69 Allowed 'General case' 0 N--CA 1.428 -1.528 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 174.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.53 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.09 -29.62 73.28 Favored Glycine 0 CA--C 1.502 -0.781 0 N-CA-C 111.881 -0.487 . . . . 0.0 111.881 -177.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -54.47 -47.74 72.6 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 123.252 0.621 . . . . 0.0 109.657 176.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.03 -19.89 27.99 Favored 'General case' 0 C--N 1.312 -1.062 0 C-N-CA 119.535 -0.866 . . . . 0.0 111.52 -177.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.7 tt -67.66 -51.16 53.14 Favored 'General case' 0 CA--C 1.548 0.884 0 O-C-N 124.192 0.932 . . . . 0.0 109.745 -178.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 50.8 mt -62.46 -34.57 77.08 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.473 0.654 . . . . 0.0 111.592 -177.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -101.9 24.92 9.27 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.589 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.451 ' HA ' ' HD3' ' A' ' 45' ' ' LYS . 32.6 mt -63.35 153.1 36.1 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.063 173.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -157.06 172.81 18.01 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 -177.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.433 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -58.8 -40.68 95.38 Favored Glycine 0 C--O 1.204 -1.73 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -51.35 -46.95 62.86 Favored 'General case' 0 CA--C 1.507 -0.705 0 C-N-CA 123.58 0.752 . . . . 0.0 111.539 176.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.47 ' O ' HD23 ' A' ' 49' ' ' LEU . 15.0 mtpp -67.02 -44.05 81.29 Favored 'General case' 0 C--O 1.193 -1.894 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.8 176.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 98.1 mt -59.55 -27.19 65.99 Favored 'General case' 0 C--O 1.256 1.423 0 CA-C-O 121.704 0.764 . . . . 0.0 111.646 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.436 ' HA ' HG23 ' A' ' 52' ' ' THR . 56.3 mtpt -83.98 -34.37 24.4 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.157 178.079 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.67 -12.67 60.24 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 121.79 0.805 . . . . 0.0 110.263 176.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.615 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 3.7 mm? -82.14 2.17 32.72 Favored 'General case' 0 C--O 1.211 -0.949 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.009 173.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 63.06 6.04 11.77 Favored Glycine 0 C--N 1.333 0.397 0 CA-C-N 115.7 -0.682 . . . . 0.0 114.446 175.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 6.5 tpt -88.15 -48.73 7.5 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 -177.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.436 HG23 ' HA ' ' A' ' 47' ' ' LYS . 81.7 p 53.99 21.26 2.8 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 125.471 1.509 . . . . 0.0 114.618 174.449 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.9 t -66.41 117.65 8.94 Favored 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 123.536 0.734 . . . . 0.0 110.032 -179.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.2 m -67.51 -26.78 66.51 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-O 121.005 0.431 . . . . 0.0 110.449 -177.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -58.14 -53.64 55.96 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 122.11 0.957 . . . . 0.0 108.522 173.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.592 ' O ' HG11 ' A' ' 60' ' ' VAL . 67.5 m-20 -71.23 -37.17 72.03 Favored 'General case' 0 N--CA 1.427 -1.596 0 CA-C-N 114.15 -1.386 . . . . 0.0 110.78 -176.476 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -52.76 -27.15 16.58 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.674 0.79 . . . . 0.0 112.768 177.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.34 -37.79 13.79 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.973 176.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -81.21 -64.4 1.2 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.434 -172.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.592 HG11 ' O ' ' A' ' 56' ' ' ASP . 3.4 p -58.9 -23.01 22.77 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.839 0 CA-C-O 121.431 0.634 . . . . 0.0 111.249 -175.268 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -68.05 -33.25 74.22 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.809 -178.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt -84.22 -30.87 25.38 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-N 114.882 -1.054 . . . . 0.0 109.727 -178.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.404 ' CB ' HD13 ' A' ' 19' ' ' LEU . 1.4 tppt? -77.43 -41.46 39.73 Favored 'General case' 0 C--N 1.298 -1.647 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.041 -177.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 pp -61.89 -32.67 73.06 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.02 0.438 . . . . 0.0 112.049 -175.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -76.77 -28.14 55.58 Favored 'General case' 0 C--N 1.31 -1.113 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.098 -178.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -102.6 0.5 33.44 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.34 0.59 . . . . 0.0 110.195 -178.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 2.3 ppp? -69.31 -23.2 63.77 Favored 'General case' 0 C--O 1.197 -1.677 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.915 -175.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.439 ' HA ' HD21 ' A' ' 71' ' ' LEU . 54.7 pttt -71.97 -14.37 61.88 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-O 121.507 0.67 . . . . 0.0 111.805 178.08 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.2 mtp -99.9 -28.9 12.88 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 174.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 16.9 m -91.93 -24.73 19.19 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.167 -0.924 . . . . 0.0 113.465 -170.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.485 HD12 ' N ' ' A' ' 72' ' ' GLU . 4.5 pp -50.24 -30.36 11.5 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 124.628 1.171 . . . . 0.0 113.309 -177.572 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.485 ' N ' HD12 ' A' ' 71' ' ' LEU . 10.6 tt0 -68.2 -44.89 74.82 Favored 'General case' 0 N--CA 1.417 -2.081 0 CA-C-N 114.382 -1.281 . . . . 0.0 111.285 -178.453 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -78.29 -53.39 7.37 Favored 'General case' 0 C--N 1.298 -1.674 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.426 -170.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.421 -1.898 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 -176.018 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.805 0 N-CA-C 111.305 -0.718 . . . . 0.0 111.305 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 68.5 t60 67.39 -71.01 0.11 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.704 1.202 . . . . 0.0 113.639 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 56.5 mtt -77.03 152.09 35.27 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.586 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.1 m -73.82 -27.61 22.99 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.134 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -165.439 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.0 p-80 -68.65 -12.05 60.88 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-O 121.272 0.558 . . . . 0.0 111.154 176.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -97.88 -0.3 45.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.127 178.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.505 ' O ' ' HB2' ' A' ' 34' ' ' SER . 52.2 m0 -82.31 143.77 31.06 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.983 -179.114 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.5 m -99.63 -73.74 0.62 Allowed 'General case' 0 N--CA 1.428 -1.538 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.355 -175.012 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.414 ' O ' HG13 ' A' ' 12' ' ' VAL . 98.4 t -143.44 -65.48 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.198 -1.615 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.483 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 -59.74 -27.24 66.33 Favored 'General case' 0 C--N 1.312 -1.024 0 C-N-CA 124.076 0.951 . . . . 0.0 112.465 -177.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.558 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 43.3 mt-30 -72.6 -18.88 61.56 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.881 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.414 HG13 ' O ' ' A' ' 9' ' ' VAL . 0.8 OUTLIER -78.83 -28.14 13.93 Favored 'Isoleucine or valine' 0 C--O 1.243 0.731 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -178.179 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.507 ' O ' HG21 ' A' ' 17' ' ' VAL . 1.2 m -67.88 -34.5 76.77 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.359 -176.599 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . 0.558 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 30.6 m-70 -59.13 -36.41 75.15 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.737 0.648 . . . . 0.0 109.631 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.447 ' O ' HD23 ' A' ' 19' ' ' LEU . 25.0 t90 -67.18 -59.04 3.78 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.74 176.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.443 HD11 ' CG ' ' A' ' 28' ' ' PHE . 31.4 mt -47.3 -48.82 24.88 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 124.441 1.088 . . . . 0.0 112.218 -177.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.507 HG21 ' O ' ' A' ' 13' ' ' SER . 64.9 t -61.2 -25.82 37.44 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.014 0 CA-C-O 120.882 0.373 . . . . 0.0 111.198 -178.062 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.76 -28.63 64.7 Favored Glycine 0 CA--C 1.505 -0.567 0 N-CA-C 111.754 -0.539 . . . . 0.0 111.754 -176.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.447 HD23 ' O ' ' A' ' 15' ' ' TRP . 1.2 pt? -105.78 16.02 25.87 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.223 178.603 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.8 m 66.59 21.69 10.65 Favored 'General case' 0 C--O 1.206 -1.197 0 C-N-CA 123.825 0.85 . . . . 0.0 112.318 -179.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.411 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 2.1 mm? -95.98 19.98 10.74 Favored 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 123.795 0.838 . . . . 0.0 109.129 178.384 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -55.22 -20.66 11.42 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.091 0.956 . . . . 0.0 111.399 175.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -69.14 -22.17 63.96 Favored 'General case' 0 C--N 1.305 -1.353 0 C-N-CA 124.065 0.946 . . . . 0.0 111.033 177.525 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.507 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 2.6 m-85 -87.5 -20.65 26.23 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.384 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 93.6 t -52.14 -38.18 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 36.7 t -54.01 -41.19 67.71 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 123.455 0.472 . . . . 0.0 111.168 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 13.1 tp10 -96.56 -31.31 12.83 Favored 'General case' 0 N--CA 1.44 -0.961 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.264 -177.279 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.443 ' CG ' HD11 ' A' ' 16' ' ' LEU . 2.7 m-85 -55.91 -39.86 72.23 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.197 0.522 . . . . 0.0 110.438 175.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.4 m -71.83 -30.78 65.84 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.336 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.11 -35.75 71.91 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.681 -175.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -98.27 2.72 48.49 Favored 'General case' 0 C--N 1.313 -1.012 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.91 -178.799 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 62.66 37.56 12.74 Favored 'General case' 0 CA--C 1.504 -0.792 0 C-N-CA 123.383 0.673 . . . . 0.0 109.553 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.7 mm -67.45 110.69 1.85 Allowed 'Isoleucine or valine' 0 N--CA 1.434 -1.246 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.505 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 84.7 p -99.3 -169.79 1.81 Allowed 'General case' 0 N--CA 1.421 -1.886 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.584 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.586 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -66.69 -23.19 72.23 Favored Glycine 0 N--CA 1.436 -1.346 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 179.216 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.53 -46.34 89.16 Favored 'General case' 0 N--CA 1.442 -0.828 0 C-N-CA 124.09 0.956 . . . . 0.0 109.546 178.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.76 -19.97 25.36 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.6 -179.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.8 tt -62.78 -50.39 71.23 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 124.492 1.117 . . . . 0.0 108.927 178.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.0 mt -58.71 -41.53 86.58 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.13 -177.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -97.07 16.17 20.39 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.443 -175.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.404 ' HB2' HD23 ' A' ' 64' ' ' LEU . 34.1 mt -57.42 154.59 10.59 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.69 0.757 . . . . 0.0 112.556 176.738 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -159.9 168.17 26.38 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -50.78 -40.09 40.69 Favored Glycine 0 C--O 1.204 -1.75 0 O-C-N 123.95 0.781 . . . . 0.0 111.739 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -51.99 -49.02 64.11 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 178.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.433 ' O ' HD23 ' A' ' 49' ' ' LEU . 12.8 mtpp -67.99 -46.86 70.12 Favored 'General case' 0 C--O 1.196 -1.724 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.259 177.577 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 74.1 mt -59.27 -26.49 64.98 Favored 'General case' 0 C--O 1.255 1.381 0 C-N-CA 123.554 0.742 . . . . 0.0 112.271 -177.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.464 ' HA ' HG22 ' A' ' 52' ' ' THR . 57.0 mtpt -79.5 -37.23 37.21 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.735 175.596 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.98 -9.88 59.2 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.532 0.682 . . . . 0.0 110.682 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.523 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.2 mm? -82.24 0.6 40.53 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.423 -0.808 . . . . 0.0 108.987 173.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 67.78 4.12 31.71 Favored Glycine 0 C--O 1.224 -0.484 0 N-CA-C 114.607 0.603 . . . . 0.0 114.607 174.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.507 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 14.5 tpt -94.76 -48.86 5.86 Favored 'General case' 0 C--N 1.311 -1.108 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.343 -178.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.464 HG22 ' HA ' ' A' ' 47' ' ' LYS . 62.3 p 59.38 2.9 0.34 Allowed 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 126.489 1.916 . . . . 0.0 115.471 174.296 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.494 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 20.3 m -55.35 123.52 14.11 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 125.191 1.397 . . . . 0.0 113.705 -174.073 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.8 t -61.76 -48.02 82.57 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 -173.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.0 pp0? -64.81 -38.35 90.69 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 122.135 0.969 . . . . 0.0 108.576 -176.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.644 ' O ' HG13 ' A' ' 60' ' ' VAL . 7.5 m-20 -70.24 -47.24 62.21 Favored 'General case' 0 N--CA 1.42 -1.934 0 CA-C-N 113.458 -1.701 . . . . 0.0 109.553 -174.086 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.478 ' HA ' ' CG1' ' A' ' 60' ' ' VAL . 44.2 mtm180 -68.28 -11.98 60.31 Favored 'General case' 0 C--O 1.213 -0.829 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 179.26 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.69 -30.04 19.42 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 174.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 36.9 tp -86.38 -44.99 11.61 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.478 -176.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.644 HG13 ' O ' ' A' ' 56' ' ' ASP . 5.0 p -61.62 -26.59 40.07 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.134 0 CA-C-O 121.405 0.622 . . . . 0.0 109.538 177.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 54.1 tptt -74.4 -27.0 60.44 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.135 -174.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -82.22 -45.87 14.48 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 113.827 -1.533 . . . . 0.0 108.478 177.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.406 ' HE3' ' CB ' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -67.01 -42.16 85.43 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.513 -175.613 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.448 ' HA ' ' HG2' ' A' ' 67' ' ' MET . 3.7 pp -62.9 -30.6 71.66 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -177.234 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.3 ptmm? -87.13 -11.12 51.01 Favored 'General case' 0 C--N 1.309 -1.165 0 C-N-CA 118.927 -1.109 . . . . 0.0 111.68 -177.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -112.97 7.53 18.21 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 120.939 -0.304 . . . . 0.0 110.313 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.448 ' HG2' ' HA ' ' A' ' 64' ' ' LEU . 92.5 mmm -46.14 -33.35 3.5 Favored 'General case' 0 C--O 1.191 -1.997 0 C-N-CA 123.899 0.88 . . . . 0.0 112.168 -179.179 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 6.7 ptpp? -50.15 -41.0 48.21 Favored 'General case' 0 C--N 1.297 -1.714 0 C-N-CA 124.386 1.074 . . . . 0.0 112.526 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 20.2 ptt? -106.55 -24.11 12.27 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-O 121.435 0.636 . . . . 0.0 109.97 177.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 42.1 m -81.91 -21.58 37.27 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -175.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.4 pp -64.16 -32.62 74.27 Favored 'General case' 0 CA--C 1.499 -1.0 0 CA-C-O 122.126 0.965 . . . . 0.0 109.057 173.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -72.97 -41.02 64.83 Favored 'General case' 0 N--CA 1.411 -2.377 0 CA-C-N 113.912 -1.495 . . . . 0.0 111.736 -177.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 83.1 mttt -89.83 26.76 1.71 Allowed 'General case' 0 C--N 1.311 -1.067 0 CA-C-O 121.927 0.87 . . . . 0.0 111.152 -172.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.282 -2.369 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 177.238 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.492 -1.383 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -126.0 -29.53 3.06 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 64.0 mtt -90.07 149.48 22.49 Favored 'General case' 0 N--CA 1.419 -2.023 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 176.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.561 ' CG1' ' HB3' ' A' ' 71' ' ' LEU . 3.9 m -67.77 -28.58 42.09 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.112 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -168.095 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.2 p-80 -74.19 -9.77 58.95 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-O 121.179 0.514 . . . . 0.0 111.494 -178.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -90.42 -9.82 46.12 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 178.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.532 ' CD2' ' HA ' ' A' ' 4' ' ' VAL . 48.3 m0 -84.0 135.37 34.47 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.237 -177.047 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.421 ' O ' ' HB3' ' A' ' 34' ' ' SER . 16.1 m -93.3 -69.63 0.74 Allowed 'General case' 0 C--N 1.298 -1.631 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.638 -178.339 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.533 ' O ' HG12 ' A' ' 12' ' ' VAL . 61.4 t -143.81 -62.33 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 -179.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.35 -37.47 48.05 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 124.667 1.187 . . . . 0.0 111.952 179.217 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -78.57 -20.07 51.41 Favored 'General case' 0 N--CA 1.435 -1.177 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -174.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.533 HG12 ' O ' ' A' ' 9' ' ' VAL . 2.6 p -70.88 -22.36 23.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 CA-C-O 121.707 0.765 . . . . 0.0 109.218 -178.526 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.479 ' O ' HG21 ' A' ' 17' ' ' VAL . 1.4 m -73.76 -26.49 60.69 Favored 'General case' 0 N--CA 1.423 -1.807 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.363 -176.159 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 53.7 m-70 -60.48 -42.33 96.05 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 123.414 0.446 . . . . 0.0 110.142 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.488 ' O ' HD22 ' A' ' 19' ' ' LEU . 36.0 t90 -63.13 -59.21 5.07 Favored 'General case' 0 N--CA 1.442 -0.831 0 O-C-N 123.825 0.703 . . . . 0.0 109.749 177.329 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.416 HD11 ' CD2' ' A' ' 28' ' ' PHE . 43.9 mt -47.53 -51.21 21.46 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 124.43 1.081 . . . . 0.0 112.266 -178.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.479 HG21 ' O ' ' A' ' 13' ' ' SER . 78.1 t -61.92 -26.86 41.09 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 CA-C-O 120.822 0.344 . . . . 0.0 111.219 -177.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -71.13 -29.2 69.04 Favored Glycine 0 C--O 1.223 -0.544 0 N-CA-C 111.945 -0.462 . . . . 0.0 111.945 -177.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.488 HD22 ' O ' ' A' ' 15' ' ' TRP . 0.5 OUTLIER -104.96 16.16 26.43 Favored 'General case' 0 C--N 1.314 -0.94 0 O-C-N 122.334 -0.51 . . . . 0.0 111.04 177.649 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 62.5 m 62.65 34.3 15.02 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 122.326 1.06 . . . . 0.0 111.497 -178.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.548 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -104.02 17.14 24.72 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 125.105 1.362 . . . . 0.0 108.552 176.792 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -54.96 -25.41 29.47 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.561 178.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.548 ' NE2' ' HA ' ' A' ' 21' ' ' LEU . 0.6 OUTLIER -69.36 -20.31 63.84 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 119.996 -0.682 . . . . 0.0 111.853 177.126 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.408 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 3.8 m-85 -82.08 -19.49 40.11 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.153 -179.694 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 97.7 t -56.05 -36.32 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 O-C-N 123.212 0.32 . . . . 0.0 110.506 177.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 39.0 t -50.37 -38.75 44.05 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.246 1.018 . . . . 0.0 111.573 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.646 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 19.0 tp10 -105.12 -32.71 8.56 Favored 'General case' 0 C--N 1.312 -1.058 0 O-C-N 121.962 -0.461 . . . . 0.0 110.917 -178.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.416 ' CD2' HD11 ' A' ' 16' ' ' LEU . 2.1 m-85 -55.17 -40.6 70.86 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-O 121.72 0.771 . . . . 0.0 110.3 176.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 33.8 t -79.03 -21.81 46.37 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.52 -178.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.47 -38.41 62.93 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.0 0.429 . . . . 0.0 110.654 -177.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -101.35 16.35 25.85 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 59.03 39.56 23.26 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 121.194 0.521 . . . . 0.0 111.362 174.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.455 HG21 ' HB2' ' A' ' 37' ' ' GLN . 49.9 mm -71.44 111.43 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.385 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.473 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.421 ' HB3' ' O ' ' A' ' 8' ' ' SER . 65.9 p -105.81 -169.85 1.65 Allowed 'General case' 0 N--CA 1.418 -2.051 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.493 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.14 -25.8 66.82 Favored Glycine 0 N--CA 1.436 -1.303 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.695 176.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -59.78 -36.74 77.3 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 123.379 0.672 . . . . 0.0 109.621 179.083 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.455 ' HB2' HG21 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -89.96 -40.08 12.58 Favored 'General case' 0 C--O 1.215 -0.747 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.326 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.429 HD12 HG21 ' A' ' 12' ' ' VAL . 3.4 tt -49.7 -48.69 49.63 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.971 1.708 . . . . 0.0 111.268 -174.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 29.5 mt -61.96 -40.73 96.57 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.018 -177.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -97.14 11.37 36.52 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -176.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 46.8 mt -53.86 150.29 7.77 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 121.446 0.641 . . . . 0.0 112.618 178.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.422 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 25.8 t70 -153.82 179.51 8.8 Favored 'General case' 0 C--N 1.295 -1.793 0 N-CA-C 105.707 -1.96 . . . . 0.0 105.707 178.187 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -60.92 -35.98 91.37 Favored Glycine 0 CA--C 1.488 -1.655 0 N-CA-C 110.971 -0.852 . . . . 0.0 110.971 -179.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -52.93 -47.66 67.86 Favored 'General case' 0 CA--C 1.498 -1.036 0 C-N-CA 123.322 0.649 . . . . 0.0 111.453 177.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.4 mtpp -68.82 -44.04 74.32 Favored 'General case' 0 C--O 1.192 -1.962 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.063 177.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 90.0 mt -58.58 -31.0 67.61 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-O 121.702 0.763 . . . . 0.0 111.392 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.479 ' HA ' HG21 ' A' ' 52' ' ' THR . 74.1 mttt -77.71 -26.55 50.18 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.897 177.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.21 -5.48 58.53 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-O 121.691 0.758 . . . . 0.0 110.215 178.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.646 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.5 mm? -83.97 -5.49 59.23 Favored 'General case' 0 C--O 1.203 -1.371 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 172.768 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.21 -7.29 8.27 Favored Glycine 0 C--O 1.222 -0.626 0 CA-C-N 116.114 -0.494 . . . . 0.0 113.534 176.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.408 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 14.1 tpt -81.08 -50.42 9.66 Favored 'General case' 0 N--CA 1.432 -1.364 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 -177.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.479 HG21 ' HA ' ' A' ' 47' ' ' LYS . 80.5 p 57.3 14.37 2.1 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.422 1.489 . . . . 0.0 114.507 173.531 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 70.9 m -63.26 129.2 39.27 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 123.801 0.84 . . . . 0.0 112.238 -174.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.8 t -61.15 -47.28 86.94 Favored 'General case' 0 C--O 1.241 0.631 0 C-N-CA 124.59 1.156 . . . . 0.0 112.81 -172.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -54.22 -55.48 27.61 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 122.234 1.016 . . . . 0.0 108.983 177.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.751 ' O ' HG12 ' A' ' 60' ' ' VAL . 4.5 m-20 -60.16 -45.89 91.54 Favored 'General case' 0 N--CA 1.417 -2.121 0 CA-C-N 113.161 -1.836 . . . . 0.0 109.425 -175.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -48.52 -34.13 10.76 Favored 'General case' 0 CA--C 1.507 -0.71 0 C-N-CA 124.411 1.084 . . . . 0.0 112.958 178.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -94.47 -40.34 9.94 Favored 'General case' 0 C--N 1.306 -1.314 0 O-C-N 123.714 0.634 . . . . 0.0 110.873 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.415 HD13 ' HZ3' ' A' ' 63' ' ' LYS . 53.7 tp -68.81 -51.99 34.93 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -175.126 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.751 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.5 p -67.2 -21.84 28.48 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.249 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.9 tmtt? -70.8 -30.34 66.78 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -178.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.647 ' O ' ' HG2' ' A' ' 65' ' ' LYS . 85.8 tttt -83.17 -42.13 17.67 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 114.447 -1.252 . . . . 0.0 109.134 179.368 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.471 ' CB ' HD11 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -69.54 -28.5 66.07 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.399 -179.396 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.71 ' O ' ' HG3' ' A' ' 67' ' ' MET . 1.9 pp -79.88 -16.71 54.83 Favored 'General case' 0 C--O 1.204 -1.311 0 CA-C-O 120.971 0.415 . . . . 0.0 111.198 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.647 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 14.5 ptmm? -82.65 -17.07 45.91 Favored 'General case' 0 C--N 1.295 -1.8 0 C-N-CA 118.026 -1.47 . . . . 0.0 109.201 175.665 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.422 ' HG3' ' HG ' ' A' ' 70' ' ' SER . 12.6 pt-20 -118.38 18.43 13.64 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.913 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.71 ' HG3' ' O ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -55.33 -21.7 16.12 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 -179.557 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -64.65 -28.07 69.36 Favored 'General case' 0 C--N 1.287 -2.132 0 CA-C-N 114.648 -1.16 . . . . 0.0 111.478 178.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.458 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 15.9 ptp -108.45 -18.65 13.69 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.084 -0.647 . . . . 0.0 109.557 174.694 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.485 ' HB2' ' HA ' ' A' ' 67' ' ' MET . 20.9 m -74.18 -29.2 61.64 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 116.614 -0.266 . . . . 0.0 110.824 178.383 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.561 ' HB3' ' CG1' ' A' ' 4' ' ' VAL . 4.4 pp -57.55 -33.03 67.7 Favored 'General case' 0 CA--C 1.487 -1.453 0 CA-C-O 122.299 1.047 . . . . 0.0 110.602 173.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.486 ' N ' HD13 ' A' ' 71' ' ' LEU . 9.1 tt0 -78.75 -33.74 46.33 Favored 'General case' 0 N--CA 1.383 -3.801 0 CA-C-N 113.497 -1.683 . . . . 0.0 111.262 -177.136 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 69' ' ' MET . 76.7 mttt -72.41 -52.58 15.35 Favored 'General case' 0 N--CA 1.432 -1.341 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 -178.071 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.958 0 O-C-N 124.817 1.323 . . . . 0.0 110.279 -176.984 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.79 0 N-CA-C 111.58 -0.608 . . . . 0.0 111.58 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -137.71 11.03 2.92 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 117.255 0.527 . . . . 0.0 111.444 -177.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 76.6 mtm -77.77 160.85 28.12 Favored 'General case' 0 N--CA 1.441 -0.911 0 C-N-CA 120.422 -0.511 . . . . 0.0 111.025 -178.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.532 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 17.2 m -65.58 -32.71 59.39 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.974 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -170.078 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 11.3 p-80 -73.36 -11.51 60.51 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-O 121.533 0.682 . . . . 0.0 110.749 -178.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -95.42 1.46 54.17 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.133 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.505 ' CH2' HG11 ' A' ' 4' ' ' VAL . 54.5 m0 -85.64 139.85 31.05 Favored 'General case' 0 CA--C 1.492 -1.259 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 176.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.2 m -94.18 -77.48 0.46 Allowed 'General case' 0 N--CA 1.419 -1.991 0 O-C-N 123.698 0.624 . . . . 0.0 110.701 -177.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.481 ' O ' HG11 ' A' ' 12' ' ' VAL . 55.2 t -141.43 -54.23 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-O 121.601 0.715 . . . . 0.0 109.661 -176.415 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.1 pm0 -77.31 -14.9 59.65 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.644 -178.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.411 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 38.9 mt-30 -83.57 -19.55 35.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.211 179.36 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.481 HG11 ' O ' ' A' ' 9' ' ' VAL . 1.9 p -72.63 -25.39 22.56 Favored 'Isoleucine or valine' 0 C--O 1.242 0.671 0 CA-C-O 121.851 0.834 . . . . 0.0 109.489 -177.627 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.416 ' HB3' ' CG1' ' A' ' 25' ' ' VAL . 0.7 OUTLIER -71.07 -29.21 65.02 Favored 'General case' 0 N--CA 1.427 -1.623 0 CA-C-N 115.012 -0.994 . . . . 0.0 111.397 -175.497 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . 0.411 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 71.5 m-70 -59.91 -36.9 77.96 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 121.417 0.627 . . . . 0.0 109.77 -178.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.523 ' O ' HD21 ' A' ' 19' ' ' LEU . 32.6 t90 -68.04 -59.65 3.09 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.123 177.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.451 HD11 ' CD2' ' A' ' 28' ' ' PHE . 44.1 mt -48.22 -51.01 27.27 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.103 0.961 . . . . 0.0 112.231 -177.688 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 90.7 t -60.35 -24.54 31.32 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.959 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.317 -178.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.88 -37.67 50.38 Favored Glycine 0 N--CA 1.441 -1.02 0 N-CA-C 111.413 -0.675 . . . . 0.0 111.413 -177.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.523 HD21 ' O ' ' A' ' 15' ' ' TRP . 0.9 OUTLIER -98.13 18.18 16.78 Favored 'General case' 0 C--N 1.32 -0.704 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.672 -179.844 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.8 m 67.89 23.52 8.34 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-O 122.151 0.977 . . . . 0.0 111.466 179.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.441 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.3 mm? -99.94 20.06 15.04 Favored 'General case' 0 C--N 1.299 -1.611 0 C-N-CA 124.321 1.048 . . . . 0.0 109.538 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -53.08 -27.0 18.13 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.422 1.089 . . . . 0.0 110.373 174.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -61.46 -21.8 64.49 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 125.414 1.486 . . . . 0.0 111.374 178.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.567 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 5.3 m-85 -93.35 -21.02 19.8 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 116.031 -0.532 . . . . 0.0 112.152 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.416 ' CG1' ' HB3' ' A' ' 13' ' ' SER . 98.4 t -53.14 -39.53 34.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 O-C-N 123.346 0.404 . . . . 0.0 111.843 -179.389 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.2 m -52.46 -38.29 58.98 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 123.76 0.663 . . . . 0.0 112.1 -177.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 15.3 tp10 -103.93 -30.04 10.57 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.565 -177.43 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.451 ' CD2' HD11 ' A' ' 16' ' ' LEU . 1.7 m-85 -56.99 -47.55 80.56 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-O 121.529 0.68 . . . . 0.0 110.541 177.062 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.1 m -81.3 -5.26 57.62 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.351 -178.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -87.85 -41.21 13.39 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.747 178.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -91.5 8.16 37.82 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 120.088 -0.645 . . . . 0.0 110.793 -177.637 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.486 ' N ' HD21 ' A' ' 32' ' ' ASN . 0.7 OUTLIER 64.89 38.06 6.73 Favored 'General case' 0 CA--C 1.507 -0.7 0 O-C-N 124.045 0.841 . . . . 0.0 109.168 179.166 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 49.0 mm -71.64 109.52 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.311 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 -179.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.409 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 97.1 p -103.94 -167.22 1.34 Allowed 'General case' 0 N--CA 1.432 -1.367 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.574 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.532 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -63.82 -24.62 68.43 Favored Glycine 0 N--CA 1.436 -1.353 0 N-CA-C 111.685 -0.566 . . . . 0.0 111.685 178.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -60.27 -43.43 96.22 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 177.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.6 -17.74 25.11 Favored 'General case' 0 N--CA 1.436 -1.132 0 C-N-CA 119.921 -0.711 . . . . 0.0 112.489 179.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.2 tt -66.34 -49.99 65.1 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 124.18 0.992 . . . . 0.0 109.48 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.9 mt -63.9 -34.6 78.33 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.223 0.535 . . . . 0.0 112.0 -177.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -100.47 15.1 29.01 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -177.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.404 HD22 ' HD3' ' A' ' 45' ' ' LYS . 40.8 mt -53.11 152.17 4.42 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-O 121.759 0.79 . . . . 0.0 112.976 177.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -155.35 167.48 30.23 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 105.666 -1.975 . . . . 0.0 105.666 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.538 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -54.17 -38.8 62.19 Favored Glycine 0 CA--C 1.493 -1.339 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 177.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -50.9 -49.19 59.95 Favored 'General case' 0 CA--C 1.503 -0.844 0 C-N-CA 123.244 0.618 . . . . 0.0 111.843 178.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.404 ' HD3' HD22 ' A' ' 41' ' ' LEU . 13.2 mtpp -64.67 -46.48 82.26 Favored 'General case' 0 C--O 1.196 -1.762 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.119 178.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 93.3 mt -57.22 -35.41 69.63 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-O 121.735 0.779 . . . . 0.0 111.272 -179.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.538 ' HG3' ' O ' ' A' ' 43' ' ' GLY . 55.5 mtpt -71.48 -35.12 70.71 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.315 178.14 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.6 -8.73 58.93 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.254 0.55 . . . . 0.0 110.864 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.41 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.0 mm? -85.26 -2.51 58.13 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.76 0.791 . . . . 0.0 108.963 174.144 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.84 0.84 57.19 Favored Glycine 0 N--CA 1.445 -0.76 0 CA-C-N 115.202 -0.908 . . . . 0.0 114.846 174.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.567 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 16.7 tpt -83.65 -56.11 3.9 Favored 'General case' 0 CA--C 1.492 -1.277 0 C-N-CA 119.359 -0.937 . . . . 0.0 109.84 -178.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.466 HG23 ' HA ' ' A' ' 47' ' ' LYS . 76.7 p 53.02 40.73 31.67 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.086 0.954 . . . . 0.0 111.991 175.246 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.61 ' HB3' ' OD1' ' A' ' 56' ' ' ASP . 32.6 t -75.88 -179.77 5.04 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 177.116 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.3 m -107.74 -23.23 12.18 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 174.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -69.52 -42.6 74.47 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.857 -178.722 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.648 ' O ' HG12 ' A' ' 60' ' ' VAL . 8.9 p-10 -75.14 -41.38 58.44 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.065 -175.042 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 54.5 mmm-85 -55.55 -19.8 11.19 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.958 0.903 . . . . 0.0 112.357 -176.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -101.19 -35.85 9.15 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.082 175.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.442 HD13 ' HZ1' ' A' ' 63' ' ' LYS . 30.6 tp -84.01 -53.97 5.18 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 -174.051 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.648 HG12 ' O ' ' A' ' 56' ' ' ASP . 8.1 p -64.28 -24.41 35.61 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.239 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -178.693 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -69.53 -30.11 67.86 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 114.423 -1.262 . . . . 0.0 108.906 -176.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.51 ' HB2' ' HZ1' ' A' ' 62' ' ' LYS . 3.8 ttmp? -86.49 -38.52 17.18 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-N 114.026 -1.443 . . . . 0.0 109.353 -178.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.442 ' HZ1' HD13 ' A' ' 59' ' ' LEU . 0.7 OUTLIER -71.47 -41.5 69.29 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 114.954 -1.021 . . . . 0.0 111.382 -177.508 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.48 ' HA ' ' HG2' ' A' ' 67' ' ' MET . 3.6 pp -63.49 -31.5 72.69 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.996 -175.551 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -78.84 -26.91 44.15 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 119.841 -0.743 . . . . 0.0 111.644 -177.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -95.3 -1.37 51.52 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.037 -177.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.48 ' HG2' ' HA ' ' A' ' 64' ' ' LEU . 93.1 mmm -45.97 -39.6 9.17 Favored 'General case' 0 C--O 1.192 -1.937 0 CA-C-O 122.118 0.961 . . . . 0.0 112.068 -177.595 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -72.44 -6.36 43.1 Favored 'General case' 0 C--N 1.261 -3.245 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -174.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 26.7 ptt? -133.38 5.64 3.77 Favored 'General case' 0 C--N 1.298 -1.668 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 174.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 51.2 m -131.67 -12.25 3.41 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -176.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.416 HD23 HG13 ' A' ' 4' ' ' VAL . 4.0 pp -60.04 -37.19 79.09 Favored 'General case' 0 CA--C 1.503 -0.842 0 CA-C-N 118.557 0.617 . . . . 0.0 111.371 -175.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -62.36 -40.8 97.61 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.421 177.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -87.02 -48.59 7.97 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.954 -173.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.996 0 C-N-CA 125.311 1.444 . . . . 0.0 110.693 -178.09 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.482 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 2.7 m . . . . . 0 CA--C 1.5 -0.959 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -70.58 -7.72 46.12 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.751 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -101.85 -7.83 22.16 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.203 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.426 ' CH2' HG12 ' A' ' 4' ' ' VAL . 53.5 m0 -71.28 144.59 49.94 Favored 'General case' 0 CA--C 1.501 -0.92 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.1 m -94.84 -71.73 0.65 Allowed 'General case' 0 N--CA 1.419 -1.98 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.615 -173.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 74.9 t -146.08 -68.13 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.203 -1.376 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.2 pm0 -63.76 -20.82 66.05 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.914 -0.585 . . . . 0.0 112.445 -175.018 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.5 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 91.9 mt-30 -77.71 -13.31 59.94 Favored 'General case' 0 C--O 1.217 -0.61 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.402 HG23 HD12 ' A' ' 38' ' ' LEU . 1.1 p -77.16 -19.58 14.36 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.379 0 CA-C-O 121.393 0.616 . . . . 0.0 109.48 178.275 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 83.3 p -70.81 -39.25 73.17 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.948 -175.212 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' HIS . . . . . 0.5 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 42.5 m-70 -50.37 -36.58 33.15 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 114.392 -1.276 . . . . 0.0 110.92 -179.54 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.489 ' CH2' HG23 ' A' ' 60' ' ' VAL . 24.7 t90 -71.15 -61.85 1.61 Allowed 'General case' 0 N--CA 1.423 -1.788 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.784 175.647 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.437 HD11 ' CD2' ' A' ' 28' ' ' PHE . 44.5 mt -46.68 -49.07 19.9 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.474 1.11 . . . . 0.0 112.419 -177.544 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 99.5 t -59.35 -29.53 42.19 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.321 0 C-N-CA 122.74 0.416 . . . . 0.0 111.176 -179.111 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -72.39 -27.37 69.87 Favored Glycine 0 N--CA 1.447 -0.621 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.179 -176.135 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.462 HD23 ' O ' ' A' ' 15' ' ' TRP . 1.2 pt? -106.94 15.51 25.3 Favored 'General case' 0 C--N 1.317 -0.847 0 O-C-N 122.586 -0.361 . . . . 0.0 111.064 179.126 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.3 t 74.46 16.42 3.28 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-O 122.178 0.989 . . . . 0.0 111.523 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -93.95 17.85 11.56 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 114.914 -1.039 . . . . 0.0 109.629 -177.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.429 ' HA ' HG23 ' A' ' 25' ' ' VAL . 13.3 t70 -50.94 -30.79 15.79 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-O 121.538 0.685 . . . . 0.0 111.196 174.472 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -59.54 -25.74 64.78 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 124.593 1.157 . . . . 0.0 110.834 178.245 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.411 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 14.3 m-85 -88.7 -21.96 23.63 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.774 -178.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.429 HG23 ' HA ' ' A' ' 22' ' ' ASP . 57.7 t -55.85 -35.09 38.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 122.665 0.386 . . . . 0.0 111.338 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.8 m -57.32 -30.05 64.44 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 123.815 0.846 . . . . 0.0 111.879 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.601 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 21.1 tp10 -109.55 -35.99 6.08 Favored 'General case' 0 N--CA 1.431 -1.377 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.416 -178.436 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.437 ' CD2' HD11 ' A' ' 16' ' ' LEU . 1.9 m-85 -53.67 -43.44 68.87 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-O 121.411 0.624 . . . . 0.0 110.795 177.705 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.7 m -77.07 -23.04 52.0 Favored 'General case' 0 N--CA 1.44 -0.972 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.718 -177.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.87 -39.48 69.62 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.624 -178.119 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.32 9.33 40.26 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.288 -178.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 61.63 42.2 11.31 Favored 'General case' 0 C--O 1.234 0.271 0 O-C-N 123.611 0.569 . . . . 0.0 110.453 177.72 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.9 mm -72.18 114.25 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.013 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.379 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 90.2 p -107.37 -167.85 1.32 Allowed 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 178.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.482 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.17 -27.74 69.56 Favored Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 111.311 -0.716 . . . . 0.0 111.311 178.181 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -55.34 -42.75 74.24 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.044 0.937 . . . . 0.0 110.224 178.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.562 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -94.61 -24.74 17.08 Favored 'General case' 0 N--CA 1.433 -1.286 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.218 -179.271 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.402 HD12 HG23 ' A' ' 12' ' ' VAL . 3.4 tt -57.2 -52.73 64.14 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.868 1.267 . . . . 0.0 109.605 177.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.8 mt -62.58 -38.71 91.17 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -175.097 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.88 10.55 41.12 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -175.058 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.62 ' HB2' HD22 ' A' ' 64' ' ' LEU . 40.5 mt -50.71 135.1 24.03 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 178.634 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -134.21 179.48 6.24 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 176.231 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.67 -42.76 85.74 Favored Glycine 0 C--O 1.204 -1.764 0 CA-C-O 119.238 -0.757 . . . . 0.0 112.699 -179.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -55.33 -43.33 74.85 Favored 'General case' 0 CA--C 1.488 -1.409 0 CA-C-N 117.459 0.629 . . . . 0.0 111.873 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.6 mtpp -65.23 -49.5 69.42 Favored 'General case' 0 C--O 1.196 -1.754 0 O-C-N 123.763 0.665 . . . . 0.0 110.817 176.356 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 91.1 mt -60.0 -30.95 69.48 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.848 0.833 . . . . 0.0 111.391 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.714 ' HA ' HG22 ' A' ' 52' ' ' THR . 58.7 mtpt -77.68 -30.24 51.84 Favored 'General case' 0 N--CA 1.426 -1.659 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.127 177.339 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.38 -4.32 47.63 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.224 0.535 . . . . 0.0 111.267 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.601 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.3 mm? -84.94 -7.56 59.11 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 171.191 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.85 -1.26 39.95 Favored Glycine 0 C--O 1.223 -0.578 0 CA-C-N 115.879 -0.601 . . . . 0.0 113.719 176.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.411 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 15.3 tpt -85.32 -50.18 7.55 Favored 'General case' 0 C--N 1.307 -1.239 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 -178.658 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.714 HG22 ' HA ' ' A' ' 47' ' ' LYS . 74.8 p 52.88 31.72 11.24 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 123.995 0.918 . . . . 0.0 112.168 174.311 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.2 t -73.08 129.76 38.79 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.768 -175.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.6 t -53.66 -54.86 31.78 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 125.061 1.344 . . . . 0.0 113.118 -176.692 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -50.65 -55.88 14.4 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-O 122.513 1.149 . . . . 0.0 109.914 177.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.788 ' O ' HG12 ' A' ' 60' ' ' VAL . 6.3 m-20 -62.0 -42.16 98.85 Favored 'General case' 0 N--CA 1.412 -2.345 0 CA-C-N 113.055 -1.884 . . . . 0.0 111.105 -173.188 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -52.79 -25.64 11.95 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 177.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -101.35 -38.47 8.03 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-O 120.879 0.371 . . . . 0.0 110.985 176.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 56.0 tp -72.67 -55.2 7.18 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -174.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.788 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.4 p -59.88 -26.4 35.47 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.032 0 CA-C-O 121.637 0.732 . . . . 0.0 109.16 -179.249 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.416 ' HA ' ' CD2' ' A' ' 64' ' ' LEU . 55.9 tptt -72.01 -28.92 63.71 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 113.655 -1.612 . . . . 0.0 110.16 -172.863 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -84.44 -40.21 18.03 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 114.73 -1.123 . . . . 0.0 108.655 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.401 ' HG2' HD13 ' A' ' 19' ' ' LEU . 3.0 tppt? -69.43 -42.46 74.94 Favored 'General case' 0 C--N 1.297 -1.686 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.201 -175.413 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.62 HD22 ' HB2' ' A' ' 41' ' ' LEU . 3.7 pp -65.73 -30.06 70.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.343 -175.332 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -82.68 -22.13 34.68 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 119.701 -0.8 . . . . 0.0 111.711 -179.253 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 . . . . . 0 C--N 1.324 -0.51 0 CA-C-O 121.06 0.457 . . . . 0.0 110.205 179.458 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.469 HG12 ' CH2' ' A' ' 7' ' ' TRP . 4.3 m . . . . . 0 CA--C 1.51 -0.565 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 12.3 p-80 -71.12 -12.69 61.63 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-O 121.268 0.556 . . . . 0.0 110.643 178.291 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -91.66 -7.9 48.63 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.85 178.412 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.488 ' O ' ' HB2' ' A' ' 34' ' ' SER . 49.2 m0 -82.66 147.45 28.51 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 -179.345 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 58.0 m -115.75 -69.21 0.87 Allowed 'General case' 0 N--CA 1.416 -2.162 0 O-C-N 123.422 0.451 . . . . 0.0 110.917 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.416 ' O ' HG12 ' A' ' 12' ' ' VAL . 59.3 t -141.58 -60.56 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -178.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.7 pm0 -70.29 9.58 0.58 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.629 -1.168 . . . . 0.0 113.865 -177.716 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.418 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 69.5 mt-30 -123.15 -11.9 7.96 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 175.158 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.574 HG23 HD12 ' A' ' 38' ' ' LEU . 4.2 p -77.4 -19.52 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-O 122.488 1.137 . . . . 0.0 108.474 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.9 p -67.53 -40.38 85.05 Favored 'General case' 0 N--CA 1.425 -1.676 0 C-N-CA 125.692 1.597 . . . . 0.0 112.376 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' HIS . . . . . 0.418 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 45.1 m-70 -57.61 -38.57 75.15 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.266 -177.287 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.467 ' O ' HD23 ' A' ' 19' ' ' LEU . 42.5 t90 -64.94 -61.06 2.39 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.488 176.141 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.1 mt -45.37 -52.62 9.69 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.657 1.183 . . . . 0.0 112.389 -177.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 85.3 t -62.65 -27.39 42.83 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 CA-C-O 121.148 0.499 . . . . 0.0 111.489 -177.554 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.67 -30.76 70.57 Favored Glycine 0 C--O 1.217 -0.918 0 CA-C-N 115.914 -0.584 . . . . 0.0 112.034 -178.147 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.467 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.4 OUTLIER -102.63 15.52 29.06 Favored 'General case' 0 C--N 1.314 -0.953 0 O-C-N 122.503 -0.41 . . . . 0.0 111.215 177.74 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.0 m 67.4 26.99 8.24 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 122.422 1.106 . . . . 0.0 111.008 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.418 ' HG ' ' CD1' ' A' ' 19' ' ' LEU . 1.2 mm? -98.0 21.28 10.92 Favored 'General case' 0 C--N 1.31 -1.114 0 C-N-CA 125.173 1.389 . . . . 0.0 108.69 178.02 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.409 ' HA ' HG12 ' A' ' 25' ' ' VAL . 8.8 p-10 -60.45 -9.97 4.33 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 123.893 0.877 . . . . 0.0 112.939 176.66 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.411 ' OE1' ' HA ' ' A' ' 21' ' ' LEU . 0.7 OUTLIER -84.07 -18.14 37.95 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 118.957 -1.097 . . . . 0.0 111.431 172.497 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -84.75 -27.72 26.74 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -177.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.544 ' HA ' ' HB2' ' A' ' 28' ' ' PHE . 0.7 OUTLIER -58.89 -25.62 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 177.971 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.3 m -54.7 -40.78 69.53 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.836 0.854 . . . . 0.0 111.383 176.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 38.2 tp10 -105.97 -27.42 11.18 Favored 'General case' 0 C--O 1.219 -0.541 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.044 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.544 ' HB2' ' HA ' ' A' ' 25' ' ' VAL . 1.7 m-85 -53.73 -44.39 69.85 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 121.218 0.533 . . . . 0.0 110.473 176.066 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.414 ' HA ' HG13 ' A' ' 9' ' ' VAL . 17.6 m -69.5 -28.87 66.43 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.615 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -76.88 -19.82 56.99 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.949 -176.176 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -106.8 4.21 27.29 Favored 'General case' 0 CA--C 1.501 -0.917 0 C-N-CA 119.649 -0.82 . . . . 0.0 109.474 175.327 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 61.06 38.9 16.86 Favored 'General case' 0 C--O 1.245 0.868 0 O-C-N 124.087 0.867 . . . . 0.0 110.435 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 49.4 mm -67.95 114.64 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.874 0 CA-C-N 115.187 -0.915 . . . . 0.0 108.673 -179.163 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.488 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 89.1 p -103.49 -169.26 1.62 Allowed 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 178.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.464 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -60.96 -29.04 69.73 Favored Glycine 0 N--CA 1.439 -1.12 0 N-CA-C 111.42 -0.672 . . . . 0.0 111.42 178.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -58.4 -44.8 89.16 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.39 0.614 . . . . 0.0 109.631 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.94 -4.46 49.75 Favored 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -179.255 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.574 HD12 HG23 ' A' ' 12' ' ' VAL . 3.3 tt -80.57 -49.47 11.27 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 178.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.5 mt -61.38 -39.52 90.97 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.524 -178.141 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.47 15.4 16.0 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -178.31 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.412 ' CB ' HD22 ' A' ' 64' ' ' LEU . 40.8 mt -55.64 160.49 2.48 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.704 0.764 . . . . 0.0 112.674 178.11 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.446 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 15.5 t70 -162.08 172.36 16.0 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 105.784 -1.932 . . . . 0.0 105.784 -177.158 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.401 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -61.04 -34.73 89.05 Favored Glycine 0 C--O 1.204 -1.748 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 175.206 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -51.1 -48.55 61.68 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 123.455 0.702 . . . . 0.0 111.16 176.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.45 ' O ' HD23 ' A' ' 49' ' ' LEU . 14.0 mtpp -69.07 -43.08 75.32 Favored 'General case' 0 C--O 1.197 -1.702 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.266 176.478 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 91.0 mt -59.84 -27.23 66.47 Favored 'General case' 0 C--O 1.255 1.349 0 CA-C-O 121.603 0.716 . . . . 0.0 111.244 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.767 ' HA ' HG22 ' A' ' 52' ' ' THR . 58.4 mtpt -80.8 -40.34 25.19 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.701 175.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.26 -11.26 60.45 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.512 0.672 . . . . 0.0 111.59 179.418 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.469 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.0 mm? -78.21 -3.23 41.62 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 123.179 0.591 . . . . 0.0 110.029 171.22 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 70.57 8.99 64.22 Favored Glycine 0 C--N 1.341 0.845 0 CA-C-O 121.259 0.366 . . . . 0.0 112.665 177.064 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 22.0 mmt -92.13 -59.06 2.19 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 115.418 -0.391 . . . . 0.0 110.929 -178.129 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.767 HG22 ' HA ' ' A' ' 47' ' ' LYS . 25.5 p 57.68 25.57 11.92 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 124.588 1.155 . . . . 0.0 112.588 175.493 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.425 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 14.8 m -69.74 118.99 13.29 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 123.19 0.596 . . . . 0.0 111.559 -176.511 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.0 m -63.2 -34.42 77.61 Favored 'General case' 0 C--O 1.244 0.77 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -177.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.459 ' HG3' ' N ' ' A' ' 56' ' ' ASP . 5.3 pt20 -59.24 -45.26 91.63 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.548 0.689 . . . . 0.0 110.198 176.16 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.587 ' O ' HG12 ' A' ' 60' ' ' VAL . 70.9 m-20 -74.76 -35.08 62.58 Favored 'General case' 0 N--CA 1.425 -1.724 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.666 -175.377 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.425 ' HG2' ' O ' ' A' ' 53' ' ' SER . 49.0 mmm-85 -55.22 -25.81 35.51 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.684 0.394 . . . . 0.0 111.548 175.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -98.28 -17.69 18.79 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.889 0.375 . . . . 0.0 111.279 178.35 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -96.39 -66.55 0.9 Allowed 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 120.641 0.258 . . . . 0.0 110.801 -175.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.587 HG12 ' O ' ' A' ' 56' ' ' ASP . 3.9 p -61.55 -24.57 34.22 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.849 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.769 -174.446 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -63.59 -36.25 83.17 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 122.107 0.956 . . . . 0.0 109.442 -179.282 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.445 ' O ' ' HG2' ' A' ' 65' ' ' LYS . 82.5 tttt -81.98 -34.76 29.53 Favored 'General case' 0 C--N 1.29 -2.016 0 CA-C-N 114.163 -1.381 . . . . 0.0 109.571 -177.783 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.454 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.5 OUTLIER -74.54 -38.57 62.73 Favored 'General case' 0 C--O 1.191 -1.989 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.229 -176.99 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.412 HD22 ' CB ' ' A' ' 41' ' ' LEU . 3.5 pp -64.36 -29.96 71.02 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -176.003 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.445 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 21.6 pttp -75.25 -34.97 61.44 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 119.933 -0.707 . . . . 0.0 110.309 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 . . . . . 0 C--N 1.311 -1.089 0 CA-C-O 121.15 0.5 . . . . 0.0 111.062 -175.509 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.583 HG12 ' CH2' ' A' ' 7' ' ' TRP . 15.2 m . . . . . 0 C--O 1.214 -0.799 0 CA-C-O 121.238 0.542 . . . . 0.0 112.311 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.4 p-80 -73.37 -9.11 58.35 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.843 0.83 . . . . 0.0 110.725 179.091 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -98.74 -11.27 22.07 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.149 177.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.583 ' CH2' HG12 ' A' ' 4' ' ' VAL . 54.1 m0 -72.53 150.77 42.9 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 177.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.2 m -104.48 -75.0 0.63 Allowed 'General case' 0 N--CA 1.424 -1.759 0 CA-C-O 121.082 0.468 . . . . 0.0 109.992 -178.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.513 ' O ' HG12 ' A' ' 12' ' ' VAL . 94.5 t -139.06 -65.67 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.203 -1.353 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 -175.624 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -66.71 -14.04 62.06 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.153 0.501 . . . . 0.0 112.301 -176.183 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.493 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 86.2 mt-30 -88.34 -15.75 34.83 Favored 'General case' 0 N--CA 1.433 -1.299 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 178.038 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.513 HG12 ' O ' ' A' ' 9' ' ' VAL . 2.9 p -75.67 -25.76 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-O 122.028 0.918 . . . . 0.0 109.294 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.412 ' HA ' HD12 ' A' ' 16' ' ' LEU . 0.8 OUTLIER -67.09 -28.38 68.13 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 114.6 -1.182 . . . . 0.0 111.654 -177.039 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' HIS . . . . . 0.493 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 83.6 m-70 -59.5 -41.68 90.41 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 -178.078 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.528 ' O ' HD23 ' A' ' 19' ' ' LEU . 38.0 t90 -64.51 -57.46 9.13 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.819 177.517 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.473 HD11 ' CD2' ' A' ' 28' ' ' PHE . 48.5 mt -48.96 -51.24 31.44 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.104 0.962 . . . . 0.0 112.738 -178.067 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 13' ' ' SER . 88.2 t -62.47 -24.78 36.15 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.033 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.022 -178.508 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -75.03 -24.13 72.56 Favored Glycine 0 N--CA 1.444 -0.775 0 N-CA-C 112.017 -0.433 . . . . 0.0 112.017 -177.32 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.528 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.7 OUTLIER -105.56 15.98 26.15 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.143 0.496 . . . . 0.0 110.482 174.818 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.1 m 64.67 28.92 13.09 Favored 'General case' 0 C--O 1.213 -0.862 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.804 178.466 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.605 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 0.6 OUTLIER -100.51 20.86 14.19 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 126.851 2.06 . . . . 0.0 108.856 -179.593 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -49.59 -29.97 7.97 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.595 0.758 . . . . 0.0 112.242 176.085 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.605 ' NE2' ' HA ' ' A' ' 21' ' ' LEU . 2.6 pm0 -61.75 -22.37 65.33 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 176.208 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.414 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 8.4 m-85 -85.97 -22.87 27.14 Favored 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 86.9 t -54.86 -38.71 45.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 O-C-N 123.383 0.427 . . . . 0.0 111.254 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.8 m -50.86 -39.46 53.83 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.283 1.033 . . . . 0.0 111.745 -178.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.623 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 35.4 tp10 -103.34 -30.66 10.47 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.747 -178.643 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.473 ' CD2' HD11 ' A' ' 16' ' ' LEU . 1.6 m-85 -55.26 -41.13 71.8 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 121.389 0.614 . . . . 0.0 109.884 176.467 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.463 ' HA ' HG13 ' A' ' 9' ' ' VAL . 47.1 t -69.37 -34.81 75.1 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.911 178.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.52 -32.51 71.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.129 -173.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -99.33 6.44 46.15 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.124 -179.523 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 59.47 39.15 22.18 Favored 'General case' 0 C--O 1.244 0.783 0 O-C-N 123.867 0.729 . . . . 0.0 110.118 178.636 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.4 mm -67.76 112.54 2.98 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.219 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.34 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 87.6 p -107.13 -168.23 1.37 Allowed 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.484 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.9 -25.37 67.71 Favored Glycine 0 N--CA 1.441 -0.975 0 N-CA-C 111.458 -0.657 . . . . 0.0 111.458 177.4 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -56.26 -39.57 72.83 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.265 1.026 . . . . 0.0 108.955 178.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.402 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -99.1 -20.71 16.54 Favored 'General case' 0 N--CA 1.434 -1.27 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 179.211 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.414 HD12 HG23 ' A' ' 12' ' ' VAL . 2.6 tt -64.75 -51.47 62.16 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.915 0.886 . . . . 0.0 109.856 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.405 HD21 HG21 ' A' ' 4' ' ' VAL . 25.6 mt -62.31 -34.32 76.38 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.547 0.689 . . . . 0.0 111.718 -175.535 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.56 13.59 34.51 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -177.465 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.409 HD23 ' HD3' ' A' ' 45' ' ' LYS . 41.3 mt -55.03 155.19 4.73 Favored 'General case' 0 C--O 1.24 0.588 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 177.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -159.38 -176.66 5.92 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 176.089 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.95 -39.25 93.88 Favored Glycine 0 N--CA 1.429 -1.791 0 CA-C-O 118.982 -0.899 . . . . 0.0 113.014 -179.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 -57.55 -45.15 85.47 Favored 'General case' 0 CA--C 1.481 -1.686 0 CA-C-N 117.845 0.822 . . . . 0.0 111.896 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.409 ' HD3' HD23 ' A' ' 41' ' ' LEU . 15.1 mtpp -63.77 -46.31 85.82 Favored 'General case' 0 C--O 1.199 -1.58 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.999 177.217 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 83.8 mt -60.14 -32.48 71.07 Favored 'General case' 0 C--O 1.244 0.779 0 CA-C-O 121.679 0.752 . . . . 0.0 111.352 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.709 ' HA ' HG22 ' A' ' 52' ' ' THR . 40.9 mtpt -72.11 -34.74 68.83 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.922 175.633 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.07 -13.26 61.17 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 123.12 0.568 . . . . 0.0 111.434 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.623 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.3 mm? -77.71 -7.66 56.81 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-O 121.449 0.642 . . . . 0.0 109.544 173.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.89 -1.43 46.93 Favored Glycine 0 C--O 1.222 -0.614 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.955 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.414 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 37.6 tpp -85.15 -48.27 9.33 Favored 'General case' 0 N--CA 1.441 -0.885 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -178.395 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.709 HG22 ' HA ' ' A' ' 47' ' ' LYS . 70.5 p 55.72 17.02 2.21 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 125.579 1.552 . . . . 0.0 114.274 172.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.453 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 40.5 t -65.14 118.75 9.66 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 122.669 0.388 . . . . 0.0 111.25 -176.19 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.5 t -59.61 -46.46 88.89 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 123.745 0.818 . . . . 0.0 110.56 -177.149 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -57.13 -48.53 78.44 Favored 'General case' 0 C--O 1.241 0.619 0 O-C-N 123.427 0.455 . . . . 0.0 111.434 178.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.667 ' O ' HG12 ' A' ' 60' ' ' VAL . 29.0 m-20 -66.9 -44.81 79.84 Favored 'General case' 0 CA--C 1.474 -1.969 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.576 -177.449 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.666 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 28.5 mtm180 -58.15 -35.66 71.87 Favored 'General case' 0 C--O 1.196 -1.735 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 -178.251 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.81 -27.49 62.0 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.315 0.579 . . . . 0.0 110.648 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 47.8 tp -85.58 -51.57 6.4 Favored 'General case' 0 C--O 1.247 0.945 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.891 -177.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.667 HG12 ' O ' ' A' ' 56' ' ' ASP . 4.4 p -60.67 -22.52 26.31 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.513 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.003 178.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.666 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 26.5 tptp -70.55 -33.84 71.58 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 122.082 0.944 . . . . 0.0 108.877 -174.801 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -82.76 -43.28 16.94 Favored 'General case' 0 C--N 1.288 -2.103 0 CA-C-N 114.221 -1.354 . . . . 0.0 108.974 -178.628 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.462 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.8 OUTLIER -69.98 -36.31 75.09 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 114.734 -1.121 . . . . 0.0 112.198 -175.87 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.0 pp -69.7 -17.17 63.45 Favored 'General case' 0 C--O 1.205 -1.285 0 CA-C-N 116.757 -0.202 . . . . 0.0 111.303 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -98.47 0.57 45.45 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 119.719 -0.792 . . . . 0.0 112.342 176.134 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 . . . . . 0 C--N 1.322 -0.63 0 CA-C-O 122.82 1.295 . . . . 0.0 108.538 177.554 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.615 HG12 ' CH2' ' A' ' 7' ' ' TRP . 10.2 m . . . . . 0 CA--C 1.512 -0.506 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.4 p-80 -70.98 -12.98 61.84 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-O 121.39 0.615 . . . . 0.0 110.488 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -95.46 -2.18 49.29 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 123.908 0.883 . . . . 0.0 110.132 178.548 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.615 ' CH2' HG12 ' A' ' 4' ' ' VAL . 52.1 m0 -84.75 131.09 34.6 Favored 'General case' 0 N--CA 1.433 -1.304 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 179.001 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.2 m -87.57 -72.98 0.5 Allowed 'General case' 0 C--N 1.296 -1.754 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.801 -175.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.44 ' O ' HG12 ' A' ' 12' ' ' VAL . 66.7 t -143.49 -63.71 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.2 -1.514 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -179.617 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.427 ' NE2' ' HG3' ' A' ' 11' ' ' GLN . 4.3 pm0 -64.38 -24.7 67.73 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.051 -177.352 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.427 ' HG3' ' NE2' ' A' ' 10' ' ' GLN . 76.9 mt-30 -79.01 -14.51 59.15 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.547 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.44 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.8 p -73.12 -26.19 22.58 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 CA-C-O 121.666 0.746 . . . . 0.0 109.688 179.445 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.462 ' HA ' HD12 ' A' ' 16' ' ' LEU . 1.5 m -71.62 -26.4 62.56 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.538 -174.618 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -61.72 -34.48 75.87 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.194 0.521 . . . . 0.0 110.348 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.489 ' O ' HD23 ' A' ' 19' ' ' LEU . 40.3 t90 -68.05 -61.44 1.86 Allowed 'General case' 0 N--CA 1.433 -1.287 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 174.794 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.492 HD11 ' CG ' ' A' ' 28' ' ' PHE . 46.9 mt -45.43 -51.75 11.03 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.67 1.188 . . . . 0.0 112.676 -177.101 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 13' ' ' SER . 93.1 t -59.5 -31.51 46.84 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.261 -177.774 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.7 -35.9 86.57 Favored Glycine 0 N--CA 1.438 -1.229 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.342 -176.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.489 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.5 OUTLIER -100.19 20.54 14.43 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 121.297 -0.161 . . . . 0.0 111.414 -179.214 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.5 m 68.43 20.3 8.58 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-O 121.638 0.732 . . . . 0.0 111.679 178.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.454 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -102.33 20.91 16.0 Favored 'General case' 0 C--N 1.294 -1.828 0 C-N-CA 123.961 0.904 . . . . 0.0 110.15 -178.745 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.43 ' HA ' HG23 ' A' ' 25' ' ' VAL . 5.9 p-10 -52.8 -24.33 8.7 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.533 0.733 . . . . 0.0 110.964 174.07 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -60.68 -25.14 66.15 Favored 'General case' 0 C--N 1.301 -1.502 0 C-N-CA 125.338 1.455 . . . . 0.0 111.692 176.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.556 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 3.9 m-85 -89.17 -20.24 24.47 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.586 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.43 HG23 ' HA ' ' A' ' 22' ' ' ASP . 88.5 t -54.15 -38.58 39.13 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 O-C-N 123.553 0.533 . . . . 0.0 111.95 -179.078 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.2 m -52.1 -37.25 53.42 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.505 0.722 . . . . 0.0 112.324 -177.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 12.9 tp10 -105.18 -30.11 9.91 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.431 -178.788 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.492 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.4 m-85 -54.74 -42.97 72.26 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.177 0.513 . . . . 0.0 110.894 177.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.9 m -73.57 -25.17 60.24 Favored 'General case' 0 N--CA 1.435 -1.221 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.531 -179.363 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -76.22 -33.39 59.22 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.482 -175.393 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -95.95 7.27 46.83 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 119.825 -0.75 . . . . 0.0 110.073 -179.093 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 60.29 37.11 20.55 Favored 'General case' 0 CA--C 1.505 -0.752 0 O-C-N 123.861 0.726 . . . . 0.0 109.569 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 50.0 mm -68.5 113.62 4.47 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 179.345 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.52 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 99.0 p -104.74 -170.74 1.81 Allowed 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 178.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.478 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.47 -28.26 70.89 Favored Glycine 0 C--O 1.224 -0.522 0 N-CA-C 110.895 -0.882 . . . . 0.0 110.895 179.279 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -54.64 -44.89 73.59 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 125.027 1.331 . . . . 0.0 110.282 177.504 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.78 -1.07 50.48 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.9 tt -84.07 -43.03 15.49 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 9.4 mt -58.82 -40.43 84.1 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.542 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -100.96 18.25 20.14 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -175.407 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.477 HD23 ' HD3' ' A' ' 45' ' ' LYS . 40.5 mt -53.74 146.67 13.12 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 178.702 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -153.08 172.33 17.04 Favored 'General case' 0 C--N 1.297 -1.674 0 N-CA-C 106.592 -1.632 . . . . 0.0 106.592 178.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -57.64 -30.92 62.99 Favored Glycine 0 CA--C 1.481 -2.076 0 N-CA-C 111.29 -0.724 . . . . 0.0 111.29 177.625 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -53.36 -47.44 69.41 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.391 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.477 ' HD3' HD23 ' A' ' 41' ' ' LEU . 14.5 mtpp -72.73 -43.96 62.3 Favored 'General case' 0 C--O 1.186 -2.255 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.378 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 91.8 mt -55.55 -37.55 68.14 Favored 'General case' 0 N--CA 1.485 1.317 0 CA-C-O 122.142 0.972 . . . . 0.0 110.835 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.798 ' HA ' HG22 ' A' ' 52' ' ' THR . 41.4 mttm -71.49 -38.73 71.16 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 114.867 -1.061 . . . . 0.0 111.106 175.8 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.51 -13.04 60.35 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.475 0.655 . . . . 0.0 111.357 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.47 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.0 mm? -84.09 -1.78 55.54 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 174.297 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 69.84 6.57 56.43 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 115.516 -0.765 . . . . 0.0 114.956 174.004 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.556 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 13.5 tpt -85.34 -50.92 6.93 Favored 'General case' 0 CA--C 1.494 -1.183 0 C-N-CA 118.708 -1.197 . . . . 0.0 108.007 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.798 HG22 ' HA ' ' A' ' 47' ' ' LYS . 68.5 p 54.07 28.94 9.46 Favored 'General case' 0 C--O 1.25 1.091 0 C-N-CA 125.007 1.323 . . . . 0.0 113.252 170.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.573 ' HB2' ' OD1' ' A' ' 56' ' ' ASP . 58.5 m -72.99 -166.43 0.3 Allowed 'General case' 0 N--CA 1.425 -1.695 0 C-N-CA 123.228 0.611 . . . . 0.0 112.158 -176.626 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.0 t -117.93 -38.57 3.22 Favored 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 121.802 -0.561 . . . . 0.0 111.13 -177.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -72.94 -32.43 65.25 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-O 121.312 0.577 . . . . 0.0 110.99 -175.688 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.684 ' O ' HG12 ' A' ' 60' ' ' VAL . 10.4 p-10 -70.85 -40.31 72.43 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 -176.511 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.9 mmm180 -57.98 -14.7 6.93 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 125.161 1.384 . . . . 0.0 112.203 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -106.02 -38.39 6.33 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.396 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.431 HD12 HD12 ' A' ' 19' ' ' LEU . 0.8 OUTLIER -75.3 -63.09 1.35 Allowed 'General case' 0 C--O 1.243 0.745 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.467 -176.17 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.684 HG12 ' O ' ' A' ' 56' ' ' ASP . 11.8 p -62.98 -24.39 35.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 122.083 0.944 . . . . 0.0 109.977 -174.204 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 51.8 tptt -68.87 -28.24 66.53 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 113.893 -1.503 . . . . 0.0 110.088 -175.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -89.98 -32.79 16.63 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.508 179.409 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.11 -39.89 60.32 Favored 'General case' 0 C--N 1.294 -1.843 0 CA-C-N 114.95 -1.023 . . . . 0.0 112.049 -177.06 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.1 pp -65.41 -28.31 69.16 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.184 0.516 . . . . 0.0 110.977 -176.356 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -83.81 -10.76 57.83 Favored 'General case' 0 C--N 1.316 -0.885 0 C-N-CA 120.665 -0.414 . . . . 0.0 111.894 -178.554 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 . . . . . 0 CA--C 1.489 -1.384 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 179.645 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.513 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 4.4 m . . . . . 0 CA--C 1.509 -0.632 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -67.79 -17.93 64.69 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 120.977 0.418 . . . . 0.0 110.775 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -91.6 -12.36 34.52 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 123.224 0.61 . . . . 0.0 110.117 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.491 ' O ' ' HB2' ' A' ' 34' ' ' SER . 51.4 m0 -65.84 140.17 58.36 Favored 'General case' 0 CA--C 1.494 -1.206 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.33 -178.279 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.52 -89.28 0.16 Allowed 'General case' 0 N--CA 1.412 -2.333 0 CA-C-N 114.992 -1.004 . . . . 0.0 111.501 -178.275 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.537 ' O ' HG12 ' A' ' 12' ' ' VAL . 91.9 t -137.36 -59.88 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.284 -2.254 0 CA-C-N 114.2 -1.364 . . . . 0.0 108.145 -177.376 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -71.85 -14.73 62.04 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-O 121.246 0.546 . . . . 0.0 111.697 -178.168 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -78.68 -22.67 46.41 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.109 176.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.537 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.4 p -75.28 -27.02 19.11 Favored 'Isoleucine or valine' 0 C--O 1.244 0.781 0 CA-C-O 121.761 0.791 . . . . 0.0 109.029 -177.277 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.2 -29.21 67.13 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 114.823 -1.08 . . . . 0.0 110.574 -178.389 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 33.4 m170 -60.19 -36.38 77.5 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.517 ' O ' HD23 ' A' ' 19' ' ' LEU . 37.6 t90 -69.41 -61.21 1.88 Allowed 'General case' 0 N--CA 1.426 -1.632 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.564 176.293 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.42 HD11 ' CD2' ' A' ' 28' ' ' PHE . 32.6 mt -47.53 -50.9 22.45 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.137 0.975 . . . . 0.0 112.466 -176.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.5 t -60.85 -28.74 43.89 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 C-N-CA 122.311 0.244 . . . . 0.0 111.092 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -72.37 -23.16 78.4 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 116.177 -0.465 . . . . 0.0 112.147 -176.065 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.517 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -110.55 19.59 18.56 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 121.009 -0.276 . . . . 0.0 110.933 176.623 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.4 m 66.81 24.42 9.83 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.384 0.673 . . . . 0.0 112.139 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.426 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 0.9 OUTLIER -99.72 19.81 15.25 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 124.978 1.311 . . . . 0.0 108.836 -179.02 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -52.6 -28.41 21.05 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 124.228 1.011 . . . . 0.0 111.773 176.416 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.23 -14.67 62.72 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 120.071 -0.652 . . . . 0.0 112.468 177.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.427 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 2.3 m-85 -88.53 -20.69 24.76 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.114 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 96.8 t -58.0 -34.19 48.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.344 178.22 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.7 m -48.41 -42.11 31.11 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.701 1.2 . . . . 0.0 111.457 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 10.9 tp10 -106.52 -29.62 9.56 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.569 -177.577 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.42 ' CD2' HD11 ' A' ' 16' ' ' LEU . 1.9 m-85 -55.0 -42.2 72.23 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-O 121.524 0.678 . . . . 0.0 110.316 176.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.417 ' HA ' HG13 ' A' ' 9' ' ' VAL . 39.7 t -71.96 -24.68 61.64 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.158 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -80.13 -31.37 39.09 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.531 -174.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -99.1 3.47 46.68 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 119.734 -0.787 . . . . 0.0 110.266 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 60.46 41.37 15.98 Favored 'General case' 0 C--O 1.243 0.743 0 O-C-N 123.881 0.738 . . . . 0.0 109.398 -179.211 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 42.7 mm -70.4 108.79 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.097 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.491 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 80.7 p -100.57 -170.43 1.86 Allowed 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 108.496 -0.928 . . . . 0.0 108.496 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.513 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -61.49 -27.05 67.3 Favored Glycine 0 N--CA 1.448 -0.552 0 N-CA-C 111.468 -0.653 . . . . 0.0 111.468 178.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -56.27 -43.94 79.27 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 124.548 1.139 . . . . 0.0 109.598 177.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.63 -5.5 35.29 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.427 -179.506 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.494 HD12 HG23 ' A' ' 12' ' ' VAL . 3.4 tt -78.78 -49.65 12.65 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 124.368 1.067 . . . . 0.0 108.86 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.416 HD21 HG21 ' A' ' 4' ' ' VAL . 54.7 mt -59.54 -35.83 74.96 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.698 -178.075 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.01 11.77 34.92 Favored 'General case' 0 C--N 1.297 -1.699 0 CA-C-N 115.348 -0.842 . . . . 0.0 112.955 -176.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.405 ' CB ' HD22 ' A' ' 64' ' ' LEU . 41.3 mt -54.64 154.96 4.46 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 178.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -157.73 168.91 25.89 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 -178.632 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.81 -36.96 67.49 Favored Glycine 0 CA--C 1.496 -1.124 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -54.47 -46.57 73.4 Favored 'General case' 0 CA--C 1.5 -0.973 0 C-N-CA 122.965 0.506 . . . . 0.0 111.988 178.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.422 ' HE3' ' HB3' ' A' ' 45' ' ' LYS . 11.8 mtpp -66.48 -45.78 78.49 Favored 'General case' 0 C--O 1.195 -1.791 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.993 175.744 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 82.2 mt -59.6 -24.98 64.25 Favored 'General case' 0 C--O 1.254 1.319 0 C-N-CA 123.192 0.597 . . . . 0.0 111.954 -178.391 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.673 ' HA ' HG22 ' A' ' 52' ' ' THR . 23.4 mtpp -81.19 -31.2 34.1 Favored 'General case' 0 N--CA 1.437 -1.105 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.391 176.392 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.28 -4.73 57.74 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 123.253 0.621 . . . . 0.0 111.205 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.456 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.5 mm? -85.01 -3.89 58.95 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 173.161 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.18 -8.13 7.07 Favored Glycine 0 C--N 1.333 0.369 0 CA-C-N 115.708 -0.678 . . . . 0.0 113.842 176.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.427 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 4.9 tpt -77.69 -48.28 17.12 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.673 HG22 ' HA ' ' A' ' 47' ' ' LYS . 67.9 p 52.3 26.31 3.96 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.323 1.449 . . . . 0.0 113.1 174.55 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.44 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 45.2 t -66.66 117.5 8.91 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 120.909 0.385 . . . . 0.0 110.994 -175.818 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.1 m -61.6 -39.18 90.28 Favored 'General case' 0 C--O 1.248 1.008 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.262 -176.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -68.37 -45.31 73.1 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.145 179.241 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.567 ' O ' HG12 ' A' ' 60' ' ' VAL . 36.5 m-20 -71.18 -40.46 71.22 Favored 'General case' 0 CA--C 1.487 -1.462 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.488 -177.196 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.504 ' HA ' HG12 ' A' ' 60' ' ' VAL . 31.0 mtm180 -60.72 -31.44 70.74 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -78.46 -2.56 39.12 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.138 0.494 . . . . 0.0 110.88 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 40.5 tp -115.64 -47.99 2.79 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 120.96 0.409 . . . . 0.0 110.968 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.567 HG12 ' O ' ' A' ' 56' ' ' ASP . 5.2 p -60.4 -27.23 39.4 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.209 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.817 178.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -68.16 -36.45 79.65 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 122.005 0.907 . . . . 0.0 109.269 -175.243 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.414 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 23.8 ttmm -77.99 -41.81 34.72 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 113.724 -1.58 . . . . 0.0 108.776 -177.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.478 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.5 OUTLIER -69.67 -41.97 74.79 Favored 'General case' 0 C--O 1.186 -2.266 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.61 -177.65 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.405 HD22 ' CB ' ' A' ' 41' ' ' LEU . 3.2 pp -65.63 -30.88 71.65 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 120.828 0.347 . . . . 0.0 111.411 -176.456 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -81.79 -18.91 42.43 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.162 -0.615 . . . . 0.0 111.307 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 11.6 pt-20 . . . . . 0 C--O 1.212 -0.883 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.356 177.162 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.601 HG12 ' CH2' ' A' ' 7' ' ' TRP . 9.4 m . . . . . 0 C--O 1.219 -0.523 0 CA-C-O 121.133 0.492 . . . . 0.0 112.316 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.1 p-80 -70.91 -9.59 58.06 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.382 -177.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -102.73 -0.82 31.04 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.487 179.198 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.601 ' CH2' HG12 ' A' ' 4' ' ' VAL . 54.5 m0 -79.5 149.82 31.37 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.098 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.9 m -102.1 -79.49 0.52 Allowed 'General case' 0 N--CA 1.419 -2.023 0 O-C-N 123.469 0.481 . . . . 0.0 109.779 -177.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.483 ' O ' HG12 ' A' ' 12' ' ' VAL . 57.9 t -139.38 -60.46 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.3 5.19 5.9 Favored 'General case' 0 C--O 1.215 -0.76 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -176.37 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -103.62 -13.08 16.66 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.602 175.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.515 HG23 HD12 ' A' ' 38' ' ' LEU . 2.4 p -81.08 -24.46 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 CA-C-O 121.811 0.815 . . . . 0.0 109.406 -179.186 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.472 ' HB3' ' CG1' ' A' ' 25' ' ' VAL . 0.3 OUTLIER -67.61 -36.15 80.3 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.449 -178.557 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -57.77 -32.15 67.21 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.084 0.469 . . . . 0.0 110.486 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.511 ' O ' HD23 ' A' ' 19' ' ' LEU . 30.2 t90 -72.83 -60.97 1.98 Allowed 'General case' 0 N--CA 1.426 -1.658 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.202 174.131 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.586 HD11 ' CD2' ' A' ' 28' ' ' PHE . 44.2 mt -47.04 -51.96 16.14 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.132 0.973 . . . . 0.0 112.656 -177.431 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 13' ' ' SER . 77.4 t -61.69 -24.75 34.95 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 C-N-CA 122.896 0.478 . . . . 0.0 111.0 -177.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.11 -34.92 54.49 Favored Glycine 0 N--CA 1.436 -1.31 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 -177.089 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.511 HD23 ' O ' ' A' ' 15' ' ' TRP . 1.2 pt? -97.83 16.03 22.0 Favored 'General case' 0 C--O 1.214 -0.802 0 C-N-CA 121.071 -0.252 . . . . 0.0 111.107 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.0 m 73.81 14.49 4.09 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.146 0.978 . . . . 0.0 112.156 178.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -93.16 21.97 5.47 Favored 'General case' 0 C--N 1.292 -1.895 0 C-N-CA 124.55 1.14 . . . . 0.0 108.928 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -51.75 -32.82 32.29 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 124.165 0.986 . . . . 0.0 110.554 174.084 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -63.12 -22.71 67.05 Favored 'General case' 0 CA--C 1.548 0.88 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.757 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -86.84 -22.37 25.84 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.76 -178.01 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.472 ' CG1' ' HB3' ' A' ' 13' ' ' SER . 35.0 t -57.8 -34.06 47.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 O-C-N 123.101 0.25 . . . . 0.0 110.518 179.454 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.1 t -51.0 -35.56 34.59 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.995 0.918 . . . . 0.0 111.487 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 19.2 tp10 -108.15 -32.43 7.52 Favored 'General case' 0 N--CA 1.432 -1.346 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.916 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.586 ' CD2' HD11 ' A' ' 16' ' ' LEU . 2.1 m-85 -53.95 -40.34 66.72 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-O 121.214 0.53 . . . . 0.0 110.793 175.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 33.7 t -73.23 -25.56 60.79 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.594 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.56 -34.1 53.87 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 121.965 -0.459 . . . . 0.0 110.909 -175.565 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 2.5 mt-30 -95.63 -3.29 46.53 Favored 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 120.397 -0.521 . . . . 0.0 109.98 -178.732 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.1 m-80 62.85 45.08 5.82 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 121.799 0.809 . . . . 0.0 109.139 -178.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.4 mm -68.87 110.29 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.195 0 CA-C-N 114.358 -1.292 . . . . 0.0 108.638 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.455 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 89.8 p -102.53 -169.26 1.64 Allowed 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.567 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -63.49 -22.46 65.76 Favored Glycine 0 N--CA 1.439 -1.117 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.955 177.596 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -59.29 -42.46 91.36 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 177.137 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.542 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -93.93 -22.29 18.69 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.813 -179.415 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.515 HD12 HG23 ' A' ' 12' ' ' VAL . 3.0 tt -62.51 -50.41 71.49 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 124.587 1.155 . . . . 0.0 109.65 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 67.8 mt -64.14 -38.51 91.31 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.235 -0.438 . . . . 0.0 112.128 -177.46 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -96.23 11.05 35.9 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -177.034 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.572 ' HB2' HD22 ' A' ' 64' ' ' LEU . 29.0 mt -50.5 136.61 20.62 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 122.322 1.058 . . . . 0.0 113.444 178.507 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -137.5 165.56 25.99 Favored 'General case' 0 C--N 1.285 -2.231 0 N-CA-C 107.34 -1.355 . . . . 0.0 107.34 -179.073 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -53.46 -39.46 59.87 Favored Glycine 0 C--O 1.212 -1.232 0 O-C-N 123.732 0.645 . . . . 0.0 111.774 178.356 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -53.01 -44.72 67.51 Favored 'General case' 0 CA--C 1.496 -1.111 0 C-N-CA 122.669 0.387 . . . . 0.0 111.23 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.415 ' HE3' ' HB3' ' A' ' 45' ' ' LYS . 11.4 mtpp -67.83 -50.05 58.81 Favored 'General case' 0 C--O 1.201 -1.48 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.664 178.775 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.8 mt -56.88 -31.12 64.53 Favored 'General case' 0 C--O 1.256 1.441 0 C-N-CA 123.645 0.778 . . . . 0.0 112.072 -177.385 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.755 ' HA ' HG22 ' A' ' 52' ' ' THR . 57.0 mtpt -80.08 -37.81 33.02 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.981 178.443 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.85 -15.4 62.64 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 122.99 0.516 . . . . 0.0 111.218 178.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.437 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.3 mm? -72.47 -4.78 32.39 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.245 0.618 . . . . 0.0 110.143 173.499 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 71.02 20.28 77.75 Favored Glycine 0 CA--C 1.501 -0.815 0 CA-C-N 116.416 -0.356 . . . . 0.0 112.524 177.644 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 23.2 mmt -105.71 -63.81 1.21 Allowed 'General case' 0 C--N 1.304 -1.389 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.795 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.755 HG22 ' HA ' ' A' ' 47' ' ' LYS . 20.2 p 64.15 13.33 7.75 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.697 1.599 . . . . 0.0 113.301 173.094 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.6 m -58.92 122.48 13.75 Favored 'General case' 0 N--CA 1.433 -1.314 0 C-N-CA 123.914 0.886 . . . . 0.0 111.143 -176.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.8 m -55.53 -35.13 65.33 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 -174.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.87 -33.7 39.85 Favored 'General case' 0 CA--C 1.497 -1.064 0 C-N-CA 119.255 -0.978 . . . . 0.0 111.207 -178.366 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.694 ' O ' HG12 ' A' ' 60' ' ' VAL . 1.7 m-20 -68.35 -44.9 74.25 Favored 'General case' 0 CA--C 1.477 -1.828 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -50.21 -29.4 9.33 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 124.75 1.22 . . . . 0.0 113.168 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -98.0 -37.5 9.75 Favored 'General case' 0 C--N 1.307 -1.279 0 O-C-N 123.578 0.549 . . . . 0.0 111.134 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 43.0 tp -74.4 -51.54 14.69 Favored 'General case' 0 C--O 1.243 0.715 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -175.081 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.694 HG12 ' O ' ' A' ' 56' ' ' ASP . 10.7 p -62.51 -24.62 35.78 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.986 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -179.514 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.426 ' HA ' ' CD2' ' A' ' 64' ' ' LEU . 56.5 tptt -73.57 -27.07 61.13 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.971 -1.468 . . . . 0.0 110.054 -173.394 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -88.41 -37.03 16.2 Favored 'General case' 0 C--N 1.291 -1.937 0 CA-C-N 114.956 -1.02 . . . . 0.0 108.834 178.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.438 ' HG2' HD13 ' A' ' 19' ' ' LEU . 2.6 tppt? -69.33 -41.33 76.8 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.165 -177.314 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.572 HD22 ' HB2' ' A' ' 41' ' ' LEU . 4.1 pp -64.42 -30.93 71.96 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 122.919 0.488 . . . . 0.0 112.263 -177.337 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -82.44 -27.24 32.06 Favored 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 119.784 -0.766 . . . . 0.0 111.642 -178.285 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 . . . . . 0 C--N 1.317 -0.838 0 C-N-CA 120.529 -0.468 . . . . 0.0 109.826 178.422 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.465 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 4.2 m . . . . . 0 CA--C 1.509 -0.627 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 9.3 p-80 -71.44 -9.8 58.75 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.527 0.68 . . . . 0.0 110.444 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -93.09 -10.3 36.49 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.94 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 54.8 m0 -80.98 146.94 30.45 Favored 'General case' 0 CA--C 1.498 -1.045 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 70.2 m -104.62 -73.83 0.66 Allowed 'General case' 0 N--CA 1.413 -2.289 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.488 ' O ' HG12 ' A' ' 12' ' ' VAL . 55.6 t -140.79 -50.31 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.096 0 CA-C-O 121.918 0.866 . . . . 0.0 110.497 -174.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -75.61 -21.74 57.5 Favored 'General case' 0 C--N 1.282 -2.336 0 CA-C-N 114.503 -1.226 . . . . 0.0 111.348 -177.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.493 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 88.0 mt-30 -91.94 -11.42 36.27 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -176.615 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 9' ' ' VAL . 3.8 p -74.36 -25.83 19.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 CA-C-O 122.026 0.917 . . . . 0.0 108.545 178.642 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.44 ' HA ' HD12 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -69.76 -28.95 66.19 Favored 'General case' 0 N--CA 1.427 -1.583 0 CA-C-N 114.505 -1.225 . . . . 0.0 111.519 -176.139 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' HIS . . . . . 0.493 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 37.8 m-70 -63.61 -32.51 74.0 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.946 0.403 . . . . 0.0 110.15 -177.403 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.487 ' O ' HD23 ' A' ' 19' ' ' LEU . 27.5 t90 -69.41 -58.49 3.93 Favored 'General case' 0 N--CA 1.436 -1.147 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.46 175.317 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.461 HD11 ' CD2' ' A' ' 28' ' ' PHE . 48.3 mt -46.84 -50.39 18.57 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.307 1.043 . . . . 0.0 112.539 -177.139 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.0 t -60.2 -30.19 45.46 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.1 0 CA-C-O 120.822 0.344 . . . . 0.0 111.135 -178.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.01 -27.04 74.27 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 116.027 -0.533 . . . . 0.0 112.148 -176.391 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.487 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -107.28 15.93 24.52 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 178.845 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.5 m 70.64 25.62 4.09 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-O 121.694 0.759 . . . . 0.0 111.589 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.406 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.2 mm? -102.74 19.46 19.17 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 124.828 1.251 . . . . 0.0 110.516 -179.537 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -51.92 -30.6 25.03 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.214 0.531 . . . . 0.0 111.243 175.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -58.74 -23.13 59.36 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.87 0.868 . . . . 0.0 111.84 177.465 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -88.45 -22.98 23.4 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 94.8 t -54.44 -36.39 34.29 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 CA-C-O 120.885 0.374 . . . . 0.0 110.889 -178.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 22.7 t -46.62 -40.98 13.93 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.585 1.554 . . . . 0.0 111.649 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 39.2 tp10 -108.17 -28.93 9.2 Favored 'General case' 0 N--CA 1.438 -1.027 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.676 -179.024 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.461 ' CD2' HD11 ' A' ' 16' ' ' LEU . 1.1 m-85 -54.39 -46.1 73.02 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-O 121.432 0.634 . . . . 0.0 110.775 177.371 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 41.3 m -83.43 -6.33 59.43 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.038 -178.344 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.93 -37.14 20.89 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -91.4 0.79 57.46 Favored 'General case' 0 CA--C 1.506 -0.725 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.223 -178.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 66.17 38.64 4.57 Favored 'General case' 0 CA--C 1.512 -0.507 0 O-C-N 124.059 0.849 . . . . 0.0 109.731 -178.623 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.3 mm -67.75 116.06 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 178.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 90.8 p -105.94 -166.71 1.23 Allowed 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.465 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -63.35 -25.02 68.06 Favored Glycine 0 N--CA 1.439 -1.154 0 N-CA-C 110.956 -0.858 . . . . 0.0 110.956 177.444 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -56.65 -45.98 81.3 Favored 'General case' 0 CA--C 1.508 -0.635 0 C-N-CA 123.474 0.71 . . . . 0.0 109.786 177.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.573 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -92.61 -14.85 27.62 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.925 -177.485 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.437 HD12 HG23 ' A' ' 12' ' ' VAL . 3.7 tt -69.2 -50.41 47.65 Favored 'General case' 0 C--N 1.311 -1.076 0 O-C-N 123.955 0.784 . . . . 0.0 109.092 179.592 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 37.8 mt -63.92 -42.71 97.32 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.454 -177.221 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.8 14.97 13.9 Favored 'General case' 0 CA--C 1.564 1.519 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -176.595 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' A' ' 37' ' ' GLN . 35.4 mt -57.01 158.42 4.98 Favored 'General case' 0 C--O 1.246 0.909 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 176.834 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.417 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 3.1 p-10 -165.4 -178.67 5.1 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 177.136 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.81 -41.28 83.09 Favored Glycine 0 C--O 1.214 -1.154 0 CA-C-O 119.256 -0.747 . . . . 0.0 113.464 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -55.63 -46.09 77.47 Favored 'General case' 0 CA--C 1.485 -1.521 0 CA-C-N 117.355 0.578 . . . . 0.0 111.376 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.465 ' HD3' HD23 ' A' ' 41' ' ' LEU . 14.5 mtpp -66.12 -45.67 80.27 Favored 'General case' 0 C--O 1.198 -1.652 0 O-C-N 123.522 0.514 . . . . 0.0 110.724 177.2 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 92.2 mt -60.85 -24.1 65.64 Favored 'General case' 0 C--O 1.258 1.548 0 CA-C-O 121.391 0.615 . . . . 0.0 111.601 -178.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.735 ' HA ' HG22 ' A' ' 52' ' ' THR . 58.1 mtpt -85.16 -39.54 17.75 Favored 'General case' 0 N--CA 1.433 -1.285 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.044 176.589 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.23 -14.15 61.28 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.744 0.783 . . . . 0.0 110.956 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.553 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 3.6 mm? -75.74 3.27 10.13 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.296 172.356 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 63.75 19.22 62.71 Favored Glycine 0 C--N 1.342 0.891 0 CA-C-O 121.283 0.38 . . . . 0.0 112.506 177.608 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 23.1 mmt -103.57 -63.1 1.22 Allowed 'General case' 0 N--CA 1.421 -1.921 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -176.415 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.735 HG22 ' HA ' ' A' ' 47' ' ' LYS . 29.5 p 57.64 22.25 8.09 Favored 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 124.447 1.099 . . . . 0.0 112.24 176.544 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 35.6 t -61.08 118.74 7.17 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 124.47 1.108 . . . . 0.0 111.248 -174.221 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.9 m -53.29 -41.24 65.41 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 124.414 1.086 . . . . 0.0 113.609 -176.172 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -65.77 -51.91 55.29 Favored 'General case' 0 CA--C 1.5 -0.945 0 CA-C-O 122.295 1.045 . . . . 0.0 109.922 177.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.674 ' O ' HG12 ' A' ' 60' ' ' VAL . 63.7 m-20 -66.66 -35.92 81.32 Favored 'General case' 0 N--CA 1.419 -2.013 0 CA-C-N 113.734 -1.575 . . . . 0.0 111.364 -170.703 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.7 mmm180 -58.53 -14.68 8.6 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 175.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -107.56 -35.57 6.7 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-O 120.656 0.265 . . . . 0.0 110.965 174.254 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 48.8 tp -81.14 -57.57 3.45 Favored 'General case' 0 C--O 1.241 0.612 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -176.285 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.674 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.7 p -61.31 -21.03 23.94 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.801 0 CA-C-O 121.535 0.683 . . . . 0.0 110.31 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.455 ' HD2' HD21 ' A' ' 64' ' ' LEU . 0.9 OUTLIER -70.22 -26.17 63.74 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.579 -179.689 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.492 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 51.5 tttp -86.98 -40.58 14.63 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 114.939 -1.028 . . . . 0.0 108.828 178.095 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.486 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.6 OUTLIER -69.76 -43.63 71.83 Favored 'General case' 0 C--O 1.19 -2.065 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.801 -175.054 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.455 HD21 ' HD2' ' A' ' 61' ' ' LYS . 3.7 pp -61.58 -30.03 70.41 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.028 0.442 . . . . 0.0 111.805 -175.457 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 53.7 pttt -84.98 -18.97 32.85 Favored 'General case' 0 C--N 1.315 -0.93 0 C-N-CA 119.675 -0.81 . . . . 0.0 112.504 -178.083 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 12.0 pt-20 . . . . . 0 C--N 1.307 -1.26 0 CA-C-O 121.169 0.509 . . . . 0.0 111.116 178.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.557 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.5 m . . . . . 0 C--O 1.215 -0.745 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -72.89 -4.54 32.57 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-O 121.445 0.64 . . . . 0.0 110.828 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -103.36 -2.47 26.98 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.291 178.132 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.54 ' CD2' ' HA ' ' A' ' 4' ' ' VAL . 53.2 m0 -83.19 136.99 34.22 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.327 -177.592 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.7 m -90.69 -72.88 0.55 Allowed 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.899 -176.039 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.45 ' O ' HG12 ' A' ' 12' ' ' VAL . 79.4 t -143.56 -65.91 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.199 -1.564 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 -179.476 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 -66.91 -17.92 65.13 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.153 0.501 . . . . 0.0 112.349 -175.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -81.05 -17.75 49.09 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.98 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.495 ' HA ' ' CE3' ' A' ' 7' ' ' TRP . 2.2 p -69.45 -24.95 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-O 121.912 0.863 . . . . 0.0 109.47 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.415 ' HA ' HD12 ' A' ' 16' ' ' LEU . 1.0 OUTLIER -70.58 -23.87 62.67 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-N 114.609 -1.178 . . . . 0.0 111.449 -176.881 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 51.5 m-70 -62.19 -39.19 91.89 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 110.285 -0.265 . . . . 0.0 110.285 -178.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.498 ' O ' HD23 ' A' ' 19' ' ' LEU . 32.6 t90 -67.91 -58.29 4.8 Favored 'General case' 0 N--CA 1.44 -0.94 0 O-C-N 123.816 0.697 . . . . 0.0 109.827 176.274 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.539 HD11 ' CD2' ' A' ' 28' ' ' PHE . 43.9 mt -47.1 -50.17 20.48 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.141 0.976 . . . . 0.0 112.511 -177.369 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 86.1 t -61.5 -26.38 39.36 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.076 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.463 -178.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.76 -26.09 68.06 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 116.33 -0.396 . . . . 0.0 112.197 -177.235 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.498 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -105.6 13.68 29.59 Favored 'General case' 0 C--N 1.321 -0.666 0 O-C-N 122.405 -0.467 . . . . 0.0 111.349 177.89 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.6 m 70.74 21.45 5.24 Favored 'General case' 0 C--O 1.211 -0.94 0 CA-C-O 121.866 0.841 . . . . 0.0 111.611 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.412 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.9 mm? -98.52 19.8 13.91 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.984 178.566 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -53.04 -25.76 13.51 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.829 0.852 . . . . 0.0 111.163 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -69.63 -18.77 63.62 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 123.504 0.722 . . . . 0.0 110.723 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -85.92 -22.06 27.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.526 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 89.3 t -54.49 -37.98 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 O-C-N 123.633 0.583 . . . . 0.0 111.132 -179.508 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.3 m -52.31 -33.09 40.76 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.077 0.951 . . . . 0.0 112.296 -177.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 53.3 tp10 -111.63 -27.69 8.44 Favored 'General case' 0 N--CA 1.444 -0.732 0 O-C-N 122.358 -0.214 . . . . 0.0 110.802 179.122 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.539 ' CD2' HD11 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -56.68 -42.29 78.79 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 121.677 0.751 . . . . 0.0 109.884 175.138 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 31.0 t -73.73 -21.56 60.17 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.709 -1.132 . . . . 0.0 109.605 -179.441 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.54 -39.79 24.1 Favored 'General case' 0 N--CA 1.436 -1.132 0 O-C-N 121.905 -0.497 . . . . 0.0 110.907 -176.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -87.36 2.51 50.15 Favored 'General case' 0 CA--C 1.501 -0.94 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.182 -177.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 65.07 34.94 8.34 Favored 'General case' 0 CA--C 1.501 -0.922 0 O-C-N 124.322 1.014 . . . . 0.0 109.713 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.8 mm -66.32 112.41 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.529 0 CA-C-N 114.7 -1.136 . . . . 0.0 108.244 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.489 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 97.5 p -103.46 -170.33 1.77 Allowed 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 178.56 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.557 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.43 -30.04 75.15 Favored Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -51.7 -48.0 63.69 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 123.986 0.914 . . . . 0.0 110.02 175.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.09 -22.51 25.36 Favored 'General case' 0 CA--C 1.502 -0.894 0 C-N-CA 120.49 -0.484 . . . . 0.0 111.786 -177.197 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.4 tt -61.33 -48.63 80.44 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 124.84 1.256 . . . . 0.0 109.272 178.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 35' ' ' GLY . 28.2 mt -65.89 -39.61 90.79 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.604 -178.235 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.55 22.17 7.38 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -177.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.459 HD23 ' HD3' ' A' ' 45' ' ' LYS . 59.7 mt -64.04 158.85 21.5 Favored 'General case' 0 C--O 1.247 0.923 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 176.025 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.478 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 2.8 p30 -164.52 178.28 7.5 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 175.298 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.51 -38.35 70.27 Favored Glycine 0 C--O 1.218 -0.883 0 O-C-N 123.764 0.665 . . . . 0.0 113.898 -177.385 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -59.89 -42.56 94.06 Favored 'General case' 0 CA--C 1.483 -1.603 0 CA-C-N 117.39 0.595 . . . . 0.0 111.325 -178.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.459 ' HD3' HD23 ' A' ' 41' ' ' LEU . 11.6 mtpp -66.45 -45.01 81.25 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.929 178.127 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 78.3 mt -61.1 -25.28 66.86 Favored 'General case' 0 C--O 1.256 1.419 0 CA-C-O 121.599 0.714 . . . . 0.0 110.966 -179.162 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.814 ' HA ' HG22 ' A' ' 52' ' ' THR . 7.3 mtpm? -82.63 -41.39 19.51 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 114.782 -1.099 . . . . 0.0 110.297 176.016 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.73 -13.44 62.29 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.462 0.705 . . . . 0.0 111.396 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.493 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 3.9 mm? -75.33 -2.36 27.98 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.52 172.289 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 70.65 16.06 73.82 Favored Glycine 0 C--N 1.342 0.864 0 CA-C-O 121.774 0.652 . . . . 0.0 111.598 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 97.7 mmm -100.97 -67.58 0.85 Allowed 'General case' 0 N--CA 1.423 -1.821 0 CA-C-N 114.782 -0.709 . . . . 0.0 110.002 -176.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.814 HG22 ' HA ' ' A' ' 47' ' ' LYS . 20.9 p 65.64 -3.41 0.71 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.863 1.665 . . . . 0.0 113.938 175.202 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.6 m -50.75 121.39 5.82 Favored 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 126.665 1.986 . . . . 0.0 112.427 -173.39 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.1 p -54.31 -48.77 70.96 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -173.227 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -56.05 -50.06 72.02 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-O 121.844 0.83 . . . . 0.0 109.832 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.701 ' O ' HG12 ' A' ' 60' ' ' VAL . 4.8 m-20 -63.39 -47.95 79.91 Favored 'General case' 0 CA--C 1.486 -1.485 0 CA-C-N 113.874 -1.512 . . . . 0.0 109.622 -176.114 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 39.1 mmm-85 -49.05 -38.49 24.09 Favored 'General case' 0 CA--C 1.506 -0.721 0 C-N-CA 124.587 1.155 . . . . 0.0 112.44 -179.644 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -83.11 -33.74 26.25 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-O 121.197 0.523 . . . . 0.0 111.402 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.422 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 45.9 tp -80.36 -51.08 9.29 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -174.689 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.701 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.4 p -64.25 -21.26 28.61 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.217 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 4.9 tppp? -69.28 -35.95 76.57 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.149 -178.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.422 ' HG2' ' O ' ' A' ' 59' ' ' LEU . 19.1 ptmt -90.2 -18.75 25.15 Favored 'General case' 0 N--CA 1.419 -1.99 0 CA-C-N 115.089 -0.96 . . . . 0.0 109.507 -176.057 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.438 ' HG2' HD13 ' A' ' 19' ' ' LEU . 1.8 tppt? -84.56 -38.79 19.55 Favored 'General case' 0 C--O 1.199 -1.588 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.035 177.166 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.6 pp -66.42 -14.55 62.33 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.619 0.368 . . . . 0.0 111.731 -176.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 59.4 pttt -90.03 -12.99 36.94 Favored 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.477 176.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 . . . . . 0 CA--C 1.509 -0.629 0 CA-C-O 123.041 1.4 . . . . 0.0 109.985 -176.544 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.472 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 6.8 m . . . . . 0 CA--C 1.506 -0.716 0 N-CA-C 112.311 0.485 . . . . 0.0 112.311 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.5 p-80 -71.67 -12.8 61.51 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-O 120.97 0.414 . . . . 0.0 110.801 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -91.03 -19.43 23.2 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.625 177.335 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.448 ' CH2' HG12 ' A' ' 4' ' ' VAL . 50.7 m0 -58.36 145.38 38.39 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -174.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.4 m -95.43 -80.36 0.42 Allowed 'General case' 0 N--CA 1.415 -2.184 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.465 -175.193 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.513 ' O ' HG12 ' A' ' 12' ' ' VAL . 73.8 t -146.03 -61.85 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.554 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 -178.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.5 pm0 -67.34 -17.69 64.85 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.542 -177.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -80.02 -17.68 52.16 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.402 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.513 HG12 ' O ' ' A' ' 9' ' ' VAL . 2.6 p -74.27 -21.86 17.78 Favored 'Isoleucine or valine' 0 C--O 1.245 0.847 0 CA-C-O 121.908 0.861 . . . . 0.0 109.096 -177.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.87 -26.58 64.26 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.957 -177.539 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 -62.47 -32.59 73.51 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.332 0.587 . . . . 0.0 109.7 -177.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.483 ' CH2' HG23 ' A' ' 60' ' ' VAL . 28.4 t90 -74.24 -58.82 3.04 Favored 'General case' 0 N--CA 1.427 -1.591 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.473 175.781 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.439 HD11 ' CG ' ' A' ' 28' ' ' PHE . 38.8 mt -48.05 -48.85 32.97 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.261 1.024 . . . . 0.0 112.5 -176.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 77.2 t -60.5 -29.25 44.18 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 CA-C-O 120.769 0.319 . . . . 0.0 110.97 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -71.72 -22.2 78.74 Favored Glycine 0 N--CA 1.442 -0.952 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.406 -176.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.485 HD13 ' HG2' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -113.7 17.8 17.91 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 117.076 0.438 . . . . 0.0 111.716 177.791 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.5 m 68.84 20.82 7.87 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.699 0.8 . . . . 0.0 112.063 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.464 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.8 mm? -98.94 18.34 17.42 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.963 179.573 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.501 ' HA ' HG23 ' A' ' 25' ' ' VAL . 8.7 p-10 -52.34 -25.2 9.03 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.912 0.885 . . . . 0.0 111.216 175.284 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -64.47 -23.75 67.39 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 124.023 0.929 . . . . 0.0 111.373 178.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.501 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 3.0 m-85 -86.57 -20.79 27.43 Favored 'General case' 0 N--CA 1.437 -1.087 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.87 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.501 HG23 ' HA ' ' A' ' 22' ' ' ASP . 90.7 t -53.08 -40.87 39.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 C-N-CA 123.495 0.718 . . . . 0.0 111.404 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.9 m -53.7 -35.49 61.19 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.237 0.615 . . . . 0.0 112.163 -177.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.612 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 21.2 tp10 -103.7 -28.94 11.37 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.851 -179.694 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.439 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.9 m-85 -56.22 -32.99 64.94 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-O 121.851 0.834 . . . . 0.0 109.965 176.403 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.485 ' HA ' HG13 ' A' ' 9' ' ' VAL . 21.6 p -80.76 -31.73 35.79 Favored 'General case' 0 N--CA 1.423 -1.823 0 CA-C-N 114.809 -1.087 . . . . 0.0 111.722 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.36 -45.5 76.15 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-O 121.819 0.819 . . . . 0.0 110.441 -176.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -94.72 14.72 20.29 Favored 'General case' 0 C--N 1.299 -1.617 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.815 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . 0.285 4.3 p30 46.05 60.92 2.93 Favored 'General case' 0 CA--C 1.502 -0.892 0 CA-C-O 122.476 1.132 . . . . 0.0 113.429 177.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 49.5 mm -85.11 117.51 30.43 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.846 0 CA-C-N 113.86 -1.518 . . . . 0.0 107.024 176.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.6 p -106.59 -166.03 1.14 Allowed 'General case' 0 C--N 1.293 -1.861 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 177.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.472 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -64.15 -25.81 69.91 Favored Glycine 0 N--CA 1.441 -1.007 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 178.702 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -57.38 -45.21 84.7 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 123.693 0.797 . . . . 0.0 109.381 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.57 -3.22 43.42 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.539 -179.2 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.477 HD12 HG23 ' A' ' 12' ' ' VAL . 3.5 tt -81.85 -51.11 8.44 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 46.6 mt -61.08 -30.85 70.59 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.473 -176.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.09 13.63 33.7 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 -179.3 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.443 ' HB2' HD22 ' A' ' 64' ' ' LEU . 37.8 mt -47.32 148.39 1.31 Allowed 'General case' 0 C--O 1.246 0.872 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 179.267 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.456 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 12.8 t70 -143.9 165.44 27.71 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 106.368 -1.716 . . . . 0.0 106.368 -175.927 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -57.28 -38.23 85.29 Favored Glycine 0 C--O 1.214 -1.143 0 N-CA-C 109.646 -1.382 . . . . 0.0 109.646 175.834 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -54.28 -47.98 71.75 Favored 'General case' 0 CA--C 1.495 -1.146 0 C-N-CA 123.806 0.843 . . . . 0.0 111.168 177.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.426 ' O ' HD23 ' A' ' 49' ' ' LEU . 14.2 mtpp -63.97 -46.64 83.71 Favored 'General case' 0 C--O 1.199 -1.555 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.531 177.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 83.4 mt -58.73 -25.49 63.02 Favored 'General case' 0 C--O 1.256 1.435 0 CA-C-O 121.604 0.716 . . . . 0.0 111.181 -179.272 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.775 ' HA ' HG22 ' A' ' 52' ' ' THR . 23.8 mtpp -83.43 -36.62 24.08 Favored 'General case' 0 N--CA 1.432 -1.357 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.467 176.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.34 -16.38 61.88 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.541 0.686 . . . . 0.0 111.127 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.612 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.6 mm? -73.68 -6.66 48.19 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.631 0.729 . . . . 0.0 109.094 172.479 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 69.87 4.52 48.16 Favored Glycine 0 CA--C 1.502 -0.779 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.512 177.525 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.605 ' HG3' ' OG ' ' A' ' 53' ' ' SER . 30.2 tpp -88.0 -51.16 5.97 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 -176.76 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.775 HG22 ' HA ' ' A' ' 47' ' ' LYS . 62.0 p 51.66 23.45 1.96 Allowed 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 125.257 1.423 . . . . 0.0 113.826 174.346 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.605 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 12.9 m -62.27 127.02 29.35 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 124.29 1.036 . . . . 0.0 111.939 -174.264 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.1 m -55.2 -51.25 67.15 Favored 'General case' 0 CA--C 1.553 1.079 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -172.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -58.33 -54.27 48.95 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 122.836 1.303 . . . . 0.0 109.634 178.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.743 ' O ' HG12 ' A' ' 60' ' ' VAL . 6.2 m-20 -59.57 -44.16 93.38 Favored 'General case' 0 C--N 1.282 -2.368 0 CA-C-N 112.279 -2.237 . . . . 0.0 111.026 -172.071 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.1 mmm180 -54.26 -23.17 13.88 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 177.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -100.18 -34.16 10.14 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.962 0.41 . . . . 0.0 110.78 176.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 48.7 tp -77.22 -57.29 3.92 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -176.35 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.743 HG12 ' O ' ' A' ' 56' ' ' ASP . 4.8 p -60.15 -21.01 21.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 CA-C-O 121.729 0.776 . . . . 0.0 110.628 -179.292 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 15.1 tppt? -65.62 -35.03 79.62 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 114.296 -1.32 . . . . 0.0 109.846 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -91.68 -30.25 16.41 Favored 'General case' 0 C--N 1.292 -1.897 0 CA-C-N 114.788 -1.097 . . . . 0.0 109.989 -177.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.485 ' HG2' HD13 ' A' ' 19' ' ' LEU . 2.8 tppt? -72.08 -40.73 68.03 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 115.067 -0.969 . . . . 0.0 111.29 -178.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.443 HD22 ' HB2' ' A' ' 41' ' ' LEU . 3.8 pp -59.2 -30.09 67.97 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.884 0.373 . . . . 0.0 111.677 -176.599 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -82.63 -22.27 34.78 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 120.37 -0.532 . . . . 0.0 111.901 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 . . . . . 0 C--O 1.24 0.577 0 CA-C-O 121.062 0.458 . . . . 0.0 110.178 179.758 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.572 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 4.4 m . . . . . 0 C--O 1.217 -0.606 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 15.0 p80 -70.62 -13.39 62.07 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 121.478 0.656 . . . . 0.0 110.719 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -96.17 -4.27 42.9 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.138 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.523 ' CD2' ' HA ' ' A' ' 4' ' ' VAL . 52.3 m0 -83.77 142.16 30.88 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.62 -178.765 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 21.3 m -103.58 -72.14 0.71 Allowed 'General case' 0 N--CA 1.423 -1.813 0 CA-C-O 121.195 0.522 . . . . 0.0 110.918 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.539 ' O ' HG12 ' A' ' 12' ' ' VAL . 69.9 t -139.57 -61.7 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.208 -1.12 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 -176.771 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.7 pm0 -66.01 -19.86 66.0 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.305 -176.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.401 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 37.2 mt-30 -86.23 -17.74 33.96 Favored 'General case' 0 N--CA 1.435 -1.212 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.477 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.539 HG12 ' O ' ' A' ' 9' ' ' VAL . 3.2 p -72.39 -24.27 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 CA-C-O 121.79 0.805 . . . . 0.0 109.785 -177.513 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.455 ' O ' HG23 ' A' ' 17' ' ' VAL . 1.1 m -71.22 -27.89 63.81 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.357 -177.19 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' HIS . . . . . 0.401 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 33.2 m-70 -59.54 -40.57 87.66 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-O 120.978 0.418 . . . . 0.0 110.095 -178.225 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.466 ' CH2' HG23 ' A' ' 60' ' ' VAL . 35.6 t90 -64.65 -57.22 9.65 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.51 177.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.447 HD11 ' CG ' ' A' ' 28' ' ' PHE . 41.4 mt -49.02 -46.32 43.91 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.932 0.893 . . . . 0.0 112.138 -177.686 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 13' ' ' SER . 98.1 t -61.2 -26.21 38.58 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.208 0 CA-C-O 121.208 0.528 . . . . 0.0 111.114 -179.293 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.95 -24.84 73.04 Favored Glycine 0 N--CA 1.438 -1.198 0 C-N-CA 121.32 -0.467 . . . . 0.0 112.491 -177.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.516 HD13 ' CB ' ' A' ' 63' ' ' LYS . 0.7 OUTLIER -114.49 21.97 14.08 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -179.06 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.1 m 71.49 17.5 5.69 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.756 0.789 . . . . 0.0 111.266 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.468 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.3 mm? -100.54 15.12 29.05 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.311 -177.15 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.453 ' HA ' HG23 ' A' ' 25' ' ' VAL . 7.2 p-10 -56.02 -19.6 13.34 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 121.253 0.549 . . . . 0.0 111.6 174.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -68.38 -23.72 64.7 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 124.125 0.97 . . . . 0.0 111.112 176.652 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -86.86 -19.81 28.38 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.592 -179.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.453 HG23 ' HA ' ' A' ' 22' ' ' ASP . 88.7 t -52.21 -39.24 26.76 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 C-N-CA 123.117 0.567 . . . . 0.0 111.654 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.1 m -51.25 -37.63 48.18 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.085 0.954 . . . . 0.0 112.166 -178.144 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 14.9 tp10 -103.28 -31.73 9.93 Favored 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.112 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.447 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.3 m-85 -54.49 -45.33 73.23 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 121.198 0.523 . . . . 0.0 111.618 178.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 35.2 m -76.32 -16.88 59.67 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.71 -178.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -79.69 -35.04 39.68 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.699 -178.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -90.87 2.56 56.05 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 119.844 -0.742 . . . . 0.0 110.04 -177.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 67.0 32.84 6.08 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.105 178.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.3 mm -64.39 118.73 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.051 -178.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.505 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 93.3 p -107.07 -172.35 2.06 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 176.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.572 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -64.43 -22.77 67.9 Favored Glycine 0 N--CA 1.439 -1.164 0 N-CA-C 111.184 -0.767 . . . . 0.0 111.184 179.38 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -59.5 -45.78 90.7 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 123.219 0.608 . . . . 0.0 109.366 176.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.435 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -88.48 -17.05 31.17 Favored 'General case' 0 CA--C 1.494 -1.21 0 C-N-CA 120.413 -0.515 . . . . 0.0 111.47 -178.447 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.453 HD12 HG23 ' A' ' 12' ' ' VAL . 2.1 tt -69.51 -49.59 53.17 Favored 'General case' 0 C--N 1.308 -1.198 0 O-C-N 124.367 1.042 . . . . 0.0 108.802 -179.654 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.9 mt -59.6 -42.54 92.8 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.551 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.57 25.84 3.77 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -178.832 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.499 ' CB ' HD22 ' A' ' 64' ' ' LEU . 28.2 mt -65.74 161.4 20.85 Favored 'General case' 0 C--O 1.247 0.924 0 CA-C-O 121.173 0.511 . . . . 0.0 111.869 175.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -167.94 176.73 6.03 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.79 -39.09 93.32 Favored Glycine 0 CA--C 1.497 -1.07 0 CA-C-O 119.608 -0.551 . . . . 0.0 112.193 -178.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -51.12 -48.18 61.81 Favored 'General case' 0 CA--C 1.506 -0.731 0 C-N-CA 123.331 0.652 . . . . 0.0 110.667 178.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.423 ' HD3' HD23 ' A' ' 41' ' ' LEU . 11.2 mtpp -67.65 -44.88 76.85 Favored 'General case' 0 C--O 1.197 -1.67 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.297 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 91.3 mt -59.46 -28.84 67.35 Favored 'General case' 0 C--O 1.255 1.343 0 CA-C-O 121.488 0.661 . . . . 0.0 111.734 -179.134 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.685 ' HA ' HG22 ' A' ' 52' ' ' THR . 22.2 mtpp -76.77 -33.07 58.08 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.906 176.593 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.03 -12.78 60.02 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.685 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.523 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.5 mm? -78.56 -2.16 37.46 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.347 0.594 . . . . 0.0 109.421 173.11 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.07 -0.72 37.03 Favored Glycine 0 C--O 1.216 -1.017 0 CA-C-N 115.832 -0.622 . . . . 0.0 113.185 176.169 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 24.6 mmt -85.33 -53.72 5.04 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 120.721 0.296 . . . . 0.0 111.365 -177.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.685 HG22 ' HA ' ' A' ' 47' ' ' LYS . 20.0 p 56.11 25.22 8.75 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.584 1.154 . . . . 0.0 112.547 174.1 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 47.4 t -68.28 127.66 33.74 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 123.289 0.636 . . . . 0.0 111.158 -174.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.6 m -58.01 -44.33 87.21 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -175.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -58.94 -55.34 36.44 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.969 0.89 . . . . 0.0 109.658 178.172 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.733 ' O ' HG12 ' A' ' 60' ' ' VAL . 48.5 m-20 -62.33 -38.58 90.03 Favored 'General case' 0 N--CA 1.42 -1.967 0 CA-C-N 113.838 -1.528 . . . . 0.0 111.245 -173.172 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 46.9 mmm-85 -56.53 -15.7 4.74 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 176.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -108.57 -39.29 5.44 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-O 121.042 0.449 . . . . 0.0 110.169 175.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 47.6 tp -73.68 -54.93 6.97 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -173.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.733 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.0 p -64.64 -25.13 37.12 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.02 0 CA-C-O 121.352 0.596 . . . . 0.0 110.195 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.489 ' HD2' HD21 ' A' ' 64' ' ' LEU . 19.1 mmmt -70.91 -23.75 62.33 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.662 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.503 ' O ' ' HG2' ' A' ' 65' ' ' LYS . 22.5 ttmm -87.39 -40.88 14.02 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 114.656 -1.156 . . . . 0.0 108.964 178.158 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.516 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -72.6 -34.11 67.16 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-N 115.344 -0.844 . . . . 0.0 112.699 -178.344 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.499 HD22 ' CB ' ' A' ' 41' ' ' LEU . 3.2 pp -72.34 -24.56 61.31 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.003 0.43 . . . . 0.0 111.352 -177.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 21.5 ptmt -83.98 -9.33 58.76 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 120.465 -0.494 . . . . 0.0 111.339 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 . . . . . 0 C--N 1.321 -0.668 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 178.611 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.52 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.5 m . . . . . 0 N--CA 1.479 0.991 0 N-CA-C 113.842 1.052 . . . . 0.0 113.842 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 15.6 p-80 -70.77 -8.47 52.55 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-O 121.175 0.512 . . . . 0.0 111.223 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -99.75 -8.02 24.78 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.631 0.772 . . . . 0.0 109.862 177.234 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.521 ' O ' ' HB2' ' A' ' 34' ' ' SER . 50.1 m0 -74.53 133.01 42.32 Favored 'General case' 0 CA--C 1.489 -1.373 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -178.477 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.41 ' O ' ' HB3' ' A' ' 34' ' ' SER . 3.3 m -91.3 -75.51 0.47 Allowed 'General case' 0 N--CA 1.428 -1.56 0 CA-C-O 121.317 0.579 . . . . 0.0 110.156 -175.936 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.474 ' O ' HG12 ' A' ' 12' ' ' VAL . 97.9 t -140.83 -63.83 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.2 -1.535 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 179.129 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -62.88 -18.79 63.46 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.98 -177.442 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.459 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 46.7 mt-30 -82.13 -20.97 36.92 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.142 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.509 HG23 HD12 ' A' ' 38' ' ' LEU . 1.3 p -76.49 -26.42 16.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 CA-C-O 122.114 0.959 . . . . 0.0 108.652 -178.119 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.426 ' HA ' HD12 ' A' ' 16' ' ' LEU . 2.5 m -66.05 -33.41 75.73 Favored 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 114.479 -1.237 . . . . 0.0 112.342 -176.684 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' HIS . . . . . 0.459 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 44.6 m-70 -59.35 -37.67 78.45 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.666 0.746 . . . . 0.0 109.028 -178.013 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.543 ' O ' HD23 ' A' ' 19' ' ' LEU . 42.3 t90 -67.67 -58.89 3.87 Favored 'General case' 0 N--CA 1.424 -1.766 0 CA-C-N 114.374 -1.285 . . . . 0.0 109.983 176.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.448 HD11 ' CD2' ' A' ' 28' ' ' PHE . 46.8 mt -47.99 -49.83 29.49 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 124.181 0.992 . . . . 0.0 111.945 -178.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 94.5 t -67.21 -18.09 23.59 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.225 -178.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -86.79 -33.13 13.25 Favored Glycine 0 N--CA 1.438 -1.213 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 -176.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.543 HD23 ' O ' ' A' ' 15' ' ' TRP . 1.8 pt? -95.09 12.19 29.48 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.207 178.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.7 m 66.06 40.58 3.93 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 122.295 1.045 . . . . 0.0 110.29 -178.149 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.434 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.7 mm? -119.63 20.04 12.44 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 113.947 -1.479 . . . . 0.0 109.36 177.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.466 ' HA ' HG12 ' A' ' 25' ' ' VAL . 4.6 p-10 -55.57 -14.74 2.26 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-O 121.57 0.7 . . . . 0.0 112.139 174.189 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -65.97 -26.13 67.42 Favored 'General case' 0 C--N 1.293 -1.879 0 C-N-CA 123.978 0.911 . . . . 0.0 110.343 174.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.589 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 6.8 m-85 -89.77 -25.13 21.28 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -177.534 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.556 ' HA ' ' HB2' ' A' ' 28' ' ' PHE 0.325 1.4 p -59.64 -26.6 35.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 178.81 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.2 m -59.15 -27.88 66.06 Favored 'General case' 0 CA--C 1.562 1.439 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.887 177.14 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 16.0 tp10 -112.02 -33.31 6.31 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 179.305 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.556 ' HB2' ' HA ' ' A' ' 25' ' ' VAL . 3.5 m-85 -54.39 -40.96 68.7 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 121.011 0.434 . . . . 0.0 110.407 175.817 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.1 t -72.37 -22.91 61.07 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.252 -178.441 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -80.03 -37.56 33.79 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.611 -177.778 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -94.88 4.83 53.36 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 119.844 -0.743 . . . . 0.0 111.291 -178.485 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 61.1 39.13 16.49 Favored 'General case' 0 C--N 1.351 0.65 0 C-N-CA 123.148 0.579 . . . . 0.0 109.586 179.299 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.2 mm -66.37 110.02 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.049 0 CA-C-N 115.304 -0.862 . . . . 0.0 108.698 -179.607 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.521 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 78.5 p -105.76 -169.68 1.62 Allowed 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.52 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -58.73 -31.83 68.41 Favored Glycine 0 N--CA 1.445 -0.716 0 O-C-N 123.575 0.547 . . . . 0.0 112.102 -179.557 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -53.49 -50.12 66.05 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 123.678 0.791 . . . . 0.0 110.075 176.436 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.533 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -86.79 -17.3 33.85 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.229 -177.799 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.509 HD12 HG23 ' A' ' 12' ' ' VAL . 2.1 tt -70.51 -51.38 29.29 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.924 0.89 . . . . 0.0 109.171 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 47.1 mt -61.01 -36.05 78.47 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-O 121.341 0.591 . . . . 0.0 112.419 -176.316 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.76 17.63 23.38 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.05 -177.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 37' ' ' GLN . 21.4 mt -54.6 154.94 4.42 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 121.789 0.804 . . . . 0.0 112.203 176.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -161.89 168.24 23.32 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 -175.594 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.15 -38.05 65.88 Favored Glycine 0 C--O 1.209 -1.41 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 177.364 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -51.48 -48.48 62.85 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 122.674 0.389 . . . . 0.0 111.093 176.089 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.3 mtpp -70.06 -45.31 67.35 Favored 'General case' 0 C--O 1.193 -1.915 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.89 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 94.3 mt -56.61 -38.04 71.5 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-O 121.825 0.821 . . . . 0.0 110.751 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.785 ' HA ' HG22 ' A' ' 52' ' ' THR . 24.5 mtpp -69.73 -36.58 75.98 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.161 177.493 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.85 -10.68 59.73 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 123.223 0.609 . . . . 0.0 111.378 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.521 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.2 mm? -84.55 -1.94 56.61 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.522 0.677 . . . . 0.0 109.286 173.739 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 70.62 7.11 60.59 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.761 -0.654 . . . . 0.0 114.284 174.193 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.589 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 40.3 tpp -90.29 -53.93 4.24 Favored 'General case' 0 C--N 1.311 -1.078 0 C-N-CA 119.07 -1.052 . . . . 0.0 109.3 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.785 HG22 ' HA ' ' A' ' 47' ' ' LYS . 63.7 p 54.9 33.25 19.57 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 124.586 1.154 . . . . 0.0 112.714 172.118 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.524 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 60.5 m -70.66 -174.68 0.93 Allowed 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 123.473 0.709 . . . . 0.0 112.909 -178.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.1 p -102.01 -41.18 6.54 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -60.8 -45.36 94.72 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.498 0.666 . . . . 0.0 111.036 -177.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.637 ' O ' HG12 ' A' ' 60' ' ' VAL . 11.5 p-10 -66.01 -45.21 82.37 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.89 -172.445 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 56.6 mmm-85 -56.33 -18.59 11.28 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 123.332 0.653 . . . . 0.0 111.954 -176.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -104.15 -44.26 5.03 Favored 'General case' 0 N--CA 1.419 -1.994 0 CA-C-O 121.048 0.451 . . . . 0.0 110.213 174.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 23.4 tp -76.84 -55.99 5.0 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -172.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.637 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.6 p -65.51 -22.04 30.24 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.779 0 CA-C-O 121.419 0.628 . . . . 0.0 109.37 -178.483 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -68.92 -31.21 69.94 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 114.254 -1.339 . . . . 0.0 108.8 -177.004 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -86.41 -42.14 13.88 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.425 -1.261 . . . . 0.0 109.39 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.505 ' HE3' ' HB2' ' A' ' 19' ' ' LEU . 0.9 OUTLIER -65.29 -40.84 94.37 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.213 -176.785 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.464 HD22 ' CB ' ' A' ' 41' ' ' LEU . 3.6 pp -64.1 -32.36 73.89 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.163 -177.761 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -80.81 -18.88 46.04 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.287 -0.565 . . . . 0.0 111.999 -178.168 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 . . . . . 0 C--N 1.318 -0.775 0 O-C-N 122.474 -0.141 . . . . 0.0 111.082 -179.252 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.526 HG12 ' CH2' ' A' ' 7' ' ' TRP . 3.6 m . . . . . 0 N--CA 1.468 0.43 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.2 p-80 -70.54 -7.27 42.52 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-O 121.498 0.666 . . . . 0.0 110.783 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -99.61 -9.41 23.23 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 124.268 1.027 . . . . 0.0 110.298 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.551 ' HA ' ' NE2' ' A' ' 11' ' ' GLN . 54.4 m0 -76.03 142.35 41.85 Favored 'General case' 0 CA--C 1.504 -0.794 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.307 -175.696 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.9 m -94.81 -79.42 0.43 Allowed 'General case' 0 N--CA 1.418 -2.039 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.862 -178.773 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.506 ' O ' HG12 ' A' ' 12' ' ' VAL . 94.9 t -141.77 -59.66 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -179.46 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.6 pm0 -60.46 -26.45 66.78 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.03 -0.987 . . . . 0.0 111.437 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.551 ' NE2' ' HA ' ' A' ' 7' ' ' TRP . 23.8 mt-30 -81.31 -16.99 50.8 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 115.01 -0.995 . . . . 0.0 112.356 -175.425 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.506 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.7 p -79.91 -20.17 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 121.894 0.854 . . . . 0.0 109.073 -179.379 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.44 ' HA ' HD12 ' A' ' 16' ' ' LEU . 2.5 m -77.15 -23.51 51.64 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.461 -174.306 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 45.3 m80 -60.63 -41.01 94.01 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 178.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.497 ' O ' HD23 ' A' ' 19' ' ' LEU . 31.3 t90 -61.99 -60.03 4.22 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 114.649 -1.16 . . . . 0.0 110.163 177.699 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.459 HD11 ' CG ' ' A' ' 28' ' ' PHE . 43.3 mt -47.97 -47.61 32.72 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.262 1.025 . . . . 0.0 112.441 -177.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 89.4 t -64.43 -22.55 31.46 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.168 0 CA-C-O 121.257 0.551 . . . . 0.0 111.018 -179.258 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.11 -29.84 61.95 Favored Glycine 0 N--CA 1.442 -0.913 0 CA-C-N 116.23 -0.441 . . . . 0.0 112.105 -179.152 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.523 HD13 ' CB ' ' A' ' 63' ' ' LYS . 0.6 OUTLIER -108.69 17.67 21.66 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -178.821 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.2 m 68.17 25.28 7.36 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 121.845 0.831 . . . . 0.0 111.169 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.473 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.1 mm? -103.62 16.29 26.79 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 124.247 1.019 . . . . 0.0 109.383 178.857 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -51.5 -26.51 8.52 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.078 0.951 . . . . 0.0 111.606 175.504 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -64.38 -23.52 67.32 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 124.066 0.946 . . . . 0.0 111.129 178.523 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.447 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 2.0 m-85 -85.89 -19.01 31.19 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.34 -178.431 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 95.7 t -53.64 -38.56 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.863 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.9 t -50.01 -39.23 40.69 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.774 0.829 . . . . 0.0 111.734 -179.067 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 12.3 tp10 -104.22 -30.53 10.12 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 120.978 -0.289 . . . . 0.0 110.829 -178.621 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.459 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.7 m-85 -56.18 -39.22 72.05 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 121.48 0.657 . . . . 0.0 110.238 176.656 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.8 t -76.05 -30.16 58.31 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.403 179.013 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.76 -45.18 72.06 Favored 'General case' 0 CA--C 1.504 -0.817 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.01 -176.524 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.439 ' HG3' HG12 ' A' ' 33' ' ' ILE . 4.3 pt20 -94.7 13.94 22.78 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 -178.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 57.57 39.91 27.32 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.857 0.863 . . . . 0.0 111.837 174.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.439 HG12 ' HG3' ' A' ' 31' ' ' GLN . 49.9 mm -68.84 115.47 7.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -179.526 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.475 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 89.6 p -108.7 -170.21 1.63 Allowed 'General case' 0 N--CA 1.423 -1.789 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 178.179 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.481 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -60.04 -32.72 76.51 Favored Glycine 0 CA--C 1.507 -0.406 0 N-CA-C 111.379 -0.688 . . . . 0.0 111.379 -179.748 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -50.28 -45.27 54.32 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 125.146 1.378 . . . . 0.0 110.387 176.549 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.471 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -96.79 -14.8 21.69 Favored 'General case' 0 C--O 1.214 -0.765 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 179.778 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.457 HD12 HG23 ' A' ' 12' ' ' VAL . 2.6 tt -69.03 -53.06 22.47 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 -179.226 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 36.3 mt -60.3 -36.23 77.4 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.949 -176.645 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.36 10.51 39.45 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 113.755 1.021 . . . . 0.0 113.755 -175.929 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.721 ' HB2' HD22 ' A' ' 64' ' ' LEU . 41.0 mt -54.51 136.14 45.01 Favored 'General case' 0 C--O 1.243 0.745 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 179.28 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.408 ' OD1' ' HG3' ' A' ' 45' ' ' LYS . 4.0 p-10 -134.78 -177.77 4.77 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 177.148 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.18 -41.99 95.05 Favored Glycine 0 C--O 1.211 -1.338 0 CA-C-O 119.169 -0.795 . . . . 0.0 113.412 -178.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -62.52 -37.43 86.0 Favored 'General case' 0 CA--C 1.475 -1.932 0 CA-C-N 117.654 0.727 . . . . 0.0 112.442 -177.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HG3' ' OD1' ' A' ' 42' ' ' ASP . 8.5 mtpp -63.48 -49.6 72.97 Favored 'General case' 0 C--N 1.299 -1.6 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.791 175.232 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.6 mt -60.99 -22.58 64.64 Favored 'General case' 0 C--O 1.261 1.694 0 CA-C-O 121.328 0.585 . . . . 0.0 111.725 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.734 ' HA ' HG22 ' A' ' 52' ' ' THR . 62.2 mtpt -82.98 -41.67 18.48 Favored 'General case' 0 N--CA 1.433 -1.304 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.966 176.699 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.37 -11.23 60.79 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.554 0.693 . . . . 0.0 110.795 177.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.47 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 3.7 mm? -77.01 -3.28 38.24 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 172.37 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.14 1.85 51.0 Favored Glycine 0 CA--C 1.506 -0.506 0 CA-C-N 116.226 -0.443 . . . . 0.0 113.591 175.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.447 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 15.7 tpt -91.89 -50.89 5.48 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.367 -177.602 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.734 HG22 ' HA ' ' A' ' 47' ' ' LYS . 68.6 p 53.51 20.17 1.98 Allowed 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 124.959 1.304 . . . . 0.0 113.736 176.161 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 42.4 t -68.78 130.19 42.09 Favored 'General case' 0 C--N 1.31 -1.122 0 C-N-CA 123.057 0.543 . . . . 0.0 111.472 -172.243 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 31.7 t -56.38 -47.57 78.65 Favored 'General case' 0 C--O 1.247 0.931 0 C-N-CA 124.633 1.173 . . . . 0.0 111.631 -175.497 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 -53.88 -58.2 8.12 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-O 122.165 0.984 . . . . 0.0 110.471 177.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.72 ' O ' HG12 ' A' ' 60' ' ' VAL . 7.7 m-20 -63.15 -40.85 98.76 Favored 'General case' 0 N--CA 1.422 -1.869 0 CA-C-N 113.451 -1.704 . . . . 0.0 110.592 -171.736 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -54.06 -26.3 26.08 Favored 'General case' 0 C--O 1.218 -0.571 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 178.397 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -104.79 -14.92 15.37 Favored 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 121.134 -0.226 . . . . 0.0 111.504 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.405 ' C ' HD13 ' A' ' 59' ' ' LEU . 3.4 tm? -96.57 -59.01 1.91 Allowed 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 -175.12 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.72 HG12 ' O ' ' A' ' 56' ' ' ASP . 4.8 p -57.41 -26.77 27.17 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.553 0 CA-C-O 120.805 0.336 . . . . 0.0 110.865 -177.082 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.689 ' HD2' HD21 ' A' ' 64' ' ' LEU . 24.7 mmmt -62.12 -30.53 71.09 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.84 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.459 ' HA ' ' HE2' ' A' ' 65' ' ' LYS . 37.9 ttmt -79.25 -44.69 21.25 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 121.952 0.882 . . . . 0.0 109.114 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.523 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -70.54 -31.74 68.92 Favored 'General case' 0 C--N 1.295 -1.795 0 CA-C-N 114.01 -1.45 . . . . 0.0 112.404 -174.356 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.721 HD22 ' HB2' ' A' ' 41' ' ' LEU . 3.9 pp -75.05 -32.15 61.47 Favored 'General case' 0 N--CA 1.437 -1.107 0 N-CA-C 112.0 0.371 . . . . 0.0 112.0 179.507 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.459 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 64.2 pttt -80.07 -29.2 39.13 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 119.491 -0.884 . . . . 0.0 111.022 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.488 ' HG2' ' HA ' ' A' ' 63' ' ' LYS . 12.1 pt-20 . . . . . 0 C--O 1.242 0.677 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 178.768 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.561 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.4 m . . . . . 0 CA--C 1.511 -0.532 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 22.8 p-80 -73.38 -6.77 48.36 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 121.044 0.45 . . . . 0.0 110.606 178.634 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -105.25 -2.22 24.33 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.611 178.756 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.5 ' HA ' ' NE2' ' A' ' 11' ' ' GLN . 53.5 m0 -78.74 142.12 37.29 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.337 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.9 m -96.41 -81.92 0.41 Allowed 'General case' 0 N--CA 1.415 -2.222 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.98 -177.476 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.556 ' O ' HG12 ' A' ' 12' ' ' VAL . 87.2 t -139.71 -58.62 0.31 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.951 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 -178.426 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.4 pm0 -63.07 -29.47 70.84 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.523 0.678 . . . . 0.0 111.356 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.5 ' NE2' ' HA ' ' A' ' 7' ' ' TRP . 20.4 mt-30 -75.66 -15.63 60.29 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.802 -176.712 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.556 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.9 p -80.73 -18.32 12.06 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-O 121.285 0.564 . . . . 0.0 109.789 -179.423 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.437 ' O ' HG23 ' A' ' 17' ' ' VAL . 86.1 p -73.6 -39.27 64.72 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.448 -174.499 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 39.7 m80 -50.69 -41.07 55.49 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 114.831 -1.077 . . . . 0.0 110.842 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.477 ' O ' HD23 ' A' ' 19' ' ' LEU . 28.6 t90 -65.52 -58.81 4.9 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.988 176.581 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 40.4 mt -48.66 -48.28 39.99 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.963 0.905 . . . . 0.0 112.189 -178.405 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 13' ' ' SER . 60.6 t -65.68 -16.34 20.26 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.393 0 CA-C-O 121.069 0.462 . . . . 0.0 111.162 -178.373 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -85.81 -21.26 53.86 Favored Glycine 0 N--CA 1.444 -0.807 0 N-CA-C 112.336 -0.306 . . . . 0.0 112.336 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.485 ' HB2' ' HE3' ' A' ' 63' ' ' LYS . 1.3 pt? -112.45 21.66 15.46 Favored 'General case' 0 C--O 1.213 -0.839 0 O-C-N 122.154 -0.615 . . . . 0.0 111.572 177.903 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.4 m 68.82 22.26 7.33 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.613 0.765 . . . . 0.0 111.747 -179.312 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -103.11 17.74 23.36 Favored 'General case' 0 C--N 1.3 -1.564 0 C-N-CA 123.905 0.882 . . . . 0.0 110.55 -178.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -54.68 -26.82 35.92 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.468 0.707 . . . . 0.0 111.312 176.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -64.88 -21.66 66.85 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 124.599 1.16 . . . . 0.0 111.327 177.144 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.476 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 3.2 m-85 -89.65 -20.63 23.44 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.784 -179.097 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.1 t -55.73 -38.15 49.78 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 O-C-N 123.321 0.388 . . . . 0.0 111.532 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.4 m -51.12 -41.09 59.83 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.812 0.845 . . . . 0.0 111.282 -178.552 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.581 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 16.1 tp10 -99.31 -34.58 10.26 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.267 -177.842 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -54.21 -48.19 71.31 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-O 121.297 0.57 . . . . 0.0 110.919 178.222 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 45.8 m -77.81 -11.23 59.86 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.516 -178.161 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.22 -29.63 26.38 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.878 0.371 . . . . 0.0 110.401 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.74 2.45 47.02 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 120.132 -0.627 . . . . 0.0 109.871 178.718 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 65.53 32.44 9.38 Favored 'General case' 0 CA--C 1.514 -0.439 0 C-N-CA 123.981 0.912 . . . . 0.0 110.826 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.401 ' HA ' ' HG3' ' A' ' 37' ' ' GLN . 47.9 mm -62.63 113.13 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 O-C-N 123.643 0.589 . . . . 0.0 109.628 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 71.1 p -100.09 -172.09 2.16 Favored 'General case' 0 N--CA 1.423 -1.822 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.561 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -65.17 -23.05 69.54 Favored Glycine 0 N--CA 1.439 -1.159 0 N-CA-C 111.513 -0.635 . . . . 0.0 111.513 178.331 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -62.45 -40.44 96.62 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 123.641 0.776 . . . . 0.0 109.917 179.12 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.433 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -93.04 -17.37 23.94 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.909 179.743 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.523 HD12 HG23 ' A' ' 12' ' ' VAL . 3.2 tt -69.0 -51.48 38.84 Favored 'General case' 0 C--N 1.314 -0.96 0 C-N-CA 124.593 1.157 . . . . 0.0 109.217 179.404 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 63.5 mt -58.63 -38.91 79.07 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.369 0.604 . . . . 0.0 111.776 -178.287 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.77 13.73 29.4 Favored 'General case' 0 C--N 1.299 -1.611 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.715 -176.568 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.546 ' HB2' HD22 ' A' ' 64' ' ' LEU . 31.4 mt -54.22 139.22 36.56 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.801 0.81 . . . . 0.0 112.271 177.443 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -139.39 170.62 15.59 Favored 'General case' 0 C--N 1.284 -2.264 0 N-CA-C 106.296 -1.742 . . . . 0.0 106.296 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -53.3 -37.56 55.41 Favored Glycine 0 C--O 1.211 -1.324 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 177.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -49.56 -49.87 44.59 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.834 0.853 . . . . 0.0 110.352 178.362 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.433 ' HE3' ' HB3' ' A' ' 45' ' ' LYS . 13.3 mtpp -71.31 -44.04 65.92 Favored 'General case' 0 N--CA 1.421 -1.879 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.624 -177.455 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 88.2 mt -60.17 -28.38 67.89 Favored 'General case' 0 C--O 1.255 1.387 0 CA-C-O 121.49 0.662 . . . . 0.0 111.121 -179.454 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.784 ' HA ' HG22 ' A' ' 52' ' ' THR . 54.3 mtpt -78.92 -33.13 45.72 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 115.151 -0.932 . . . . 0.0 109.952 176.762 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.98 -4.89 46.35 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 123.127 0.571 . . . . 0.0 111.574 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.581 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.4 mm? -87.53 -2.15 58.42 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 173.17 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.06 -9.76 6.46 Favored Glycine 0 C--O 1.222 -0.602 0 CA-C-N 115.713 -0.676 . . . . 0.0 114.128 175.491 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.782 ' SD ' ' HB2' ' A' ' 53' ' ' SER . 0.0 OUTLIER -79.49 -50.36 10.88 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -176.336 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.784 HG22 ' HA ' ' A' ' 47' ' ' LYS . 70.1 p 53.21 27.44 6.0 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.833 1.253 . . . . 0.0 113.103 175.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.782 ' HB2' ' SD ' ' A' ' 51' ' ' MET . 40.0 t -65.7 123.55 20.02 Favored 'General case' 0 C--N 1.313 -1.015 0 C-N-CA 123.532 0.733 . . . . 0.0 111.944 -174.6 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.1 m -54.6 -41.72 70.27 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.958 0.903 . . . . 0.0 113.198 -177.067 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -61.07 -55.83 28.09 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.982 0.896 . . . . 0.0 109.557 176.582 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.727 ' O ' HG12 ' A' ' 60' ' ' VAL . 67.0 m-20 -62.61 -40.55 97.31 Favored 'General case' 0 N--CA 1.427 -1.577 0 CA-C-N 113.593 -1.64 . . . . 0.0 111.135 -171.768 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.1 mmm180 -53.79 -22.39 9.38 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 124.058 0.943 . . . . 0.0 113.045 177.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -106.8 -26.2 11.37 Favored 'General case' 0 N--CA 1.444 -0.752 0 O-C-N 123.138 0.274 . . . . 0.0 111.425 177.399 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 47.8 tp -86.42 -52.57 5.52 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -176.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.727 HG12 ' O ' ' A' ' 56' ' ' ASP . 6.5 p -62.77 -22.88 31.36 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.244 0 CA-C-O 121.414 0.625 . . . . 0.0 109.485 178.063 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.433 ' HA ' ' CD2' ' A' ' 64' ' ' LEU . 26.7 tptp -71.22 -27.53 63.56 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 114.422 -1.263 . . . . 0.0 108.797 -176.594 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -83.44 -46.78 12.11 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.909 -1.496 . . . . 0.0 108.995 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.485 ' HE3' ' HB2' ' A' ' 19' ' ' LEU . 0.9 OUTLIER -67.58 -40.01 84.84 Favored 'General case' 0 N--CA 1.426 -1.657 0 CA-C-N 114.143 -1.39 . . . . 0.0 110.933 -174.885 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.546 HD22 ' HB2' ' A' ' 41' ' ' LEU . 3.9 pp -64.05 -30.72 71.77 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.012 -176.279 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -87.29 -10.17 53.03 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 118.078 -1.449 . . . . 0.0 111.639 -178.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 . . . . . 0 C--N 1.309 -1.156 0 C-N-CA 120.364 -0.534 . . . . 0.0 109.605 178.692 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.521 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.4 m . . . . . 0 N--CA 1.468 0.443 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 18.0 p-80 -71.55 -12.85 61.58 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-O 121.292 0.568 . . . . 0.0 110.969 178.477 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -96.73 -12.6 23.53 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.994 178.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.407 ' CD2' ' HA ' ' A' ' 4' ' ' VAL . 51.0 m0 -66.45 141.03 58.06 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.171 -178.818 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.1 m -94.54 -80.06 0.41 Allowed 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.647 -178.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.546 ' O ' HG12 ' A' ' 12' ' ' VAL . 91.9 t -141.12 -60.43 0.22 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.143 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 -176.351 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.424 ' H ' ' CD ' ' A' ' 10' ' ' GLN . 4.1 pm0 -64.01 -23.29 67.28 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 115.186 -0.916 . . . . 0.0 112.265 -179.674 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -81.16 -18.26 46.94 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 179.375 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.546 HG12 ' O ' ' A' ' 9' ' ' VAL . 2.0 p -73.77 -24.34 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-O 121.63 0.728 . . . . 0.0 109.699 -179.102 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.453 ' O ' HG23 ' A' ' 17' ' ' VAL . 0.7 OUTLIER -70.8 -30.1 66.46 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.195 -176.214 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 42.0 m80 -58.09 -39.33 78.33 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-O 121.037 0.446 . . . . 0.0 110.039 -178.258 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.564 ' O ' HD23 ' A' ' 19' ' ' LEU . 35.4 t90 -65.17 -60.47 2.98 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.936 176.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.499 HD11 ' CG ' ' A' ' 28' ' ' PHE . 50.3 mt -48.59 -51.08 29.7 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.103 0.961 . . . . 0.0 112.441 -177.674 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 13' ' ' SER . 59.2 t -66.22 -20.78 27.78 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 CA-C-O 121.044 0.449 . . . . 0.0 110.572 -177.841 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -76.6 -30.33 56.53 Favored Glycine 0 N--CA 1.439 -1.158 0 N-CA-C 111.174 -0.77 . . . . 0.0 111.174 -177.373 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.564 HD23 ' O ' ' A' ' 15' ' ' TRP . 1.0 OUTLIER -102.11 14.11 32.87 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.995 -0.282 . . . . 0.0 110.579 177.197 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.9 m 65.03 37.82 6.57 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-O 121.591 0.71 . . . . 0.0 112.255 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.699 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -109.82 22.31 15.82 Favored 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 127.082 2.153 . . . . 0.0 107.889 176.61 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -53.24 -27.77 23.93 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.321 0.648 . . . . 0.0 112.621 177.456 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.699 ' NE2' ' HA ' ' A' ' 21' ' ' LEU . 3.5 pm0 -66.39 -18.38 65.32 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 175.653 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.42 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 2.5 m-85 -87.45 -21.53 25.49 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.225 178.381 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 90.8 t -57.48 -37.96 60.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 122.508 0.323 . . . . 0.0 110.705 179.046 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 7.2 m -49.66 -36.76 25.87 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 124.81 1.244 . . . . 0.0 111.929 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 19.8 tp10 -106.62 -34.06 7.45 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.507 -178.531 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.499 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.2 m-85 -53.02 -48.14 67.81 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 121.37 0.605 . . . . 0.0 110.811 177.785 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.4 m -76.83 -21.17 55.45 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.385 -177.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.69 -31.82 63.62 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.818 0.342 . . . . 0.0 111.273 -178.105 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.74 7.58 44.96 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 119.78 -0.768 . . . . 0.0 111.94 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 65.24 36.98 6.72 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.68 0.792 . . . . 0.0 110.695 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.49 HG23 ' HB2' ' A' ' 37' ' ' GLN . 45.0 mm -69.04 119.2 14.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 178.467 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 63.1 p -106.33 -172.31 2.06 Favored 'General case' 0 N--CA 1.419 -2.003 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 179.093 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.521 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -64.48 -22.96 68.17 Favored Glycine 0 N--CA 1.447 -0.592 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 177.84 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -60.08 -44.29 94.88 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 123.673 0.789 . . . . 0.0 109.791 177.739 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.49 ' HB2' HG23 ' A' ' 33' ' ' ILE . 0.3 OUTLIER -83.96 -26.25 29.41 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 -177.703 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.434 ' HA ' ' HG ' ' A' ' 41' ' ' LEU . 3.1 tt -62.79 -50.64 70.2 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.007 1.323 . . . . 0.0 110.724 -174.428 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 38.6 mt -62.96 -31.47 72.58 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.161 -177.313 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.41 13.08 34.41 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-N 115.575 -0.738 . . . . 0.0 112.553 -177.139 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.434 ' HG ' ' HA ' ' A' ' 38' ' ' LEU . 48.7 mt -53.49 145.67 14.3 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 177.761 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.418 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 24.5 t70 -142.39 169.04 18.33 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 105.827 -1.916 . . . . 0.0 105.827 179.016 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.495 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -54.03 -36.32 55.97 Favored Glycine 0 CA--C 1.487 -1.705 0 N-CA-C 110.502 -1.039 . . . . 0.0 110.502 176.286 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.467 ' HA ' ' HD3' ' A' ' 47' ' ' LYS . 66.1 t30 -50.67 -51.25 50.99 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-O 121.748 0.785 . . . . 0.0 110.238 178.765 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.466 ' HB3' ' HE3' ' A' ' 45' ' ' LYS . 13.5 mtpp -68.27 -39.8 82.06 Favored 'General case' 0 C--O 1.198 -1.64 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.3 -177.718 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 81.6 mt -62.89 -24.7 67.95 Favored 'General case' 0 C--O 1.254 1.299 0 CA-C-O 121.452 0.644 . . . . 0.0 110.767 179.211 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.858 ' HA ' HG22 ' A' ' 52' ' ' THR . 6.8 mtpm? -80.11 -35.78 36.31 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.067 -0.97 . . . . 0.0 108.931 175.605 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.45 -9.24 58.29 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 123.63 0.772 . . . . 0.0 111.581 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.481 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 2.9 mm? -86.06 -4.49 59.18 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 172.747 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 69.71 -0.07 22.34 Favored Glycine 0 C--N 1.328 0.135 0 CA-C-N 116.088 -0.506 . . . . 0.0 114.11 176.813 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 0.6 OUTLIER -84.37 -43.6 14.57 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 179.212 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.858 HG22 ' HA ' ' A' ' 47' ' ' LYS . 72.0 p 50.39 21.09 0.77 Allowed 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 125.721 1.608 . . . . 0.0 114.406 172.49 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.405 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 30.1 t -73.04 121.92 20.94 Favored 'General case' 0 C--N 1.3 -1.565 0 C-N-CA 122.428 0.291 . . . . 0.0 111.331 -174.605 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.2 m -63.59 -28.74 70.14 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -178.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.93 -54.59 24.36 Favored 'General case' 0 CA--C 1.503 -0.839 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 176.62 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.605 ' O ' HG12 ' A' ' 60' ' ' VAL . 4.6 m-20 -61.13 -45.71 93.55 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.182 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.521 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 12.0 mtm180 -63.51 -17.4 62.73 Favored 'General case' 0 C--O 1.207 -1.152 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.78 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.7 -15.5 30.21 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 121.373 0.606 . . . . 0.0 110.332 177.522 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.531 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 39.3 tp -100.81 -49.06 4.27 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.181 -178.416 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.605 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.5 p -60.62 -25.81 35.98 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.767 0 CA-C-O 121.727 0.775 . . . . 0.0 109.998 179.16 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.521 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 56.8 tptt -71.85 -34.03 68.92 Favored 'General case' 0 C--N 1.295 -1.776 0 CA-C-N 114.246 -1.343 . . . . 0.0 109.701 -172.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 59' ' ' LEU . 21.0 ptmt -87.9 -31.86 19.24 Favored 'General case' 0 N--CA 1.418 -2.061 0 CA-C-N 114.78 -1.1 . . . . 0.0 108.306 -177.847 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.41 ' HG2' HD13 ' A' ' 19' ' ' LEU . 2.6 tppt? -70.98 -44.87 65.06 Favored 'General case' 0 N--CA 1.417 -2.09 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.854 -178.466 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.411 HD22 ' HB2' ' A' ' 41' ' ' LEU . 3.7 pp -59.15 -31.42 68.95 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.959 0.409 . . . . 0.0 111.858 -176.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -87.86 -5.04 58.79 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -177.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 . . . . . 0 C--N 1.312 -1.05 0 C-N-CA 120.268 -0.573 . . . . 0.0 109.685 174.324 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.525 HG12 ' CH2' ' A' ' 7' ' ' TRP . 10.9 m . . . . . 0 N--CA 1.469 0.52 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -69.37 -13.08 62.18 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-O 121.603 0.716 . . . . 0.0 110.75 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -88.95 -12.45 41.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.671 178.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.525 ' CH2' HG12 ' A' ' 4' ' ' VAL . 50.2 m0 -79.12 142.84 36.07 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 -179.525 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 13.1 m -99.83 -72.16 0.67 Allowed 'General case' 0 C--N 1.294 -1.819 0 O-C-N 123.657 0.598 . . . . 0.0 110.374 -178.532 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.534 ' O ' HG12 ' A' ' 12' ' ' VAL . 54.6 t -141.48 -65.76 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.209 -1.076 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 -179.713 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -62.4 -22.86 66.49 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -176.529 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -80.32 -18.47 49.09 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 176.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.534 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.4 p -75.25 -23.0 16.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 179.706 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.442 ' HA ' HD12 ' A' ' 16' ' ' LEU . 1.4 m -76.04 -27.56 57.36 Favored 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.246 -176.95 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 37.2 m80 -63.16 -34.82 78.45 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.475 ' O ' HD23 ' A' ' 19' ' ' LEU . 30.4 t90 -66.38 -62.21 1.59 Allowed 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.483 175.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.505 HD11 ' CG ' ' A' ' 28' ' ' PHE . 56.8 mt -44.83 -50.18 10.4 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.354 1.061 . . . . 0.0 112.946 -177.527 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 99.0 t -62.01 -27.73 42.99 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.277 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.688 -178.052 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.63 -35.44 74.39 Favored Glycine 0 N--CA 1.444 -0.831 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 -177.77 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.475 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -98.55 10.0 41.96 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 -179.305 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.3 m 75.59 19.47 2.06 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 124.206 1.002 . . . . 0.0 112.301 179.529 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.413 ' HG ' ' CD1' ' A' ' 19' ' ' LEU . 1.4 mm? -95.99 19.32 11.75 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.103 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -48.21 -33.56 8.73 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.231 1.412 . . . . 0.0 111.187 173.752 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -62.56 -22.05 66.05 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.77 -1.105 . . . . 0.0 111.124 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.51 ' HD2' HD13 ' A' ' 49' ' ' LEU . 13.4 m-85 -90.77 -20.24 22.59 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.877 -178.209 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 99.0 t -52.84 -37.62 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 C-N-CA 123.055 0.542 . . . . 0.0 111.855 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 29.7 t -57.58 -33.27 67.99 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 122.902 0.481 . . . . 0.0 111.923 -177.288 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.442 ' HG2' ' HA ' ' A' ' 49' ' ' LEU . 19.7 tp10 -106.91 -28.21 10.22 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 121.176 -0.21 . . . . 0.0 110.898 -179.376 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.505 ' CG ' HD11 ' A' ' 16' ' ' LEU . 2.1 m-85 -54.79 -38.76 67.68 Favored 'General case' 0 C--N 1.347 0.476 0 CA-C-O 121.829 0.823 . . . . 0.0 109.462 174.96 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 31.1 p -74.17 -27.56 60.89 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 114.841 -1.072 . . . . 0.0 111.887 -179.081 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.09 -31.95 64.68 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-O 121.166 0.508 . . . . 0.0 110.387 -175.157 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.402 ' HB2' HG12 ' A' ' 33' ' ' ILE . 0.4 OUTLIER -95.16 -1.39 51.95 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 119.815 -0.754 . . . . 0.0 110.41 179.768 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 63.58 38.69 9.45 Favored 'General case' 0 CA--C 1.512 -0.486 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -179.142 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.517 HG23 ' HB2' ' A' ' 37' ' ' GLN . 44.7 mm -65.01 114.75 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.603 -179.094 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.4 p -97.34 -175.53 3.24 Favored 'General case' 0 N--CA 1.407 -2.584 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 176.26 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.49 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -65.25 -21.46 68.31 Favored Glycine 0 N--CA 1.433 -1.533 0 N-CA-C 111.563 -0.615 . . . . 0.0 111.563 178.126 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -65.49 -38.7 90.54 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.618 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.517 ' HB2' HG23 ' A' ' 33' ' ' ILE . 0.2 OUTLIER -84.85 -28.39 26.07 Favored 'General case' 0 CA--C 1.507 -0.685 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 -179.227 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.526 HD12 HG23 ' A' ' 12' ' ' VAL . 2.6 tt -58.56 -51.05 71.54 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 125.196 1.398 . . . . 0.0 109.654 -178.736 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 21.7 mt -57.37 -37.94 73.43 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.366 -178.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -100.48 21.49 13.16 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -177.718 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.485 ' HB2' HD22 ' A' ' 64' ' ' LEU . 27.9 mt -62.37 139.02 58.55 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.116 0.484 . . . . 0.0 111.786 175.253 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.476 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 0.6 OUTLIER -138.95 178.05 7.44 Favored 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 177.656 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.59 -37.93 69.45 Favored Glycine 0 C--O 1.203 -1.815 0 CA-C-O 119.322 -0.71 . . . . 0.0 113.209 178.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -62.35 -41.67 98.77 Favored 'General case' 0 CA--C 1.482 -1.636 0 CA-C-N 117.747 0.774 . . . . 0.0 112.666 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.541 ' O ' ' HG ' ' A' ' 49' ' ' LEU . 16.5 mtpp -66.02 -40.6 91.2 Favored 'General case' 0 C--N 1.31 -1.141 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.087 175.662 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.766 ' HA ' HD12 ' A' ' 49' ' ' LEU . 87.5 mt -63.96 -34.16 77.35 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-O 121.773 0.797 . . . . 0.0 110.548 178.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.676 ' HA ' HG22 ' A' ' 52' ' ' THR . 43.1 mtpt -71.39 -37.1 71.58 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.242 176.634 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.11 3.74 16.65 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.455 0.645 . . . . 0.0 110.87 -179.329 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.766 HD12 ' HA ' ' A' ' 46' ' ' LEU . 72.4 mt -95.94 -0.84 50.26 Favored 'General case' 0 N--CA 1.428 -1.535 0 CA-C-O 121.663 0.744 . . . . 0.0 109.215 176.738 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 81.14 -23.26 4.63 Favored Glycine 0 CA--C 1.501 -0.79 0 CA-C-N 115.271 -0.877 . . . . 0.0 113.58 173.456 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 16.4 mmt -74.97 -55.4 5.8 Favored 'General case' 0 C--N 1.296 -1.742 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 -176.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.676 HG22 ' HA ' ' A' ' 47' ' ' LYS . 14.7 p 60.49 23.37 13.01 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.312 1.045 . . . . 0.0 110.922 174.643 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.8 m -68.38 126.11 28.58 Favored 'General case' 0 N--CA 1.421 -1.877 0 C-N-CA 124.531 1.133 . . . . 0.0 112.426 -173.042 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.9 m -58.98 -40.85 86.09 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.391 1.077 . . . . 0.0 113.398 -175.103 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -55.23 -57.87 10.01 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 122.817 1.294 . . . . 0.0 109.072 177.17 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.765 ' O ' HG12 ' A' ' 60' ' ' VAL . 9.8 m-20 -60.42 -42.53 96.18 Favored 'General case' 0 N--CA 1.415 -2.219 0 CA-C-N 112.462 -2.154 . . . . 0.0 110.961 -174.198 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.5 mmm-85 -52.35 -24.48 7.68 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 177.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -104.08 -36.56 7.67 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-O 120.97 0.414 . . . . 0.0 111.081 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.45 HD12 HD12 ' A' ' 19' ' ' LEU . 2.1 tm? -72.59 -60.67 2.12 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.301 -176.249 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.765 HG12 ' O ' ' A' ' 56' ' ' ASP . 8.2 p -60.63 -25.28 34.42 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.72 0 CA-C-O 121.837 0.827 . . . . 0.0 109.417 -176.882 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -71.02 -25.92 62.88 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.059 -175.203 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.435 ' HA ' ' HE3' ' A' ' 65' ' ' LYS . 58.3 tttm -85.14 -39.56 17.75 Favored 'General case' 0 N--CA 1.424 -1.769 0 CA-C-N 115.428 -0.806 . . . . 0.0 109.057 176.52 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.429 ' HG2' HD13 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -67.06 -40.76 87.13 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.408 -176.086 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.485 HD22 ' HB2' ' A' ' 41' ' ' LEU . 4.1 pp -66.36 -29.02 69.12 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.934 -177.133 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.435 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 22.4 pttp -88.24 -1.87 58.27 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 120.099 -0.64 . . . . 0.0 111.773 -179.558 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 . . . . . 0 C--N 1.313 -1.002 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 176.664 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.504 HG12 ' CH2' ' A' ' 7' ' ' TRP . 4.5 m . . . . . 0 C--O 1.221 -0.406 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 11.1 p-80 -68.34 -15.91 63.74 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.338 0.589 . . . . 0.0 110.895 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -86.48 -11.85 50.61 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.555 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.504 ' CH2' HG12 ' A' ' 4' ' ' VAL . 51.2 m0 -78.8 142.32 37.04 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-O 121.436 0.636 . . . . 0.0 111.132 -176.517 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.98 -80.66 0.33 Allowed 'General case' 0 N--CA 1.417 -2.1 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.104 -178.567 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.48 ' O ' HG12 ' A' ' 12' ' ' VAL . 59.5 t -143.27 -60.76 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.839 0 CA-C-N 113.82 -1.537 . . . . 0.0 108.882 -177.869 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.0 pm0 -74.12 -10.94 60.12 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.296 0.57 . . . . 0.0 112.091 -175.625 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -86.32 -17.46 34.5 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.72 176.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.48 HG12 ' O ' ' A' ' 9' ' ' VAL . 2.5 p -70.66 -24.12 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-O 122.125 0.964 . . . . 0.0 108.979 -178.565 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.489 ' HA ' HD12 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -70.06 -26.24 63.93 Favored 'General case' 0 N--CA 1.418 -2.064 0 CA-C-N 114.425 -1.261 . . . . 0.0 111.31 -176.733 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 29.3 m-70 -63.67 -39.36 94.14 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -177.696 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.495 ' O ' HD23 ' A' ' 19' ' ' LEU . 28.0 t90 -63.93 -55.83 19.67 Favored 'General case' 0 CA--C 1.511 -0.544 0 O-C-N 123.814 0.696 . . . . 0.0 109.743 176.802 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.489 HD12 ' HA ' ' A' ' 13' ' ' SER . 46.4 mt -48.11 -48.71 33.64 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.269 1.028 . . . . 0.0 112.458 -178.213 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 13' ' ' SER . 86.7 t -61.16 -27.08 41.01 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 C-N-CA 122.471 0.308 . . . . 0.0 111.381 -178.797 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.24 -28.73 65.56 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.735 -0.546 . . . . 0.0 111.735 -176.531 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.495 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.9 OUTLIER -106.34 17.95 22.68 Favored 'General case' 0 C--O 1.212 -0.87 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.336 179.114 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.5 t 65.91 29.88 10.12 Favored 'General case' 0 C--O 1.208 -1.111 0 CA-C-O 121.575 0.702 . . . . 0.0 110.55 179.297 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.41 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.7 mm? -107.71 18.79 20.97 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 123.552 0.741 . . . . 0.0 109.989 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -48.91 -32.09 8.39 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.921 0.889 . . . . 0.0 111.444 174.583 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -59.51 -20.67 57.13 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 124.686 1.195 . . . . 0.0 112.014 178.424 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -90.45 -19.9 23.35 Favored 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 179.141 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 92.6 t -53.13 -38.01 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 C-N-CA 122.798 0.439 . . . . 0.0 110.722 179.061 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.1 m -50.63 -29.38 10.86 Favored 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 125.706 1.602 . . . . 0.0 112.881 -179.489 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.581 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 18.3 tp10 -117.49 -30.47 5.52 Favored 'General case' 0 N--CA 1.432 -1.359 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.289 178.347 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.423 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.6 m-85 -54.61 -42.83 71.63 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-O 121.508 0.671 . . . . 0.0 110.938 177.787 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 45.8 m -84.36 -9.44 58.44 Favored 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.87 -178.062 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -83.07 -41.24 18.86 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.674 0.75 . . . . 0.0 110.059 179.606 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.478 ' HG3' HG12 ' A' ' 33' ' ' ILE . 3.7 pt20 -93.21 17.0 11.78 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 59.84 36.57 21.99 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.668 174.022 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.478 HG12 ' HG3' ' A' ' 31' ' ' GLN . 49.6 mm -70.35 118.19 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.087 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 -179.789 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 91.5 p -107.04 -167.74 1.31 Allowed 'General case' 0 N--CA 1.423 -1.797 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 176.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.486 ' O ' ' HG ' ' A' ' 39' ' ' LEU . . . -63.07 -28.43 72.1 Favored Glycine 0 N--CA 1.43 -1.737 0 N-CA-C 110.647 -0.981 . . . . 0.0 110.647 177.666 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -54.64 -46.34 73.93 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.538 0.735 . . . . 0.0 110.112 178.342 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.84 -19.98 23.99 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 120.27 -0.572 . . . . 0.0 112.271 -177.727 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.8 tt -63.94 -48.37 76.79 Favored 'General case' 0 C--N 1.316 -0.882 0 O-C-N 124.536 1.147 . . . . 0.0 108.53 177.353 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 35' ' ' GLY . 21.7 mt -63.68 -37.29 86.78 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.827 -178.791 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.9 20.88 14.59 Favored 'General case' 0 C--N 1.309 -1.161 0 N-CA-C 114.141 1.163 . . . . 0.0 114.141 -177.365 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.1 mt -54.79 153.53 5.98 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 176.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.501 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 14.3 t70 -159.8 161.93 34.68 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 -176.641 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.91 -34.32 61.42 Favored Glycine 0 CA--C 1.49 -1.504 0 O-C-N 123.569 0.543 . . . . 0.0 112.032 178.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -56.72 -43.94 81.13 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-O 121.031 0.443 . . . . 0.0 110.456 176.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.417 ' HE3' ' HB3' ' A' ' 45' ' ' LYS . 12.2 mtpp -68.79 -48.46 63.58 Favored 'General case' 0 C--O 1.193 -1.893 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.82 176.433 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 80.3 mt -54.99 -35.15 64.05 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-O 121.59 0.71 . . . . 0.0 111.451 -178.129 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.742 ' HA ' HG22 ' A' ' 52' ' ' THR . 22.6 mttm -75.57 -35.72 60.55 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.167 176.582 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.32 -12.72 60.93 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.144 0.578 . . . . 0.0 111.35 -179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.581 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.4 mm? -74.88 -8.71 57.28 Favored 'General case' 0 C--O 1.22 -0.5 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 172.003 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 71.35 1.29 42.35 Favored Glycine 0 C--O 1.225 -0.418 0 CA-C-N 115.935 -0.575 . . . . 0.0 112.543 178.05 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.586 ' HG3' ' OG ' ' A' ' 53' ' ' SER . 12.0 tpt -87.67 -49.36 7.2 Favored 'General case' 0 N--CA 1.433 -1.314 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -177.353 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.742 HG22 ' HA ' ' A' ' 47' ' ' LYS . 70.7 p 57.93 10.23 1.1 Allowed 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.783 1.633 . . . . 0.0 114.393 172.616 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.586 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 16.2 m -57.29 118.41 5.07 Favored 'General case' 0 C--N 1.31 -1.135 0 C-N-CA 124.807 1.243 . . . . 0.0 112.22 -175.107 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 p -63.69 -39.93 95.53 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 -172.196 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.25 -32.17 68.41 Favored 'General case' 0 CA--C 1.49 -1.336 0 CA-C-O 122.338 1.066 . . . . 0.0 108.904 -179.11 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.651 ' O ' HG12 ' A' ' 60' ' ' VAL . 17.7 m-20 -74.65 -40.85 61.22 Favored 'General case' 0 N--CA 1.413 -2.282 0 CA-C-N 113.137 -1.847 . . . . 0.0 109.369 -178.285 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.593 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 24.7 mmm-85 -51.43 -36.35 43.42 Favored 'General case' 0 C--O 1.2 -1.519 0 C-N-CA 124.3 1.04 . . . . 0.0 111.132 175.687 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.44 -35.67 27.33 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.035 0.445 . . . . 0.0 111.894 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 30.7 tp -80.23 -43.79 20.83 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 120.306 -0.558 . . . . 0.0 112.216 -174.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.651 HG12 ' O ' ' A' ' 56' ' ' ASP . 9.7 p -65.26 -26.1 38.82 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.737 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.178 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.593 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 55.0 tptt -70.36 -31.98 69.47 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 122.734 1.254 . . . . 0.0 108.896 -175.502 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -80.62 -44.75 18.38 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-N 113.118 -1.856 . . . . 0.0 109.026 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.46 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.3 OUTLIER -72.31 -35.68 68.71 Favored 'General case' 0 N--CA 1.423 -1.824 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.191 -176.776 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.7 pp -70.0 -13.74 62.37 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 -176.421 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -98.84 -5.12 31.65 Favored 'General case' 0 C--N 1.309 -1.167 0 C-N-CA 119.026 -1.069 . . . . 0.0 112.275 175.212 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 . . . . . 0 N--CA 1.478 0.933 0 CA-C-O 122.159 0.98 . . . . 0.0 109.381 -179.754 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.532 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.9 m . . . . . 0 C--O 1.215 -0.728 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.5 p-80 -72.41 -6.39 43.17 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 121.467 0.651 . . . . 0.0 110.941 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -103.08 -7.01 21.69 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.822 178.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.519 ' CH2' HG12 ' A' ' 4' ' ' VAL . 54.2 m0 -79.69 156.59 27.49 Favored 'General case' 0 CA--C 1.473 -1.996 0 CA-C-O 121.821 0.82 . . . . 0.0 111.607 -178.141 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.453 ' H ' ' HB2' ' A' ' 11' ' ' GLN . 7.8 m -111.91 -131.22 0.32 Allowed 'General case' 1 N--CA 1.37 -4.446 0 CA-C-N 113.578 -1.647 . . . . 0.0 106.866 177.037 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.569 ' O ' HG12 ' A' ' 12' ' ' VAL . 59.8 t -95.41 -52.4 9.52 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.991 0 C-N-CA 123.524 0.729 . . . . 0.0 110.628 -170.231 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.406 ' CD ' ' H ' ' A' ' 10' ' ' GLN . 4.7 pm0 -71.18 -19.77 62.37 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 122.36 1.076 . . . . 0.0 109.83 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.453 ' HB2' ' H ' ' A' ' 8' ' ' SER . 29.3 mt-30 -86.03 -19.4 30.36 Favored 'General case' 0 N--CA 1.413 -2.297 0 CA-C-N 114.158 -1.383 . . . . 0.0 111.787 -176.771 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.569 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.3 p -78.54 -20.98 13.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.778 0.799 . . . . 0.0 109.007 -179.373 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.5 ' HA ' HD12 ' A' ' 16' ' ' LEU . 1.8 m -74.94 -23.85 58.39 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.814 -176.125 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -61.34 -36.16 79.41 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-O 120.998 0.428 . . . . 0.0 110.44 -179.03 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.438 ' O ' HD23 ' A' ' 19' ' ' LEU . 31.3 t90 -68.09 -59.3 3.35 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.698 176.226 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.515 HD11 ' CD2' ' A' ' 28' ' ' PHE . 44.9 mt -46.49 -50.61 16.77 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.283 1.033 . . . . 0.0 112.326 -177.505 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 13' ' ' SER . 94.0 t -60.55 -26.09 36.6 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.174 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.308 -178.054 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -70.91 -34.35 65.55 Favored Glycine 0 N--CA 1.449 -0.492 0 CA-C-N 116.413 -0.358 . . . . 0.0 112.332 -178.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.466 ' HG ' ' HB2' ' A' ' 21' ' ' LEU . 0.5 OUTLIER -100.52 15.71 27.09 Favored 'General case' 0 C--N 1.317 -0.841 0 O-C-N 122.731 -0.276 . . . . 0.0 111.357 -179.565 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 43.4 m 70.21 18.34 6.94 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.413 1.085 . . . . 0.0 111.415 -179.369 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.466 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.6 mm? -94.25 18.81 10.31 Favored 'General case' 0 C--N 1.301 -1.537 0 C-N-CA 124.17 0.988 . . . . 0.0 109.422 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.446 ' HB3' HG22 ' A' ' 17' ' ' VAL . 1.1 p30 -51.64 -26.63 9.38 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.341 1.056 . . . . 0.0 111.212 172.513 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -62.51 -26.97 68.82 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 124.098 0.959 . . . . 0.0 111.344 177.238 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.422 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 1.8 m-85 -85.1 -19.85 31.25 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.627 -178.004 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 91.0 t -54.53 -33.35 26.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 122.842 0.457 . . . . 0.0 110.91 178.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 4.4 m -48.61 -39.62 24.58 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.201 1.4 . . . . 0.0 112.266 178.447 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.628 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 15.5 tp10 -108.59 -30.09 8.41 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.33 -177.328 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.515 ' CD2' HD11 ' A' ' 16' ' ' LEU . 2.7 m-85 -54.09 -36.89 63.67 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.356 0.598 . . . . 0.0 110.795 176.019 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.2 p -73.04 -32.28 64.98 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.359 178.846 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.08 -31.16 61.15 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.864 -174.38 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -96.82 0.93 50.09 Favored 'General case' 0 CA--C 1.509 -0.604 0 C-N-CA 119.931 -0.708 . . . . 0.0 110.246 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 62.66 40.1 10.61 Favored 'General case' 0 CA--C 1.509 -0.617 0 O-C-N 123.939 0.774 . . . . 0.0 109.988 179.047 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 43.7 mm -65.61 128.17 27.99 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.131 0 CA-C-N 115.12 -0.945 . . . . 0.0 108.57 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.437 ' H ' ' HG2' ' A' ' 37' ' ' GLN . 74.9 p -120.14 -168.85 1.69 Allowed 'General case' 0 N--CA 1.428 -1.528 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 174.663 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.532 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.09 -29.62 73.28 Favored Glycine 0 CA--C 1.502 -0.781 0 N-CA-C 111.881 -0.487 . . . . 0.0 111.881 -177.849 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -54.47 -47.74 72.6 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 123.252 0.621 . . . . 0.0 109.657 176.183 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.437 ' HG2' ' H ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -87.03 -19.89 27.99 Favored 'General case' 0 C--N 1.312 -1.062 0 C-N-CA 119.535 -0.866 . . . . 0.0 111.52 -177.752 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.405 ' HA ' ' HG ' ' A' ' 41' ' ' LEU . 2.7 tt -67.66 -51.16 53.14 Favored 'General case' 0 CA--C 1.548 0.884 0 O-C-N 124.192 0.932 . . . . 0.0 109.745 -178.399 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 50.8 mt -62.46 -34.57 77.08 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.473 0.654 . . . . 0.0 111.592 -177.398 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.9 24.92 9.27 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.589 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.478 ' HA ' ' HD3' ' A' ' 45' ' ' LYS . 32.6 mt -63.35 153.1 36.1 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.063 173.718 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -157.06 172.81 18.01 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 -177.907 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.426 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -58.8 -40.68 95.38 Favored Glycine 0 C--O 1.204 -1.73 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -51.35 -46.95 62.86 Favored 'General case' 0 CA--C 1.507 -0.705 0 C-N-CA 123.58 0.752 . . . . 0.0 111.539 176.908 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.48 ' O ' HD23 ' A' ' 49' ' ' LEU . 15.0 mtpp -67.02 -44.05 81.29 Favored 'General case' 0 C--O 1.193 -1.894 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.8 176.856 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 98.1 mt -59.55 -27.19 65.99 Favored 'General case' 0 C--O 1.256 1.423 0 CA-C-O 121.704 0.764 . . . . 0.0 111.646 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.654 ' HA ' HG22 ' A' ' 52' ' ' THR . 56.3 mtpt -83.98 -34.37 24.4 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.157 178.079 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.67 -12.67 60.24 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 121.79 0.805 . . . . 0.0 110.263 176.89 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.628 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 3.7 mm? -82.14 2.17 32.72 Favored 'General case' 0 C--O 1.211 -0.949 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.009 173.89 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 63.06 6.04 11.77 Favored Glycine 0 C--N 1.333 0.397 0 CA-C-N 115.7 -0.682 . . . . 0.0 114.446 175.238 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.422 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 6.5 tpt -88.15 -48.73 7.5 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 -177.477 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.654 HG22 ' HA ' ' A' ' 47' ' ' LYS . 81.7 p 53.99 21.26 2.8 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 125.471 1.509 . . . . 0.0 114.618 174.449 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.9 t -66.41 117.65 8.94 Favored 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 123.536 0.734 . . . . 0.0 110.032 -179.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.2 m -67.51 -26.78 66.51 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-O 121.005 0.431 . . . . 0.0 110.449 -177.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -58.14 -53.64 55.96 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 122.11 0.957 . . . . 0.0 108.522 173.664 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.621 ' O ' HG12 ' A' ' 60' ' ' VAL . 67.5 m-20 -71.23 -37.17 72.03 Favored 'General case' 0 N--CA 1.427 -1.596 0 CA-C-N 114.15 -1.386 . . . . 0.0 110.78 -176.476 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -52.76 -27.15 16.58 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.674 0.79 . . . . 0.0 112.768 177.453 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.34 -37.79 13.79 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.973 176.717 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -81.21 -64.4 1.2 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.434 -172.545 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.621 HG12 ' O ' ' A' ' 56' ' ' ASP . 3.4 p -58.9 -23.01 22.77 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.839 0 CA-C-O 121.431 0.634 . . . . 0.0 111.249 -175.268 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -68.05 -33.25 74.22 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.809 -178.811 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt -84.22 -30.87 25.38 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-N 114.882 -1.054 . . . . 0.0 109.727 -178.597 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.428 ' HG2' HD13 ' A' ' 19' ' ' LEU . 1.4 tppt? -77.43 -41.46 39.73 Favored 'General case' 0 C--N 1.298 -1.647 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.041 -177.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.41 HD22 ' CB ' ' A' ' 41' ' ' LEU . 3.9 pp -61.89 -32.67 73.06 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.02 0.438 . . . . 0.0 112.049 -175.933 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -76.77 -28.14 55.58 Favored 'General case' 0 C--N 1.31 -1.113 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.098 -178.34 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 . . . . . 0 C--N 1.322 -0.614 0 CA-C-O 121.34 0.59 . . . . 0.0 110.195 -178.373 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.578 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.1 m . . . . . 0 N--CA 1.444 -0.758 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.0 p-80 -68.65 -12.05 60.88 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-O 121.272 0.558 . . . . 0.0 111.154 176.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -97.88 -0.3 45.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.127 178.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.523 ' O ' ' HB2' ' A' ' 34' ' ' SER . 52.2 m0 -82.31 143.77 31.06 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.983 -179.114 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.5 m -99.63 -73.74 0.62 Allowed 'General case' 0 N--CA 1.428 -1.538 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.355 -175.012 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.431 ' O ' HG12 ' A' ' 12' ' ' VAL . 98.4 t -143.44 -65.48 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.198 -1.615 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.483 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 -59.74 -27.24 66.33 Favored 'General case' 0 C--N 1.312 -1.024 0 C-N-CA 124.076 0.951 . . . . 0.0 112.465 -177.552 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -72.6 -18.88 61.56 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.881 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.466 HG23 HD12 ' A' ' 38' ' ' LEU . 0.8 OUTLIER -78.83 -28.14 13.93 Favored 'Isoleucine or valine' 0 C--O 1.243 0.731 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -178.179 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.521 ' O ' HG23 ' A' ' 17' ' ' VAL . 1.2 m -67.88 -34.5 76.77 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.359 -176.599 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 23.5 m170 -59.13 -36.41 75.15 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.737 0.648 . . . . 0.0 109.631 -179.653 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.443 ' CH2' HG23 ' A' ' 60' ' ' VAL . 25.0 t90 -67.18 -59.04 3.78 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.74 176.626 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.445 HD12 ' HA ' ' A' ' 13' ' ' SER . 31.4 mt -47.3 -48.82 24.88 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 124.441 1.088 . . . . 0.0 112.218 -177.85 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 13' ' ' SER . 64.9 t -61.2 -25.82 37.44 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.014 0 CA-C-O 120.882 0.373 . . . . 0.0 111.198 -178.062 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.76 -28.63 64.7 Favored Glycine 0 CA--C 1.505 -0.567 0 N-CA-C 111.754 -0.539 . . . . 0.0 111.754 -176.723 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.453 HD23 ' H ' ' A' ' 19' ' ' LEU . 1.2 pt? -105.78 16.02 25.87 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.223 178.603 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.8 m 66.59 21.69 10.65 Favored 'General case' 0 C--O 1.206 -1.197 0 C-N-CA 123.825 0.85 . . . . 0.0 112.318 -179.421 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.406 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 2.1 mm? -95.98 19.98 10.74 Favored 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 123.795 0.838 . . . . 0.0 109.129 178.384 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.45 ' HA ' HG23 ' A' ' 25' ' ' VAL . 7.6 p-10 -55.22 -20.66 11.42 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.091 0.956 . . . . 0.0 111.399 175.883 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -69.14 -22.17 63.96 Favored 'General case' 0 C--N 1.305 -1.353 0 C-N-CA 124.065 0.946 . . . . 0.0 111.033 177.525 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.534 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 2.6 m-85 -87.5 -20.65 26.23 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.384 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.45 HG23 ' HA ' ' A' ' 22' ' ' ASP . 93.6 t -52.14 -38.18 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -179.365 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 36.7 t -54.01 -41.19 67.71 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 123.455 0.472 . . . . 0.0 111.168 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.533 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 13.1 tp10 -96.56 -31.31 12.83 Favored 'General case' 0 N--CA 1.44 -0.961 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.264 -177.279 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.43 ' CG ' HD11 ' A' ' 16' ' ' LEU . 2.7 m-85 -55.91 -39.86 72.23 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.197 0.522 . . . . 0.0 110.438 175.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.4 m -71.83 -30.78 65.84 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.336 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.11 -35.75 71.91 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.681 -175.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -98.27 2.72 48.49 Favored 'General case' 0 C--N 1.313 -1.012 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.91 -178.799 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 62.66 37.56 12.74 Favored 'General case' 0 CA--C 1.504 -0.792 0 C-N-CA 123.383 0.673 . . . . 0.0 109.553 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.7 mm -67.45 110.69 1.85 Allowed 'Isoleucine or valine' 0 N--CA 1.434 -1.246 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.523 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 84.7 p -99.3 -169.79 1.81 Allowed 'General case' 0 N--CA 1.421 -1.886 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.584 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.578 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -66.69 -23.19 72.23 Favored Glycine 0 N--CA 1.436 -1.346 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 179.216 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.53 -46.34 89.16 Favored 'General case' 0 N--CA 1.442 -0.828 0 C-N-CA 124.09 0.956 . . . . 0.0 109.546 178.243 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.421 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -88.76 -19.97 25.36 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.6 -179.802 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.466 HD12 HG23 ' A' ' 12' ' ' VAL . 2.8 tt -62.78 -50.39 71.23 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 124.492 1.117 . . . . 0.0 108.927 178.151 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.0 mt -58.71 -41.53 86.58 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.13 -177.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -97.07 16.17 20.39 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.443 -175.821 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.478 ' HB2' HD22 ' A' ' 64' ' ' LEU . 34.1 mt -57.42 154.59 10.59 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.69 0.757 . . . . 0.0 112.556 176.738 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -159.9 168.17 26.38 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -50.78 -40.09 40.69 Favored Glycine 0 C--O 1.204 -1.75 0 O-C-N 123.95 0.781 . . . . 0.0 111.739 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -51.99 -49.02 64.11 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 178.117 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.439 ' O ' HD23 ' A' ' 49' ' ' LEU . 12.8 mtpp -67.99 -46.86 70.12 Favored 'General case' 0 C--O 1.196 -1.724 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.259 177.577 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 74.1 mt -59.27 -26.49 64.98 Favored 'General case' 0 C--O 1.255 1.381 0 C-N-CA 123.554 0.742 . . . . 0.0 112.271 -177.67 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.74 ' HA ' HG22 ' A' ' 52' ' ' THR . 57.0 mtpt -79.5 -37.23 37.21 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.735 175.596 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.98 -9.88 59.2 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.532 0.682 . . . . 0.0 110.682 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.533 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.2 mm? -82.24 0.6 40.53 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.423 -0.808 . . . . 0.0 108.987 173.792 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 67.78 4.12 31.71 Favored Glycine 0 C--O 1.224 -0.484 0 N-CA-C 114.607 0.603 . . . . 0.0 114.607 174.549 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.534 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 14.5 tpt -94.76 -48.86 5.86 Favored 'General case' 0 C--N 1.311 -1.108 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.343 -178.862 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.74 HG22 ' HA ' ' A' ' 47' ' ' LYS . 62.3 p 59.38 2.9 0.34 Allowed 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 126.489 1.916 . . . . 0.0 115.471 174.296 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.503 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 20.3 m -55.35 123.52 14.11 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 125.191 1.397 . . . . 0.0 113.705 -174.073 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.8 t -61.76 -48.02 82.57 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 -173.184 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.0 pp0? -64.81 -38.35 90.69 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 122.135 0.969 . . . . 0.0 108.576 -176.242 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.63 ' O ' HG12 ' A' ' 60' ' ' VAL . 7.5 m-20 -70.24 -47.24 62.21 Favored 'General case' 0 N--CA 1.42 -1.934 0 CA-C-N 113.458 -1.701 . . . . 0.0 109.553 -174.086 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.527 ' HA ' HG12 ' A' ' 60' ' ' VAL . 44.2 mtm180 -68.28 -11.98 60.31 Favored 'General case' 0 C--O 1.213 -0.829 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 179.26 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.69 -30.04 19.42 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 174.108 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 36.9 tp -86.38 -44.99 11.61 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.478 -176.209 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.63 HG12 ' O ' ' A' ' 56' ' ' ASP . 5.0 p -61.62 -26.59 40.07 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.134 0 CA-C-O 121.405 0.622 . . . . 0.0 109.538 177.583 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 54.1 tptt -74.4 -27.0 60.44 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.135 -174.736 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -82.22 -45.87 14.48 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 113.827 -1.533 . . . . 0.0 108.478 177.961 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.407 ' HE3' ' CB ' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -67.01 -42.16 85.43 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.513 -175.613 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.478 HD22 ' HB2' ' A' ' 41' ' ' LEU . 3.7 pp -62.9 -30.6 71.66 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -177.234 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.3 ptmm? -87.13 -11.12 51.01 Favored 'General case' 0 C--N 1.309 -1.165 0 C-N-CA 118.927 -1.109 . . . . 0.0 111.68 -177.255 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 . . . . . 0 C--N 1.315 -0.932 0 C-N-CA 120.939 -0.304 . . . . 0.0 110.313 -179.985 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.541 ' HA ' ' CD2' ' A' ' 7' ' ' TRP . 3.9 m . . . . . 0 C--O 1.219 -0.516 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.2 p-80 -74.19 -9.77 58.95 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-O 121.179 0.514 . . . . 0.0 111.494 -178.208 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -90.42 -9.82 46.12 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 178.301 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.541 ' CD2' ' HA ' ' A' ' 4' ' ' VAL . 48.3 m0 -84.0 135.37 34.47 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.237 -177.047 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.433 ' O ' ' HB3' ' A' ' 34' ' ' SER . 16.1 m -93.3 -69.63 0.74 Allowed 'General case' 0 C--N 1.298 -1.631 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.638 -178.339 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.54 ' O ' HG12 ' A' ' 12' ' ' VAL . 61.4 t -143.81 -62.33 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 -179.748 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.35 -37.47 48.05 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 124.667 1.187 . . . . 0.0 111.952 179.217 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -78.57 -20.07 51.41 Favored 'General case' 0 N--CA 1.435 -1.177 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -174.505 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.54 HG12 ' O ' ' A' ' 9' ' ' VAL . 2.6 p -70.88 -22.36 23.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 CA-C-O 121.707 0.765 . . . . 0.0 109.218 -178.526 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.492 ' O ' HG23 ' A' ' 17' ' ' VAL . 1.4 m -73.76 -26.49 60.69 Favored 'General case' 0 N--CA 1.423 -1.807 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.363 -176.159 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 33.1 m170 -60.48 -42.33 96.05 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 123.414 0.446 . . . . 0.0 110.142 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.486 ' O ' HD23 ' A' ' 19' ' ' LEU . 36.0 t90 -63.13 -59.21 5.07 Favored 'General case' 0 N--CA 1.442 -0.831 0 O-C-N 123.825 0.703 . . . . 0.0 109.749 177.329 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.428 HD11 ' CD2' ' A' ' 28' ' ' PHE . 43.9 mt -47.53 -51.21 21.46 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 124.43 1.081 . . . . 0.0 112.266 -178.0 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 13' ' ' SER . 78.1 t -61.92 -26.86 41.09 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 CA-C-O 120.822 0.344 . . . . 0.0 111.219 -177.95 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -71.13 -29.2 69.04 Favored Glycine 0 C--O 1.223 -0.544 0 N-CA-C 111.945 -0.462 . . . . 0.0 111.945 -177.771 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.488 HD13 ' CB ' ' A' ' 63' ' ' LYS . 0.5 OUTLIER -104.96 16.16 26.43 Favored 'General case' 0 C--N 1.314 -0.94 0 O-C-N 122.334 -0.51 . . . . 0.0 111.04 177.649 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 62.5 m 62.65 34.3 15.02 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 122.326 1.06 . . . . 0.0 111.497 -178.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.418 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 0.9 OUTLIER -104.02 17.14 24.72 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 125.105 1.362 . . . . 0.0 108.552 176.792 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -54.96 -25.41 29.47 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.561 178.44 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.36 -20.31 63.84 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 119.996 -0.682 . . . . 0.0 111.853 177.126 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.423 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 3.8 m-85 -82.08 -19.49 40.11 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.153 -179.694 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 97.7 t -56.05 -36.32 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 O-C-N 123.212 0.32 . . . . 0.0 110.506 177.748 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 39.0 t -50.37 -38.75 44.05 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.246 1.018 . . . . 0.0 111.573 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.655 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 19.0 tp10 -105.12 -32.71 8.56 Favored 'General case' 0 C--N 1.312 -1.058 0 O-C-N 121.962 -0.461 . . . . 0.0 110.917 -178.943 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.428 ' CD2' HD11 ' A' ' 16' ' ' LEU . 2.1 m-85 -55.17 -40.6 70.86 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-O 121.72 0.771 . . . . 0.0 110.3 176.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 33.8 t -79.03 -21.81 46.37 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.52 -178.07 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.47 -38.41 62.93 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.0 0.429 . . . . 0.0 110.654 -177.512 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -101.35 16.35 25.85 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 -179.859 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 59.03 39.56 23.26 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 121.194 0.521 . . . . 0.0 111.362 174.703 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.529 HG23 ' HB2' ' A' ' 37' ' ' GLN . 49.9 mm -71.44 111.43 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.385 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.473 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.433 ' HB3' ' O ' ' A' ' 8' ' ' SER . 65.9 p -105.81 -169.85 1.65 Allowed 'General case' 0 N--CA 1.418 -2.051 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.948 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.496 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.14 -25.8 66.82 Favored Glycine 0 N--CA 1.436 -1.303 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.695 176.861 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -59.78 -36.74 77.3 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 123.379 0.672 . . . . 0.0 109.621 179.083 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.529 ' HB2' HG23 ' A' ' 33' ' ' ILE . 0.9 OUTLIER -89.96 -40.08 12.58 Favored 'General case' 0 C--O 1.215 -0.747 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.326 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.517 HD12 HG23 ' A' ' 12' ' ' VAL . 3.4 tt -49.7 -48.69 49.63 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.971 1.708 . . . . 0.0 111.268 -174.807 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 29.5 mt -61.96 -40.73 96.57 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.018 -177.224 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.14 11.37 36.52 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -176.064 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.435 ' HG ' ' HA ' ' A' ' 38' ' ' LEU . 46.8 mt -53.86 150.29 7.77 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 121.446 0.641 . . . . 0.0 112.618 178.427 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.431 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 25.8 t70 -153.82 179.51 8.8 Favored 'General case' 0 C--N 1.295 -1.793 0 N-CA-C 105.707 -1.96 . . . . 0.0 105.707 178.187 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -60.92 -35.98 91.37 Favored Glycine 0 CA--C 1.488 -1.655 0 N-CA-C 110.971 -0.852 . . . . 0.0 110.971 -179.552 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -52.93 -47.66 67.86 Favored 'General case' 0 CA--C 1.498 -1.036 0 C-N-CA 123.322 0.649 . . . . 0.0 111.453 177.776 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.431 ' HD3' HD23 ' A' ' 41' ' ' LEU . 13.4 mtpp -68.82 -44.04 74.32 Favored 'General case' 0 C--O 1.192 -1.962 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.063 177.176 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 90.0 mt -58.58 -31.0 67.61 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-O 121.702 0.763 . . . . 0.0 111.392 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.733 ' HA ' HG22 ' A' ' 52' ' ' THR . 74.1 mttt -77.71 -26.55 50.18 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.897 177.845 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.21 -5.48 58.53 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-O 121.691 0.758 . . . . 0.0 110.215 178.193 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.655 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.5 mm? -83.97 -5.49 59.23 Favored 'General case' 0 C--O 1.203 -1.371 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 172.768 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.21 -7.29 8.27 Favored Glycine 0 C--O 1.222 -0.626 0 CA-C-N 116.114 -0.494 . . . . 0.0 113.534 176.158 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.423 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 14.1 tpt -81.08 -50.42 9.66 Favored 'General case' 0 N--CA 1.432 -1.364 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 -177.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.733 HG22 ' HA ' ' A' ' 47' ' ' LYS . 80.5 p 57.3 14.37 2.1 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.422 1.489 . . . . 0.0 114.507 173.531 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.404 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 70.9 m -63.26 129.2 39.27 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 123.801 0.84 . . . . 0.0 112.238 -174.818 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.8 t -61.15 -47.28 86.94 Favored 'General case' 0 C--O 1.241 0.631 0 C-N-CA 124.59 1.156 . . . . 0.0 112.81 -172.749 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -54.22 -55.48 27.61 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 122.234 1.016 . . . . 0.0 108.983 177.861 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.771 ' O ' HG12 ' A' ' 60' ' ' VAL . 4.5 m-20 -60.16 -45.89 91.54 Favored 'General case' 0 N--CA 1.417 -2.121 0 CA-C-N 113.161 -1.836 . . . . 0.0 109.425 -175.797 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -48.52 -34.13 10.76 Favored 'General case' 0 CA--C 1.507 -0.71 0 C-N-CA 124.411 1.084 . . . . 0.0 112.958 178.688 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -94.47 -40.34 9.94 Favored 'General case' 0 C--N 1.306 -1.314 0 O-C-N 123.714 0.634 . . . . 0.0 110.873 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.7 tp -68.81 -51.99 34.93 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -175.126 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.771 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.5 p -67.2 -21.84 28.48 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.249 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.9 tmtt? -70.8 -30.34 66.78 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -178.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.659 ' O ' ' HG2' ' A' ' 65' ' ' LYS . 85.8 tttt -83.17 -42.13 17.67 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 114.447 -1.252 . . . . 0.0 109.134 179.368 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.488 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -69.54 -28.5 66.07 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.399 -179.396 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.9 pp -79.88 -16.71 54.83 Favored 'General case' 0 C--O 1.204 -1.311 0 CA-C-O 120.971 0.415 . . . . 0.0 111.198 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.659 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 14.5 ptmm? -82.65 -17.07 45.91 Favored 'General case' 0 C--N 1.295 -1.8 0 C-N-CA 118.026 -1.47 . . . . 0.0 109.201 175.665 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 . . . . . 0 N--CA 1.439 -0.986 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.913 -179.925 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.535 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 17.2 m . . . . . 0 C--O 1.21 -0.974 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 11.3 p-80 -73.36 -11.51 60.51 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-O 121.533 0.682 . . . . 0.0 110.749 -178.715 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -95.42 1.46 54.17 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.133 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.505 ' CH2' HG12 ' A' ' 4' ' ' VAL . 54.5 m0 -85.64 139.85 31.05 Favored 'General case' 0 CA--C 1.492 -1.259 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 176.959 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.2 m -94.18 -77.48 0.46 Allowed 'General case' 0 N--CA 1.419 -1.991 0 O-C-N 123.698 0.624 . . . . 0.0 110.701 -177.056 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.488 ' O ' HG12 ' A' ' 12' ' ' VAL . 55.2 t -141.43 -54.23 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-O 121.601 0.715 . . . . 0.0 109.661 -176.415 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.1 pm0 -77.31 -14.9 59.65 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.644 -178.764 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -83.57 -19.55 35.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.211 179.36 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.9 p -72.63 -25.39 22.56 Favored 'Isoleucine or valine' 0 C--O 1.242 0.671 0 CA-C-O 121.851 0.834 . . . . 0.0 109.489 -177.627 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.07 -29.21 65.02 Favored 'General case' 0 N--CA 1.427 -1.623 0 CA-C-N 115.012 -0.994 . . . . 0.0 111.397 -175.497 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 33.4 m80 -59.91 -36.9 77.96 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 121.417 0.627 . . . . 0.0 109.77 -178.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.502 ' O ' HD23 ' A' ' 19' ' ' LEU . 32.6 t90 -68.04 -59.65 3.09 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.123 177.448 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.457 HD11 ' CD2' ' A' ' 28' ' ' PHE . 44.1 mt -48.22 -51.01 27.27 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.103 0.961 . . . . 0.0 112.231 -177.688 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 90.7 t -60.35 -24.54 31.32 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.959 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.317 -178.641 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.88 -37.67 50.38 Favored Glycine 0 N--CA 1.441 -1.02 0 N-CA-C 111.413 -0.675 . . . . 0.0 111.413 -177.294 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.502 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.9 OUTLIER -98.13 18.18 16.78 Favored 'General case' 0 C--N 1.32 -0.704 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.672 -179.844 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.8 m 67.89 23.52 8.34 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-O 122.151 0.977 . . . . 0.0 111.466 179.109 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.429 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.3 mm? -99.94 20.06 15.04 Favored 'General case' 0 C--N 1.299 -1.611 0 C-N-CA 124.321 1.048 . . . . 0.0 109.538 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.413 ' HA ' HG23 ' A' ' 25' ' ' VAL . 9.5 p-10 -53.08 -27.0 18.13 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.422 1.089 . . . . 0.0 110.373 174.644 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -61.46 -21.8 64.49 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 125.414 1.486 . . . . 0.0 111.374 178.207 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.597 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 5.3 m-85 -93.35 -21.02 19.8 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 116.031 -0.532 . . . . 0.0 112.152 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.413 HG23 ' HA ' ' A' ' 22' ' ' ASP . 98.4 t -53.14 -39.53 34.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 O-C-N 123.346 0.404 . . . . 0.0 111.843 -179.389 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.2 m -52.46 -38.29 58.98 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 123.76 0.663 . . . . 0.0 112.1 -177.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.471 ' HG3' HD13 ' A' ' 49' ' ' LEU . 15.3 tp10 -103.93 -30.04 10.57 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.565 -177.43 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.457 ' CD2' HD11 ' A' ' 16' ' ' LEU . 1.7 m-85 -56.99 -47.55 80.56 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-O 121.529 0.68 . . . . 0.0 110.541 177.062 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.1 m -81.3 -5.26 57.62 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.351 -178.082 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -87.85 -41.21 13.39 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.747 178.294 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -91.5 8.16 37.82 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 120.088 -0.645 . . . . 0.0 110.793 -177.637 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 64.89 38.06 6.73 Favored 'General case' 0 CA--C 1.507 -0.7 0 O-C-N 124.045 0.841 . . . . 0.0 109.168 179.166 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 49.0 mm -71.64 109.52 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.311 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 -179.622 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.433 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 97.1 p -103.94 -167.22 1.34 Allowed 'General case' 0 N--CA 1.432 -1.367 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.574 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.535 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -63.82 -24.62 68.43 Favored Glycine 0 N--CA 1.436 -1.353 0 N-CA-C 111.685 -0.566 . . . . 0.0 111.685 178.697 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -60.27 -43.43 96.22 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 177.867 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.6 -17.74 25.11 Favored 'General case' 0 N--CA 1.436 -1.132 0 C-N-CA 119.921 -0.711 . . . . 0.0 112.489 179.506 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.442 HD12 HG23 ' A' ' 12' ' ' VAL . 4.2 tt -66.34 -49.99 65.1 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 124.18 0.992 . . . . 0.0 109.48 179.085 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.9 mt -63.9 -34.6 78.33 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.223 0.535 . . . . 0.0 112.0 -177.408 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.47 15.1 29.01 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -177.099 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.455 ' HB2' HD22 ' A' ' 64' ' ' LEU . 40.8 mt -53.11 152.17 4.42 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-O 121.759 0.79 . . . . 0.0 112.976 177.311 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -155.35 167.48 30.23 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 105.666 -1.975 . . . . 0.0 105.666 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.533 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -54.17 -38.8 62.19 Favored Glycine 0 CA--C 1.493 -1.339 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 177.873 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -50.9 -49.19 59.95 Favored 'General case' 0 CA--C 1.503 -0.844 0 C-N-CA 123.244 0.618 . . . . 0.0 111.843 178.66 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.434 ' HD3' HD23 ' A' ' 41' ' ' LEU . 13.2 mtpp -64.67 -46.48 82.26 Favored 'General case' 0 C--O 1.196 -1.762 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.119 178.448 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 93.3 mt -57.22 -35.41 69.63 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-O 121.735 0.779 . . . . 0.0 111.272 -179.106 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.686 ' HA ' HG22 ' A' ' 52' ' ' THR . 55.5 mtpt -71.48 -35.12 70.71 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.315 178.14 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.6 -8.73 58.93 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.254 0.55 . . . . 0.0 110.864 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.471 HD13 ' HG3' ' A' ' 27' ' ' GLU . 4.0 mm? -85.26 -2.51 58.13 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.76 0.791 . . . . 0.0 108.963 174.144 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.84 0.84 57.19 Favored Glycine 0 N--CA 1.445 -0.76 0 CA-C-N 115.202 -0.908 . . . . 0.0 114.846 174.191 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.597 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 16.7 tpt -83.65 -56.11 3.9 Favored 'General case' 0 CA--C 1.492 -1.277 0 C-N-CA 119.359 -0.937 . . . . 0.0 109.84 -178.526 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.686 HG22 ' HA ' ' A' ' 47' ' ' LYS . 76.7 p 53.02 40.73 31.67 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.086 0.954 . . . . 0.0 111.991 175.246 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.605 ' HB3' ' OD1' ' A' ' 56' ' ' ASP . 32.6 t -75.88 -179.77 5.04 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 177.116 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.3 m -107.74 -23.23 12.18 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 174.772 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -69.52 -42.6 74.47 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.857 -178.722 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.654 ' O ' HG12 ' A' ' 60' ' ' VAL . 8.9 p-10 -75.14 -41.38 58.44 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.065 -175.042 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 54.5 mmm-85 -55.55 -19.8 11.19 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.958 0.903 . . . . 0.0 112.357 -176.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -101.19 -35.85 9.15 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.082 175.712 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 30.6 tp -84.01 -53.97 5.18 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 -174.051 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.654 HG12 ' O ' ' A' ' 56' ' ' ASP . 8.1 p -64.28 -24.41 35.61 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.239 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -178.693 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -69.53 -30.11 67.86 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 114.423 -1.262 . . . . 0.0 108.906 -176.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.41 ' NZ ' ' HB2' ' A' ' 62' ' ' LYS . 3.8 ttmp? -86.49 -38.52 17.18 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-N 114.026 -1.443 . . . . 0.0 109.353 -178.751 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.421 ' HG2' HD13 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -71.47 -41.5 69.29 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 114.954 -1.021 . . . . 0.0 111.382 -177.508 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.455 HD22 ' HB2' ' A' ' 41' ' ' LEU . 3.6 pp -63.49 -31.5 72.69 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.996 -175.551 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -78.84 -26.91 44.15 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 119.841 -0.743 . . . . 0.0 111.644 -177.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 . . . . . 0 N--CA 1.444 -0.772 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.037 -177.468 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.615 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 43.5 p-80 -152.83 11.27 0.49 Allowed 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 5.0 mpp? -80.41 161.1 25.12 Favored 'General case' 0 N--CA 1.421 -1.895 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.597 -172.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.482 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 2.7 m -74.64 -29.66 23.77 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.959 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -169.037 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -70.58 -7.72 46.12 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.751 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -101.85 -7.83 22.16 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.203 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.426 ' CH2' HG12 ' A' ' 4' ' ' VAL . 53.5 m0 -71.28 144.59 49.94 Favored 'General case' 0 CA--C 1.501 -0.92 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.1 m -94.84 -71.73 0.65 Allowed 'General case' 0 N--CA 1.419 -1.98 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.615 -173.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 74.9 t -146.08 -68.13 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.203 -1.376 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.2 pm0 -63.76 -20.82 66.05 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.914 -0.585 . . . . 0.0 112.445 -175.018 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.5 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 91.9 mt-30 -77.71 -13.31 59.94 Favored 'General case' 0 C--O 1.217 -0.61 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.402 HG23 HD12 ' A' ' 38' ' ' LEU . 1.1 p -77.16 -19.58 14.36 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.379 0 CA-C-O 121.393 0.616 . . . . 0.0 109.48 178.275 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 83.3 p -70.81 -39.25 73.17 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.948 -175.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' HIS . . . . . 0.5 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 42.5 m-70 -50.37 -36.58 33.15 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 114.392 -1.276 . . . . 0.0 110.92 -179.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.489 ' CH2' HG23 ' A' ' 60' ' ' VAL . 24.7 t90 -71.15 -61.85 1.61 Allowed 'General case' 0 N--CA 1.423 -1.788 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.784 175.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.437 HD11 ' CD2' ' A' ' 28' ' ' PHE . 44.5 mt -46.68 -49.07 19.9 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.474 1.11 . . . . 0.0 112.419 -177.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 99.5 t -59.35 -29.53 42.19 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.321 0 C-N-CA 122.74 0.416 . . . . 0.0 111.176 -179.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -72.39 -27.37 69.87 Favored Glycine 0 N--CA 1.447 -0.621 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.179 -176.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.462 HD23 ' O ' ' A' ' 15' ' ' TRP . 1.2 pt? -106.94 15.51 25.3 Favored 'General case' 0 C--N 1.317 -0.847 0 O-C-N 122.586 -0.361 . . . . 0.0 111.064 179.126 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.3 t 74.46 16.42 3.28 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-O 122.178 0.989 . . . . 0.0 111.523 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -93.95 17.85 11.56 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 114.914 -1.039 . . . . 0.0 109.629 -177.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.429 ' HA ' HG23 ' A' ' 25' ' ' VAL . 13.3 t70 -50.94 -30.79 15.79 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-O 121.538 0.685 . . . . 0.0 111.196 174.472 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -59.54 -25.74 64.78 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 124.593 1.157 . . . . 0.0 110.834 178.245 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.411 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 14.3 m-85 -88.7 -21.96 23.63 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.774 -178.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.429 HG23 ' HA ' ' A' ' 22' ' ' ASP . 57.7 t -55.85 -35.09 38.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 122.665 0.386 . . . . 0.0 111.338 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.8 m -57.32 -30.05 64.44 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 123.815 0.846 . . . . 0.0 111.879 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.601 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 21.1 tp10 -109.55 -35.99 6.08 Favored 'General case' 0 N--CA 1.431 -1.377 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.416 -178.436 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.437 ' CD2' HD11 ' A' ' 16' ' ' LEU . 1.9 m-85 -53.67 -43.44 68.87 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-O 121.411 0.624 . . . . 0.0 110.795 177.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.7 m -77.07 -23.04 52.0 Favored 'General case' 0 N--CA 1.44 -0.972 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.718 -177.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.87 -39.48 69.62 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.624 -178.119 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.32 9.33 40.26 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.288 -178.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 61.63 42.2 11.31 Favored 'General case' 0 C--O 1.234 0.271 0 O-C-N 123.611 0.569 . . . . 0.0 110.453 177.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.9 mm -72.18 114.25 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.013 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 90.2 p -107.37 -167.85 1.32 Allowed 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 178.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.482 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.17 -27.74 69.56 Favored Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 111.311 -0.716 . . . . 0.0 111.311 178.181 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -55.34 -42.75 74.24 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.044 0.937 . . . . 0.0 110.224 178.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.562 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -94.61 -24.74 17.08 Favored 'General case' 0 N--CA 1.433 -1.286 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.218 -179.271 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.402 HD12 HG23 ' A' ' 12' ' ' VAL . 3.4 tt -57.2 -52.73 64.14 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.868 1.267 . . . . 0.0 109.605 177.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.8 mt -62.58 -38.71 91.17 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -175.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.88 10.55 41.12 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -175.058 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.62 ' HB2' HD22 ' A' ' 64' ' ' LEU . 40.5 mt -50.71 135.1 24.03 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 178.634 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -134.21 179.48 6.24 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 176.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.67 -42.76 85.74 Favored Glycine 0 C--O 1.204 -1.764 0 CA-C-O 119.238 -0.757 . . . . 0.0 112.699 -179.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -55.33 -43.33 74.85 Favored 'General case' 0 CA--C 1.488 -1.409 0 CA-C-N 117.459 0.629 . . . . 0.0 111.873 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.6 mtpp -65.23 -49.5 69.42 Favored 'General case' 0 C--O 1.196 -1.754 0 O-C-N 123.763 0.665 . . . . 0.0 110.817 176.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 91.1 mt -60.0 -30.95 69.48 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.848 0.833 . . . . 0.0 111.391 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.714 ' HA ' HG22 ' A' ' 52' ' ' THR . 58.7 mtpt -77.68 -30.24 51.84 Favored 'General case' 0 N--CA 1.426 -1.659 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.127 177.339 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.38 -4.32 47.63 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.224 0.535 . . . . 0.0 111.267 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.601 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.3 mm? -84.94 -7.56 59.11 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 171.191 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.85 -1.26 39.95 Favored Glycine 0 C--O 1.223 -0.578 0 CA-C-N 115.879 -0.601 . . . . 0.0 113.719 176.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.411 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 15.3 tpt -85.32 -50.18 7.55 Favored 'General case' 0 C--N 1.307 -1.239 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 -178.658 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.714 HG22 ' HA ' ' A' ' 47' ' ' LYS . 74.8 p 52.88 31.72 11.24 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 123.995 0.918 . . . . 0.0 112.168 174.311 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.2 t -73.08 129.76 38.79 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.768 -175.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.6 t -53.66 -54.86 31.78 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 125.061 1.344 . . . . 0.0 113.118 -176.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -50.65 -55.88 14.4 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-O 122.513 1.149 . . . . 0.0 109.914 177.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.788 ' O ' HG12 ' A' ' 60' ' ' VAL . 6.3 m-20 -62.0 -42.16 98.85 Favored 'General case' 0 N--CA 1.412 -2.345 0 CA-C-N 113.055 -1.884 . . . . 0.0 111.105 -173.188 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -52.79 -25.64 11.95 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 177.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -101.35 -38.47 8.03 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-O 120.879 0.371 . . . . 0.0 110.985 176.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 56.0 tp -72.67 -55.2 7.18 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -174.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.788 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.4 p -59.88 -26.4 35.47 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.032 0 CA-C-O 121.637 0.732 . . . . 0.0 109.16 -179.249 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.416 ' HA ' ' CD2' ' A' ' 64' ' ' LEU . 55.9 tptt -72.01 -28.92 63.71 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 113.655 -1.612 . . . . 0.0 110.16 -172.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -84.44 -40.21 18.03 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 114.73 -1.123 . . . . 0.0 108.655 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.401 ' HG2' HD13 ' A' ' 19' ' ' LEU . 3.0 tppt? -69.43 -42.46 74.94 Favored 'General case' 0 C--N 1.297 -1.686 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.201 -175.413 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.62 HD22 ' HB2' ' A' ' 41' ' ' LEU . 3.7 pp -65.73 -30.06 70.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.343 -175.332 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -82.68 -22.13 34.68 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 119.701 -0.8 . . . . 0.0 111.711 -179.253 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -100.58 7.77 43.83 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.06 0.457 . . . . 0.0 110.205 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.479 ' HG2' ' HA ' ' A' ' 64' ' ' LEU . 49.0 mmm -53.52 -24.28 12.84 Favored 'General case' 0 CA--C 1.488 -1.428 0 N-CA-C 113.72 1.007 . . . . 0.0 113.72 -179.005 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -62.17 -28.04 69.39 Favored 'General case' 0 C--N 1.286 -2.18 0 CA-C-N 115.059 -0.973 . . . . 0.0 112.55 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 19.0 ptp -104.48 -28.18 11.46 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 174.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 18.6 m -76.86 -28.84 55.58 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.634 -173.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.403 ' HB3' ' HE3' ' A' ' 67' ' ' MET . 4.0 pp -58.79 -33.9 70.86 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 121.474 0.654 . . . . 0.0 111.761 -179.203 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -81.32 -50.11 9.9 Favored 'General case' 0 N--CA 1.403 -2.789 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.379 -176.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 50.7 mttm -83.45 -20.58 33.8 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.087 -0.961 . . . . 0.0 111.679 -169.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.319 0 C-N-CA 125.542 1.537 . . . . 0.0 112.626 176.924 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.744 0 N-CA-C 109.908 -1.277 . . . . 0.0 109.908 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 41.3 p-80 -80.54 -3.21 49.29 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -175.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 65.2 mtt -67.3 158.06 32.45 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 121.432 0.634 . . . . 0.0 112.533 -175.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.651 HG13 HD22 ' A' ' 71' ' ' LEU . 4.3 m -71.02 -26.04 26.81 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.253 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -167.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 15.7 p80 -71.12 -12.69 61.63 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-O 121.268 0.556 . . . . 0.0 110.643 178.291 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -91.66 -7.9 48.63 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.85 178.412 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.488 ' O ' ' HB2' ' A' ' 34' ' ' SER . 49.2 m0 -82.66 147.45 28.51 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 -179.345 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 58.0 m -115.75 -69.21 0.87 Allowed 'General case' 0 N--CA 1.416 -2.162 0 O-C-N 123.422 0.451 . . . . 0.0 110.917 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.416 ' O ' HG12 ' A' ' 12' ' ' VAL . 59.3 t -141.58 -60.56 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -178.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.7 pm0 -70.29 9.58 0.58 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.629 -1.168 . . . . 0.0 113.865 -177.716 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.418 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 69.5 mt-30 -123.15 -11.9 7.96 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 175.158 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.574 HG23 HD12 ' A' ' 38' ' ' LEU . 4.2 p -77.4 -19.52 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-O 122.488 1.137 . . . . 0.0 108.474 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.9 p -67.53 -40.38 85.05 Favored 'General case' 0 N--CA 1.425 -1.676 0 C-N-CA 125.692 1.597 . . . . 0.0 112.376 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' HIS . . . . . 0.418 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 45.1 m-70 -57.61 -38.57 75.15 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.266 -177.287 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.467 ' O ' HD23 ' A' ' 19' ' ' LEU . 42.5 t90 -64.94 -61.06 2.39 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.488 176.141 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.1 mt -45.37 -52.62 9.69 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.657 1.183 . . . . 0.0 112.389 -177.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 85.3 t -62.65 -27.39 42.83 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 CA-C-O 121.148 0.499 . . . . 0.0 111.489 -177.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.67 -30.76 70.57 Favored Glycine 0 C--O 1.217 -0.918 0 CA-C-N 115.914 -0.584 . . . . 0.0 112.034 -178.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.467 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.4 OUTLIER -102.63 15.52 29.06 Favored 'General case' 0 C--N 1.314 -0.953 0 O-C-N 122.503 -0.41 . . . . 0.0 111.215 177.74 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.0 m 67.4 26.99 8.24 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 122.422 1.106 . . . . 0.0 111.008 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.418 ' HG ' ' CD1' ' A' ' 19' ' ' LEU . 1.2 mm? -98.0 21.28 10.92 Favored 'General case' 0 C--N 1.31 -1.114 0 C-N-CA 125.173 1.389 . . . . 0.0 108.69 178.02 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.409 ' HA ' HG12 ' A' ' 25' ' ' VAL . 8.8 p-10 -60.45 -9.97 4.33 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 123.893 0.877 . . . . 0.0 112.939 176.66 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.411 ' OE1' ' HA ' ' A' ' 21' ' ' LEU . 0.7 OUTLIER -84.07 -18.14 37.95 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 118.957 -1.097 . . . . 0.0 111.431 172.497 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -84.75 -27.72 26.74 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -177.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.544 ' HA ' ' HB2' ' A' ' 28' ' ' PHE . 0.7 OUTLIER -58.89 -25.62 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 177.971 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.3 m -54.7 -40.78 69.53 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.836 0.854 . . . . 0.0 111.383 176.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 38.2 tp10 -105.97 -27.42 11.18 Favored 'General case' 0 C--O 1.219 -0.541 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.044 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.544 ' HB2' ' HA ' ' A' ' 25' ' ' VAL . 1.7 m-85 -53.73 -44.39 69.85 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 121.218 0.533 . . . . 0.0 110.473 176.066 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.414 ' HA ' HG13 ' A' ' 9' ' ' VAL . 17.6 m -69.5 -28.87 66.43 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.615 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -76.88 -19.82 56.99 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.949 -176.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -106.8 4.21 27.29 Favored 'General case' 0 CA--C 1.501 -0.917 0 C-N-CA 119.649 -0.82 . . . . 0.0 109.474 175.327 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 61.06 38.9 16.86 Favored 'General case' 0 C--O 1.245 0.868 0 O-C-N 124.087 0.867 . . . . 0.0 110.435 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 49.4 mm -67.95 114.64 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.874 0 CA-C-N 115.187 -0.915 . . . . 0.0 108.673 -179.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.488 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 89.1 p -103.49 -169.26 1.62 Allowed 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 178.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.464 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -60.96 -29.04 69.73 Favored Glycine 0 N--CA 1.439 -1.12 0 N-CA-C 111.42 -0.672 . . . . 0.0 111.42 178.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -58.4 -44.8 89.16 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.39 0.614 . . . . 0.0 109.631 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.94 -4.46 49.75 Favored 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -179.255 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.574 HD12 HG23 ' A' ' 12' ' ' VAL . 3.3 tt -80.57 -49.47 11.27 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 178.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.5 mt -61.38 -39.52 90.97 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.524 -178.141 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.47 15.4 16.0 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -178.31 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.412 ' CB ' HD22 ' A' ' 64' ' ' LEU . 40.8 mt -55.64 160.49 2.48 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.704 0.764 . . . . 0.0 112.674 178.11 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.446 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 15.5 t70 -162.08 172.36 16.0 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 105.784 -1.932 . . . . 0.0 105.784 -177.158 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.401 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -61.04 -34.73 89.05 Favored Glycine 0 C--O 1.204 -1.748 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 175.206 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -51.1 -48.55 61.68 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 123.455 0.702 . . . . 0.0 111.16 176.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.45 ' O ' HD23 ' A' ' 49' ' ' LEU . 14.0 mtpp -69.07 -43.08 75.32 Favored 'General case' 0 C--O 1.197 -1.702 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.266 176.478 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 91.0 mt -59.84 -27.23 66.47 Favored 'General case' 0 C--O 1.255 1.349 0 CA-C-O 121.603 0.716 . . . . 0.0 111.244 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.767 ' HA ' HG22 ' A' ' 52' ' ' THR . 58.4 mtpt -80.8 -40.34 25.19 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.701 175.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.26 -11.26 60.45 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.512 0.672 . . . . 0.0 111.59 179.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.469 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.0 mm? -78.21 -3.23 41.62 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 123.179 0.591 . . . . 0.0 110.029 171.22 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 70.57 8.99 64.22 Favored Glycine 0 C--N 1.341 0.845 0 CA-C-O 121.259 0.366 . . . . 0.0 112.665 177.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 22.0 mmt -92.13 -59.06 2.19 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 115.418 -0.391 . . . . 0.0 110.929 -178.129 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.767 HG22 ' HA ' ' A' ' 47' ' ' LYS . 25.5 p 57.68 25.57 11.92 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 124.588 1.155 . . . . 0.0 112.588 175.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.425 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 14.8 m -69.74 118.99 13.29 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 123.19 0.596 . . . . 0.0 111.559 -176.511 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.0 m -63.2 -34.42 77.61 Favored 'General case' 0 C--O 1.244 0.77 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -177.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.459 ' HG3' ' N ' ' A' ' 56' ' ' ASP . 5.3 pt20 -59.24 -45.26 91.63 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.548 0.689 . . . . 0.0 110.198 176.16 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.587 ' O ' HG12 ' A' ' 60' ' ' VAL . 70.9 m-20 -74.76 -35.08 62.58 Favored 'General case' 0 N--CA 1.425 -1.724 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.666 -175.377 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.425 ' HG2' ' O ' ' A' ' 53' ' ' SER . 49.0 mmm-85 -55.22 -25.81 35.51 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.684 0.394 . . . . 0.0 111.548 175.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -98.28 -17.69 18.79 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.889 0.375 . . . . 0.0 111.279 178.35 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -96.39 -66.55 0.9 Allowed 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 120.641 0.258 . . . . 0.0 110.801 -175.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.587 HG12 ' O ' ' A' ' 56' ' ' ASP . 3.9 p -61.55 -24.57 34.22 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.849 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.769 -174.446 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -63.59 -36.25 83.17 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 122.107 0.956 . . . . 0.0 109.442 -179.282 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.445 ' O ' ' HG2' ' A' ' 65' ' ' LYS . 82.5 tttt -81.98 -34.76 29.53 Favored 'General case' 0 C--N 1.29 -2.016 0 CA-C-N 114.163 -1.381 . . . . 0.0 109.571 -177.783 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.466 ' O ' ' HB3' ' A' ' 67' ' ' MET . 0.5 OUTLIER -74.54 -38.57 62.73 Favored 'General case' 0 C--O 1.191 -1.989 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.229 -176.99 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.412 HD22 ' CB ' ' A' ' 41' ' ' LEU . 3.5 pp -64.36 -29.96 71.02 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -176.003 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.445 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 21.6 pttp -75.25 -34.97 61.44 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 119.933 -0.707 . . . . 0.0 110.309 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -100.52 1.5 41.08 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.15 0.5 . . . . 0.0 111.062 -175.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.466 ' HB3' ' O ' ' A' ' 63' ' ' LYS . 2.6 ppp? -70.83 -22.71 62.29 Favored 'General case' 0 C--O 1.195 -1.788 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.224 -176.418 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.53 ' HA ' HD23 ' A' ' 71' ' ' LEU . 54.4 pttt -71.67 -17.54 62.23 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.358 179.566 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 48.1 mtt -100.94 -34.45 9.77 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 172.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 22.8 m -82.91 -12.87 57.01 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.928 -1.033 . . . . 0.0 113.542 -172.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.651 HD22 HG13 ' A' ' 4' ' ' VAL . 4.5 pp -55.98 -31.57 63.13 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.939 0.876 . . . . 0.0 110.857 176.608 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.507 ' N ' HD12 ' A' ' 71' ' ' LEU . 10.3 tt0 -70.81 -37.22 73.24 Favored 'General case' 0 N--CA 1.416 -2.167 0 CA-C-N 114.051 -1.431 . . . . 0.0 111.727 -179.568 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.78 24.34 8.51 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.892 0.853 . . . . 0.0 110.614 -175.222 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.279 -2.465 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.436 -178.158 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.38 0 N-CA-C 111.74 -0.544 . . . . 0.0 111.74 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 27.6 p80 -116.51 3.39 13.19 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -174.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 96.0 mmm -67.93 169.25 10.24 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 177.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.583 HG12 ' CH2' ' A' ' 7' ' ' TRP . 15.2 m -66.04 -34.99 73.96 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.799 0 O-C-N 121.831 -0.543 . . . . 0.0 112.311 -173.171 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.4 p-80 -73.37 -9.11 58.35 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.843 0.83 . . . . 0.0 110.725 179.091 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -98.74 -11.27 22.07 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.149 177.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.583 ' CH2' HG12 ' A' ' 4' ' ' VAL . 54.1 m0 -72.53 150.77 42.9 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 177.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.2 m -104.48 -75.0 0.63 Allowed 'General case' 0 N--CA 1.424 -1.759 0 CA-C-O 121.082 0.468 . . . . 0.0 109.992 -178.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.513 ' O ' HG12 ' A' ' 12' ' ' VAL . 94.5 t -139.06 -65.67 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.203 -1.353 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 -175.624 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -66.71 -14.04 62.06 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.153 0.501 . . . . 0.0 112.301 -176.183 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.493 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 86.2 mt-30 -88.34 -15.75 34.83 Favored 'General case' 0 N--CA 1.433 -1.299 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 178.038 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.513 HG12 ' O ' ' A' ' 9' ' ' VAL . 2.9 p -75.67 -25.76 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-O 122.028 0.918 . . . . 0.0 109.294 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.412 ' HA ' HD12 ' A' ' 16' ' ' LEU . 0.8 OUTLIER -67.09 -28.38 68.13 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 114.6 -1.182 . . . . 0.0 111.654 -177.039 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' HIS . . . . . 0.493 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 83.6 m-70 -59.5 -41.68 90.41 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 -178.078 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.528 ' O ' HD23 ' A' ' 19' ' ' LEU . 38.0 t90 -64.51 -57.46 9.13 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.819 177.517 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.473 HD11 ' CD2' ' A' ' 28' ' ' PHE . 48.5 mt -48.96 -51.24 31.44 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.104 0.962 . . . . 0.0 112.738 -178.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 13' ' ' SER . 88.2 t -62.47 -24.78 36.15 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.033 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.022 -178.508 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -75.03 -24.13 72.56 Favored Glycine 0 N--CA 1.444 -0.775 0 N-CA-C 112.017 -0.433 . . . . 0.0 112.017 -177.32 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.528 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.7 OUTLIER -105.56 15.98 26.15 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.143 0.496 . . . . 0.0 110.482 174.818 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.1 m 64.67 28.92 13.09 Favored 'General case' 0 C--O 1.213 -0.862 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.804 178.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.605 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 0.6 OUTLIER -100.51 20.86 14.19 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 126.851 2.06 . . . . 0.0 108.856 -179.593 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -49.59 -29.97 7.97 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.595 0.758 . . . . 0.0 112.242 176.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.605 ' NE2' ' HA ' ' A' ' 21' ' ' LEU . 2.6 pm0 -61.75 -22.37 65.33 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 176.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.414 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 8.4 m-85 -85.97 -22.87 27.14 Favored 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 86.9 t -54.86 -38.71 45.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 O-C-N 123.383 0.427 . . . . 0.0 111.254 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.8 m -50.86 -39.46 53.83 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.283 1.033 . . . . 0.0 111.745 -178.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.623 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 35.4 tp10 -103.34 -30.66 10.47 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.747 -178.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.473 ' CD2' HD11 ' A' ' 16' ' ' LEU . 1.6 m-85 -55.26 -41.13 71.8 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 121.389 0.614 . . . . 0.0 109.884 176.467 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.463 ' HA ' HG13 ' A' ' 9' ' ' VAL . 47.1 t -69.37 -34.81 75.1 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.911 178.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.52 -32.51 71.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.129 -173.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -99.33 6.44 46.15 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.124 -179.523 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 59.47 39.15 22.18 Favored 'General case' 0 C--O 1.244 0.783 0 O-C-N 123.867 0.729 . . . . 0.0 110.118 178.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.4 mm -67.76 112.54 2.98 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.219 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.34 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 87.6 p -107.13 -168.23 1.37 Allowed 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.484 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.9 -25.37 67.71 Favored Glycine 0 N--CA 1.441 -0.975 0 N-CA-C 111.458 -0.657 . . . . 0.0 111.458 177.4 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -56.26 -39.57 72.83 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.265 1.026 . . . . 0.0 108.955 178.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.402 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -99.1 -20.71 16.54 Favored 'General case' 0 N--CA 1.434 -1.27 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 179.211 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.414 HD12 HG23 ' A' ' 12' ' ' VAL . 2.6 tt -64.75 -51.47 62.16 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.915 0.886 . . . . 0.0 109.856 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.405 HD21 HG21 ' A' ' 4' ' ' VAL . 25.6 mt -62.31 -34.32 76.38 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.547 0.689 . . . . 0.0 111.718 -175.535 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.56 13.59 34.51 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -177.465 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.409 HD23 ' HD3' ' A' ' 45' ' ' LYS . 41.3 mt -55.03 155.19 4.73 Favored 'General case' 0 C--O 1.24 0.588 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 177.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -159.38 -176.66 5.92 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 176.089 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.95 -39.25 93.88 Favored Glycine 0 N--CA 1.429 -1.791 0 CA-C-O 118.982 -0.899 . . . . 0.0 113.014 -179.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 -57.55 -45.15 85.47 Favored 'General case' 0 CA--C 1.481 -1.686 0 CA-C-N 117.845 0.822 . . . . 0.0 111.896 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.409 ' HD3' HD23 ' A' ' 41' ' ' LEU . 15.1 mtpp -63.77 -46.31 85.82 Favored 'General case' 0 C--O 1.199 -1.58 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.999 177.217 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 83.8 mt -60.14 -32.48 71.07 Favored 'General case' 0 C--O 1.244 0.779 0 CA-C-O 121.679 0.752 . . . . 0.0 111.352 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.709 ' HA ' HG22 ' A' ' 52' ' ' THR . 40.9 mtpt -72.11 -34.74 68.83 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.922 175.633 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.07 -13.26 61.17 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 123.12 0.568 . . . . 0.0 111.434 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.623 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.3 mm? -77.71 -7.66 56.81 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-O 121.449 0.642 . . . . 0.0 109.544 173.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.89 -1.43 46.93 Favored Glycine 0 C--O 1.222 -0.614 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.955 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.414 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 37.6 tpp -85.15 -48.27 9.33 Favored 'General case' 0 N--CA 1.441 -0.885 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -178.395 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.709 HG22 ' HA ' ' A' ' 47' ' ' LYS . 70.5 p 55.72 17.02 2.21 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 125.579 1.552 . . . . 0.0 114.274 172.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.453 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 40.5 t -65.14 118.75 9.66 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 122.669 0.388 . . . . 0.0 111.25 -176.19 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.5 t -59.61 -46.46 88.89 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 123.745 0.818 . . . . 0.0 110.56 -177.149 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -57.13 -48.53 78.44 Favored 'General case' 0 C--O 1.241 0.619 0 O-C-N 123.427 0.455 . . . . 0.0 111.434 178.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.667 ' O ' HG12 ' A' ' 60' ' ' VAL . 29.0 m-20 -66.9 -44.81 79.84 Favored 'General case' 0 CA--C 1.474 -1.969 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.576 -177.449 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.666 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 28.5 mtm180 -58.15 -35.66 71.87 Favored 'General case' 0 C--O 1.196 -1.735 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 -178.251 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.81 -27.49 62.0 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.315 0.579 . . . . 0.0 110.648 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 47.8 tp -85.58 -51.57 6.4 Favored 'General case' 0 C--O 1.247 0.945 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.891 -177.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.667 HG12 ' O ' ' A' ' 56' ' ' ASP . 4.4 p -60.67 -22.52 26.31 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.513 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.003 178.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.666 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 26.5 tptp -70.55 -33.84 71.58 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 122.082 0.944 . . . . 0.0 108.877 -174.801 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -82.76 -43.28 16.94 Favored 'General case' 0 C--N 1.288 -2.103 0 CA-C-N 114.221 -1.354 . . . . 0.0 108.974 -178.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.462 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.8 OUTLIER -69.98 -36.31 75.09 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 114.734 -1.121 . . . . 0.0 112.198 -175.87 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.0 pp -69.7 -17.17 63.45 Favored 'General case' 0 C--O 1.205 -1.285 0 CA-C-N 116.757 -0.202 . . . . 0.0 111.303 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -98.47 0.57 45.45 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 119.719 -0.792 . . . . 0.0 112.342 176.134 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -128.34 12.05 6.46 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 122.82 1.295 . . . . 0.0 108.538 177.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.486 ' N ' ' SD ' ' A' ' 67' ' ' MET . 0.0 OUTLIER -58.21 -26.16 62.5 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 126.649 1.979 . . . . 0.0 110.142 179.428 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -58.12 -34.34 70.11 Favored 'General case' 0 C--N 1.304 -1.392 0 C-N-CA 126.021 1.729 . . . . 0.0 111.676 177.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.447 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 18.2 ptp -98.82 -26.83 14.18 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 176.253 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.446 ' HB3' ' HA ' ' A' ' 67' ' ' MET . 16.6 t -65.02 -40.68 95.23 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.825 -177.173 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.503 HD22 HG13 ' A' ' 4' ' ' VAL . 4.1 pp -60.0 -30.23 69.0 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.27 0.557 . . . . 0.0 111.343 178.255 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -83.63 -45.7 13.18 Favored 'General case' 0 N--CA 1.397 -3.08 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.747 -172.429 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 69' ' ' MET . 56.1 mtpt -63.01 -77.95 0.05 OUTLIER 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.287 -169.273 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.997 0 C-N-CA 126.811 2.044 . . . . 0.0 105.597 -177.593 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.534 0 N-CA-C 110.751 -0.94 . . . . 0.0 110.751 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -97.96 -6.25 32.54 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 117.703 0.752 . . . . 0.0 110.557 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 78.2 mtm -79.88 154.63 28.23 Favored 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.624 178.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.632 HG11 ' SD ' ' A' ' 67' ' ' MET . 10.2 m -67.32 -30.6 49.66 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.355 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 -166.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.4 p-80 -70.98 -12.98 61.84 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-O 121.39 0.615 . . . . 0.0 110.488 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -95.46 -2.18 49.29 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 123.908 0.883 . . . . 0.0 110.132 178.548 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.615 ' CH2' HG12 ' A' ' 4' ' ' VAL . 52.1 m0 -84.75 131.09 34.6 Favored 'General case' 0 N--CA 1.433 -1.304 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 179.001 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.2 m -87.57 -72.98 0.5 Allowed 'General case' 0 C--N 1.296 -1.754 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.801 -175.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.44 ' O ' HG12 ' A' ' 12' ' ' VAL . 66.7 t -143.49 -63.71 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.2 -1.514 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -179.617 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.427 ' NE2' ' HG3' ' A' ' 11' ' ' GLN . 4.3 pm0 -64.38 -24.7 67.73 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.051 -177.352 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.427 ' HG3' ' NE2' ' A' ' 10' ' ' GLN . 76.9 mt-30 -79.01 -14.51 59.15 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.547 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.44 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.8 p -73.12 -26.19 22.58 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 CA-C-O 121.666 0.746 . . . . 0.0 109.688 179.445 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.462 ' HA ' HD12 ' A' ' 16' ' ' LEU . 1.5 m -71.62 -26.4 62.56 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.538 -174.618 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -61.72 -34.48 75.87 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.194 0.521 . . . . 0.0 110.348 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.489 ' O ' HD23 ' A' ' 19' ' ' LEU . 40.3 t90 -68.05 -61.44 1.86 Allowed 'General case' 0 N--CA 1.433 -1.287 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 174.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.492 HD11 ' CG ' ' A' ' 28' ' ' PHE . 46.9 mt -45.43 -51.75 11.03 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.67 1.188 . . . . 0.0 112.676 -177.101 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 13' ' ' SER . 93.1 t -59.5 -31.51 46.84 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.261 -177.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.7 -35.9 86.57 Favored Glycine 0 N--CA 1.438 -1.229 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.342 -176.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.489 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.5 OUTLIER -100.19 20.54 14.43 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 121.297 -0.161 . . . . 0.0 111.414 -179.214 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.5 m 68.43 20.3 8.58 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-O 121.638 0.732 . . . . 0.0 111.679 178.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.454 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -102.33 20.91 16.0 Favored 'General case' 0 C--N 1.294 -1.828 0 C-N-CA 123.961 0.904 . . . . 0.0 110.15 -178.745 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.43 ' HA ' HG23 ' A' ' 25' ' ' VAL . 5.9 p-10 -52.8 -24.33 8.7 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.533 0.733 . . . . 0.0 110.964 174.07 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -60.68 -25.14 66.15 Favored 'General case' 0 C--N 1.301 -1.502 0 C-N-CA 125.338 1.455 . . . . 0.0 111.692 176.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.556 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 3.9 m-85 -89.17 -20.24 24.47 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.586 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.43 HG23 ' HA ' ' A' ' 22' ' ' ASP . 88.5 t -54.15 -38.58 39.13 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 O-C-N 123.553 0.533 . . . . 0.0 111.95 -179.078 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.2 m -52.1 -37.25 53.42 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.505 0.722 . . . . 0.0 112.324 -177.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 12.9 tp10 -105.18 -30.11 9.91 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.431 -178.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.492 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.4 m-85 -54.74 -42.97 72.26 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.177 0.513 . . . . 0.0 110.894 177.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.9 m -73.57 -25.17 60.24 Favored 'General case' 0 N--CA 1.435 -1.221 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.531 -179.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -76.22 -33.39 59.22 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.482 -175.393 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -95.95 7.27 46.83 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 119.825 -0.75 . . . . 0.0 110.073 -179.093 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 60.29 37.11 20.55 Favored 'General case' 0 CA--C 1.505 -0.752 0 O-C-N 123.861 0.726 . . . . 0.0 109.569 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 50.0 mm -68.5 113.62 4.47 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 179.345 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.52 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 99.0 p -104.74 -170.74 1.81 Allowed 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 178.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.478 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.47 -28.26 70.89 Favored Glycine 0 C--O 1.224 -0.522 0 N-CA-C 110.895 -0.882 . . . . 0.0 110.895 179.279 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -54.64 -44.89 73.59 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 125.027 1.331 . . . . 0.0 110.282 177.504 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.78 -1.07 50.48 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.9 tt -84.07 -43.03 15.49 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 9.4 mt -58.82 -40.43 84.1 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.542 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -100.96 18.25 20.14 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -175.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.477 HD23 ' HD3' ' A' ' 45' ' ' LYS . 40.5 mt -53.74 146.67 13.12 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 178.702 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -153.08 172.33 17.04 Favored 'General case' 0 C--N 1.297 -1.674 0 N-CA-C 106.592 -1.632 . . . . 0.0 106.592 178.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -57.64 -30.92 62.99 Favored Glycine 0 CA--C 1.481 -2.076 0 N-CA-C 111.29 -0.724 . . . . 0.0 111.29 177.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -53.36 -47.44 69.41 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.391 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.477 ' HD3' HD23 ' A' ' 41' ' ' LEU . 14.5 mtpp -72.73 -43.96 62.3 Favored 'General case' 0 C--O 1.186 -2.255 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.378 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 91.8 mt -55.55 -37.55 68.14 Favored 'General case' 0 N--CA 1.485 1.317 0 CA-C-O 122.142 0.972 . . . . 0.0 110.835 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.798 ' HA ' HG22 ' A' ' 52' ' ' THR . 41.4 mttm -71.49 -38.73 71.16 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 114.867 -1.061 . . . . 0.0 111.106 175.8 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.51 -13.04 60.35 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.475 0.655 . . . . 0.0 111.357 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.47 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.0 mm? -84.09 -1.78 55.54 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 174.297 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 69.84 6.57 56.43 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 115.516 -0.765 . . . . 0.0 114.956 174.004 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.556 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 13.5 tpt -85.34 -50.92 6.93 Favored 'General case' 0 CA--C 1.494 -1.183 0 C-N-CA 118.708 -1.197 . . . . 0.0 108.007 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.798 HG22 ' HA ' ' A' ' 47' ' ' LYS . 68.5 p 54.07 28.94 9.46 Favored 'General case' 0 C--O 1.25 1.091 0 C-N-CA 125.007 1.323 . . . . 0.0 113.252 170.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.573 ' HB2' ' OD1' ' A' ' 56' ' ' ASP . 58.5 m -72.99 -166.43 0.3 Allowed 'General case' 0 N--CA 1.425 -1.695 0 C-N-CA 123.228 0.611 . . . . 0.0 112.158 -176.626 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.0 t -117.93 -38.57 3.22 Favored 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 121.802 -0.561 . . . . 0.0 111.13 -177.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -72.94 -32.43 65.25 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-O 121.312 0.577 . . . . 0.0 110.99 -175.688 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.684 ' O ' HG12 ' A' ' 60' ' ' VAL . 10.4 p-10 -70.85 -40.31 72.43 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 -176.511 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.9 mmm180 -57.98 -14.7 6.93 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 125.161 1.384 . . . . 0.0 112.203 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -106.02 -38.39 6.33 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.396 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.431 HD12 HD12 ' A' ' 19' ' ' LEU . 0.8 OUTLIER -75.3 -63.09 1.35 Allowed 'General case' 0 C--O 1.243 0.745 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.467 -176.17 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.684 HG12 ' O ' ' A' ' 56' ' ' ASP . 11.8 p -62.98 -24.39 35.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 122.083 0.944 . . . . 0.0 109.977 -174.204 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 51.8 tptt -68.87 -28.24 66.53 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 113.893 -1.503 . . . . 0.0 110.088 -175.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -89.98 -32.79 16.63 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.508 179.409 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.11 -39.89 60.32 Favored 'General case' 0 C--N 1.294 -1.843 0 CA-C-N 114.95 -1.023 . . . . 0.0 112.049 -177.06 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.1 pp -65.41 -28.31 69.16 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.184 0.516 . . . . 0.0 110.977 -176.356 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -83.81 -10.76 57.83 Favored 'General case' 0 C--N 1.316 -0.885 0 C-N-CA 120.665 -0.414 . . . . 0.0 111.894 -178.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -112.93 -9.54 13.61 Favored 'General case' 0 CA--C 1.489 -1.384 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.632 ' SD ' HG11 ' A' ' 4' ' ' VAL . 7.1 tmm? -54.04 -37.35 64.05 Favored 'General case' 0 C--N 1.296 -1.736 0 C-N-CA 127.209 2.204 . . . . 0.0 109.515 -174.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.503 ' HA ' HD23 ' A' ' 71' ' ' LEU . 22.1 pttp -62.92 -17.38 61.72 Favored 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 114.532 -1.213 . . . . 0.0 114.201 178.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 27.0 ptm -115.51 -23.23 8.89 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 108.914 -0.772 . . . . 0.0 108.914 173.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 49.1 m -81.02 -27.91 35.64 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.758 -176.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.503 HD23 ' HA ' ' A' ' 68' ' ' LYS . 4.1 pp -59.71 -31.0 69.2 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.795 0.807 . . . . 0.0 110.555 176.673 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -67.99 -33.06 73.9 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.202 -178.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -83.87 -13.57 53.29 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.215 -176.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.261 1.67 0 C-N-CA 125.123 1.369 . . . . 0.0 112.349 178.472 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.69 0 N-CA-C 111.773 -0.531 . . . . 0.0 111.773 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 42.3 p-80 -96.07 -7.55 35.84 Favored 'General case' 0 C--N 1.321 -0.642 0 O-C-N 122.899 -0.177 . . . . 0.0 111.3 -175.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 58.6 mtt -73.8 169.79 16.66 Favored 'General case' 0 N--CA 1.437 -1.077 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -172.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.513 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 4.4 m -68.07 -28.3 40.57 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.049 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 -167.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.0 p80 -67.79 -17.93 64.69 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 120.977 0.418 . . . . 0.0 110.775 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -91.6 -12.36 34.52 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 123.224 0.61 . . . . 0.0 110.117 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.491 ' O ' ' HB2' ' A' ' 34' ' ' SER . 51.4 m0 -65.84 140.17 58.36 Favored 'General case' 0 CA--C 1.494 -1.206 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.33 -178.279 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.52 -89.28 0.16 Allowed 'General case' 0 N--CA 1.412 -2.333 0 CA-C-N 114.992 -1.004 . . . . 0.0 111.501 -178.275 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.537 ' O ' HG12 ' A' ' 12' ' ' VAL . 91.9 t -137.36 -59.88 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.284 -2.254 0 CA-C-N 114.2 -1.364 . . . . 0.0 108.145 -177.376 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -71.85 -14.73 62.04 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-O 121.246 0.546 . . . . 0.0 111.697 -178.168 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -78.68 -22.67 46.41 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.109 176.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.537 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.4 p -75.28 -27.02 19.11 Favored 'Isoleucine or valine' 0 C--O 1.244 0.781 0 CA-C-O 121.761 0.791 . . . . 0.0 109.029 -177.277 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.2 -29.21 67.13 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 114.823 -1.08 . . . . 0.0 110.574 -178.389 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 33.4 m170 -60.19 -36.38 77.5 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.517 ' O ' HD23 ' A' ' 19' ' ' LEU . 37.6 t90 -69.41 -61.21 1.88 Allowed 'General case' 0 N--CA 1.426 -1.632 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.564 176.293 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.42 HD11 ' CD2' ' A' ' 28' ' ' PHE . 32.6 mt -47.53 -50.9 22.45 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.137 0.975 . . . . 0.0 112.466 -176.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.5 t -60.85 -28.74 43.89 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 C-N-CA 122.311 0.244 . . . . 0.0 111.092 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -72.37 -23.16 78.4 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 116.177 -0.465 . . . . 0.0 112.147 -176.065 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.517 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -110.55 19.59 18.56 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 121.009 -0.276 . . . . 0.0 110.933 176.623 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.4 m 66.81 24.42 9.83 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.384 0.673 . . . . 0.0 112.139 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.426 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 0.9 OUTLIER -99.72 19.81 15.25 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 124.978 1.311 . . . . 0.0 108.836 -179.02 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -52.6 -28.41 21.05 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 124.228 1.011 . . . . 0.0 111.773 176.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.23 -14.67 62.72 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 120.071 -0.652 . . . . 0.0 112.468 177.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.427 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 2.3 m-85 -88.53 -20.69 24.76 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.114 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 96.8 t -58.0 -34.19 48.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.344 178.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.7 m -48.41 -42.11 31.11 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.701 1.2 . . . . 0.0 111.457 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 10.9 tp10 -106.52 -29.62 9.56 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.569 -177.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.42 ' CD2' HD11 ' A' ' 16' ' ' LEU . 1.9 m-85 -55.0 -42.2 72.23 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-O 121.524 0.678 . . . . 0.0 110.316 176.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.417 ' HA ' HG13 ' A' ' 9' ' ' VAL . 39.7 t -71.96 -24.68 61.64 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.158 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -80.13 -31.37 39.09 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.531 -174.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -99.1 3.47 46.68 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 119.734 -0.787 . . . . 0.0 110.266 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 60.46 41.37 15.98 Favored 'General case' 0 C--O 1.243 0.743 0 O-C-N 123.881 0.738 . . . . 0.0 109.398 -179.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 42.7 mm -70.4 108.79 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.097 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.491 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 80.7 p -100.57 -170.43 1.86 Allowed 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 108.496 -0.928 . . . . 0.0 108.496 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.513 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -61.49 -27.05 67.3 Favored Glycine 0 N--CA 1.448 -0.552 0 N-CA-C 111.468 -0.653 . . . . 0.0 111.468 178.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -56.27 -43.94 79.27 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 124.548 1.139 . . . . 0.0 109.598 177.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.63 -5.5 35.29 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.427 -179.506 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.494 HD12 HG23 ' A' ' 12' ' ' VAL . 3.4 tt -78.78 -49.65 12.65 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 124.368 1.067 . . . . 0.0 108.86 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.416 HD21 HG21 ' A' ' 4' ' ' VAL . 54.7 mt -59.54 -35.83 74.96 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.698 -178.075 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.01 11.77 34.92 Favored 'General case' 0 C--N 1.297 -1.699 0 CA-C-N 115.348 -0.842 . . . . 0.0 112.955 -176.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.405 ' CB ' HD22 ' A' ' 64' ' ' LEU . 41.3 mt -54.64 154.96 4.46 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 178.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -157.73 168.91 25.89 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 -178.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.81 -36.96 67.49 Favored Glycine 0 CA--C 1.496 -1.124 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -54.47 -46.57 73.4 Favored 'General case' 0 CA--C 1.5 -0.973 0 C-N-CA 122.965 0.506 . . . . 0.0 111.988 178.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.422 ' HE3' ' HB3' ' A' ' 45' ' ' LYS . 11.8 mtpp -66.48 -45.78 78.49 Favored 'General case' 0 C--O 1.195 -1.791 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.993 175.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 82.2 mt -59.6 -24.98 64.25 Favored 'General case' 0 C--O 1.254 1.319 0 C-N-CA 123.192 0.597 . . . . 0.0 111.954 -178.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.673 ' HA ' HG22 ' A' ' 52' ' ' THR . 23.4 mtpp -81.19 -31.2 34.1 Favored 'General case' 0 N--CA 1.437 -1.105 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.391 176.392 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.28 -4.73 57.74 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 123.253 0.621 . . . . 0.0 111.205 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.456 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.5 mm? -85.01 -3.89 58.95 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 173.161 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.18 -8.13 7.07 Favored Glycine 0 C--N 1.333 0.369 0 CA-C-N 115.708 -0.678 . . . . 0.0 113.842 176.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.427 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 4.9 tpt -77.69 -48.28 17.12 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.673 HG22 ' HA ' ' A' ' 47' ' ' LYS . 67.9 p 52.3 26.31 3.96 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.323 1.449 . . . . 0.0 113.1 174.55 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.44 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 45.2 t -66.66 117.5 8.91 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 120.909 0.385 . . . . 0.0 110.994 -175.818 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.1 m -61.6 -39.18 90.28 Favored 'General case' 0 C--O 1.248 1.008 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.262 -176.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -68.37 -45.31 73.1 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.145 179.241 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.567 ' O ' HG12 ' A' ' 60' ' ' VAL . 36.5 m-20 -71.18 -40.46 71.22 Favored 'General case' 0 CA--C 1.487 -1.462 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.488 -177.196 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.504 ' HA ' HG12 ' A' ' 60' ' ' VAL . 31.0 mtm180 -60.72 -31.44 70.74 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -78.46 -2.56 39.12 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.138 0.494 . . . . 0.0 110.88 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 40.5 tp -115.64 -47.99 2.79 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 120.96 0.409 . . . . 0.0 110.968 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.567 HG12 ' O ' ' A' ' 56' ' ' ASP . 5.2 p -60.4 -27.23 39.4 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.209 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.817 178.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -68.16 -36.45 79.65 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 122.005 0.907 . . . . 0.0 109.269 -175.243 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.414 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 23.8 ttmm -77.99 -41.81 34.72 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 113.724 -1.58 . . . . 0.0 108.776 -177.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.478 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.5 OUTLIER -69.67 -41.97 74.79 Favored 'General case' 0 C--O 1.186 -2.266 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.61 -177.65 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.405 HD22 ' CB ' ' A' ' 41' ' ' LEU . 3.2 pp -65.63 -30.88 71.65 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 120.828 0.347 . . . . 0.0 111.411 -176.456 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -81.79 -18.91 42.43 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.162 -0.615 . . . . 0.0 111.307 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.419 ' O ' ' HG2' ' A' ' 69' ' ' MET . 11.6 pt-20 -103.28 -15.76 15.87 Favored 'General case' 0 C--O 1.212 -0.883 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.356 177.162 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.468 ' HB3' ' O ' ' A' ' 63' ' ' LYS . 2.1 ppp? -60.66 -33.69 73.19 Favored 'General case' 0 C--O 1.194 -1.85 0 CA-C-O 121.2 0.524 . . . . 0.0 109.777 -175.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -70.33 -13.07 62.0 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.733 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 66' ' ' GLU . 23.2 ptp -120.8 5.4 10.49 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 177.434 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.4 t -121.11 -33.53 3.69 Favored 'General case' 0 C--O 1.191 -2.018 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.486 -176.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.465 ' HG ' HG13 ' A' ' 4' ' ' VAL . 0.0 OUTLIER -46.35 -36.39 6.34 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 114.363 1.245 . . . . 0.0 114.363 -171.475 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -75.16 -50.57 15.88 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 121.618 0.723 . . . . 0.0 111.582 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -86.12 -34.57 20.58 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.65 -167.38 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.419 -1.994 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 -176.852 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.914 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 38.0 p-80 -147.88 -16.09 0.36 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 117.152 0.476 . . . . 0.0 110.666 -179.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.415 ' HA ' HD13 ' A' ' 71' ' ' LEU . 66.1 mtt -77.49 162.17 27.36 Favored 'General case' 0 N--CA 1.438 -1.063 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 -175.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.601 HG12 ' CH2' ' A' ' 7' ' ' TRP . 9.4 m -61.41 -37.26 77.3 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.523 0 CA-C-O 121.133 0.492 . . . . 0.0 112.316 -171.853 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.1 p-80 -70.91 -9.59 58.06 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.382 -177.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -102.73 -0.82 31.04 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.487 179.198 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.601 ' CH2' HG12 ' A' ' 4' ' ' VAL . 54.5 m0 -79.5 149.82 31.37 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.098 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.9 m -102.1 -79.49 0.52 Allowed 'General case' 0 N--CA 1.419 -2.023 0 O-C-N 123.469 0.481 . . . . 0.0 109.779 -177.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.483 ' O ' HG12 ' A' ' 12' ' ' VAL . 57.9 t -139.38 -60.46 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.3 5.19 5.9 Favored 'General case' 0 C--O 1.215 -0.76 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -176.37 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -103.62 -13.08 16.66 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.602 175.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.515 HG23 HD12 ' A' ' 38' ' ' LEU . 2.4 p -81.08 -24.46 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 CA-C-O 121.811 0.815 . . . . 0.0 109.406 -179.186 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.472 ' HB3' ' CG1' ' A' ' 25' ' ' VAL . 0.3 OUTLIER -67.61 -36.15 80.3 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.449 -178.557 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -57.77 -32.15 67.21 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.084 0.469 . . . . 0.0 110.486 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.511 ' O ' HD23 ' A' ' 19' ' ' LEU . 30.2 t90 -72.83 -60.97 1.98 Allowed 'General case' 0 N--CA 1.426 -1.658 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.202 174.131 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.586 HD11 ' CD2' ' A' ' 28' ' ' PHE . 44.2 mt -47.04 -51.96 16.14 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.132 0.973 . . . . 0.0 112.656 -177.431 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 13' ' ' SER . 77.4 t -61.69 -24.75 34.95 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 C-N-CA 122.896 0.478 . . . . 0.0 111.0 -177.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.11 -34.92 54.49 Favored Glycine 0 N--CA 1.436 -1.31 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 -177.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.511 HD23 ' O ' ' A' ' 15' ' ' TRP . 1.2 pt? -97.83 16.03 22.0 Favored 'General case' 0 C--O 1.214 -0.802 0 C-N-CA 121.071 -0.252 . . . . 0.0 111.107 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.0 m 73.81 14.49 4.09 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.146 0.978 . . . . 0.0 112.156 178.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -93.16 21.97 5.47 Favored 'General case' 0 C--N 1.292 -1.895 0 C-N-CA 124.55 1.14 . . . . 0.0 108.928 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -51.75 -32.82 32.29 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 124.165 0.986 . . . . 0.0 110.554 174.084 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -63.12 -22.71 67.05 Favored 'General case' 0 CA--C 1.548 0.88 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.757 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -86.84 -22.37 25.84 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.76 -178.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.472 ' CG1' ' HB3' ' A' ' 13' ' ' SER . 35.0 t -57.8 -34.06 47.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 O-C-N 123.101 0.25 . . . . 0.0 110.518 179.454 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.1 t -51.0 -35.56 34.59 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.995 0.918 . . . . 0.0 111.487 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 19.2 tp10 -108.15 -32.43 7.52 Favored 'General case' 0 N--CA 1.432 -1.346 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.916 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.586 ' CD2' HD11 ' A' ' 16' ' ' LEU . 2.1 m-85 -53.95 -40.34 66.72 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-O 121.214 0.53 . . . . 0.0 110.793 175.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 33.7 t -73.23 -25.56 60.79 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.594 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.56 -34.1 53.87 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 121.965 -0.459 . . . . 0.0 110.909 -175.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 2.5 mt-30 -95.63 -3.29 46.53 Favored 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 120.397 -0.521 . . . . 0.0 109.98 -178.732 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.1 m-80 62.85 45.08 5.82 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 121.799 0.809 . . . . 0.0 109.139 -178.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.4 mm -68.87 110.29 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.195 0 CA-C-N 114.358 -1.292 . . . . 0.0 108.638 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.455 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 89.8 p -102.53 -169.26 1.64 Allowed 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.567 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -63.49 -22.46 65.76 Favored Glycine 0 N--CA 1.439 -1.117 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.955 177.596 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -59.29 -42.46 91.36 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 177.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.542 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -93.93 -22.29 18.69 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.813 -179.415 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.515 HD12 HG23 ' A' ' 12' ' ' VAL . 3.0 tt -62.51 -50.41 71.49 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 124.587 1.155 . . . . 0.0 109.65 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 67.8 mt -64.14 -38.51 91.31 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.235 -0.438 . . . . 0.0 112.128 -177.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -96.23 11.05 35.9 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -177.034 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.572 ' HB2' HD22 ' A' ' 64' ' ' LEU . 29.0 mt -50.5 136.61 20.62 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 122.322 1.058 . . . . 0.0 113.444 178.507 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -137.5 165.56 25.99 Favored 'General case' 0 C--N 1.285 -2.231 0 N-CA-C 107.34 -1.355 . . . . 0.0 107.34 -179.073 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -53.46 -39.46 59.87 Favored Glycine 0 C--O 1.212 -1.232 0 O-C-N 123.732 0.645 . . . . 0.0 111.774 178.356 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -53.01 -44.72 67.51 Favored 'General case' 0 CA--C 1.496 -1.111 0 C-N-CA 122.669 0.387 . . . . 0.0 111.23 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.415 ' HE3' ' HB3' ' A' ' 45' ' ' LYS . 11.4 mtpp -67.83 -50.05 58.81 Favored 'General case' 0 C--O 1.201 -1.48 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.664 178.775 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.8 mt -56.88 -31.12 64.53 Favored 'General case' 0 C--O 1.256 1.441 0 C-N-CA 123.645 0.778 . . . . 0.0 112.072 -177.385 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.755 ' HA ' HG22 ' A' ' 52' ' ' THR . 57.0 mtpt -80.08 -37.81 33.02 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.981 178.443 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.85 -15.4 62.64 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 122.99 0.516 . . . . 0.0 111.218 178.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.437 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.3 mm? -72.47 -4.78 32.39 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.245 0.618 . . . . 0.0 110.143 173.499 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 71.02 20.28 77.75 Favored Glycine 0 CA--C 1.501 -0.815 0 CA-C-N 116.416 -0.356 . . . . 0.0 112.524 177.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 23.2 mmt -105.71 -63.81 1.21 Allowed 'General case' 0 C--N 1.304 -1.389 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.795 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.755 HG22 ' HA ' ' A' ' 47' ' ' LYS . 20.2 p 64.15 13.33 7.75 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.697 1.599 . . . . 0.0 113.301 173.094 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.6 m -58.92 122.48 13.75 Favored 'General case' 0 N--CA 1.433 -1.314 0 C-N-CA 123.914 0.886 . . . . 0.0 111.143 -176.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.8 m -55.53 -35.13 65.33 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 -174.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.87 -33.7 39.85 Favored 'General case' 0 CA--C 1.497 -1.064 0 C-N-CA 119.255 -0.978 . . . . 0.0 111.207 -178.366 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.694 ' O ' HG12 ' A' ' 60' ' ' VAL . 1.7 m-20 -68.35 -44.9 74.25 Favored 'General case' 0 CA--C 1.477 -1.828 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -50.21 -29.4 9.33 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 124.75 1.22 . . . . 0.0 113.168 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -98.0 -37.5 9.75 Favored 'General case' 0 C--N 1.307 -1.279 0 O-C-N 123.578 0.549 . . . . 0.0 111.134 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 43.0 tp -74.4 -51.54 14.69 Favored 'General case' 0 C--O 1.243 0.715 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -175.081 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.694 HG12 ' O ' ' A' ' 56' ' ' ASP . 10.7 p -62.51 -24.62 35.78 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.986 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -179.514 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.426 ' HA ' ' CD2' ' A' ' 64' ' ' LEU . 56.5 tptt -73.57 -27.07 61.13 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.971 -1.468 . . . . 0.0 110.054 -173.394 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -88.41 -37.03 16.2 Favored 'General case' 0 C--N 1.291 -1.937 0 CA-C-N 114.956 -1.02 . . . . 0.0 108.834 178.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.438 ' HG2' HD13 ' A' ' 19' ' ' LEU . 2.6 tppt? -69.33 -41.33 76.8 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.165 -177.314 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.572 HD22 ' HB2' ' A' ' 41' ' ' LEU . 4.1 pp -64.42 -30.93 71.96 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 122.919 0.488 . . . . 0.0 112.263 -177.337 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -82.44 -27.24 32.06 Favored 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 119.784 -0.766 . . . . 0.0 111.642 -178.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -95.34 1.32 54.31 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.529 -0.468 . . . . 0.0 109.826 178.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.489 ' CE ' ' HA ' ' A' ' 67' ' ' MET . 0.0 OUTLIER -53.67 -38.75 64.49 Favored 'General case' 0 C--O 1.189 -2.116 0 CA-C-O 121.653 0.739 . . . . 0.0 111.057 178.382 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.431 ' HG2' ' H ' ' A' ' 68' ' ' LYS . 45.9 pttt -79.46 2.08 23.19 Favored 'General case' 0 C--N 1.272 -2.771 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -174.647 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 23.0 ptp -128.33 5.13 5.74 Favored 'General case' 0 C--N 1.286 -2.156 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 174.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.6 t -143.4 -6.89 0.8 Allowed 'General case' 0 N--CA 1.441 -0.922 0 C-N-CA 119.507 -0.877 . . . . 0.0 112.591 -175.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.533 HD12 ' N ' ' A' ' 72' ' ' GLU . 4.4 pp -50.99 -35.98 36.78 Favored 'General case' 0 CA--C 1.503 -0.849 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.533 ' N ' HD12 ' A' ' 71' ' ' LEU . 20.9 tt0 -68.68 -45.04 72.74 Favored 'General case' 0 C--N 1.301 -1.504 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.925 178.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -89.4 -58.97 2.34 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -170.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.236 -0.887 . . . . 0.0 108.639 -174.638 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.376 0 N-CA-C 112.098 -0.401 . . . . 0.0 112.098 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 41.9 p-80 -95.05 -12.04 27.29 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 111.616 0.228 . . . . 0.0 111.616 -174.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.465 ' O ' ' HB2' ' A' ' 6' ' ' GLU . 59.2 mtt -68.74 164.81 20.91 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 -174.801 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.5 HG13 ' HG ' ' A' ' 71' ' ' LEU . 4.2 m -72.61 -29.5 30.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -170.352 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 15.7 p80 -71.44 -9.8 58.75 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.527 0.68 . . . . 0.0 110.444 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' A' ' 3' ' ' MET . 12.9 mm-40 -93.09 -10.3 36.49 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.94 179.734 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 54.8 m0 -80.98 146.94 30.45 Favored 'General case' 0 CA--C 1.498 -1.045 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 70.2 m -104.62 -73.83 0.66 Allowed 'General case' 0 N--CA 1.413 -2.289 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.488 ' O ' HG12 ' A' ' 12' ' ' VAL . 55.6 t -140.79 -50.31 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.096 0 CA-C-O 121.918 0.866 . . . . 0.0 110.497 -174.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -75.61 -21.74 57.5 Favored 'General case' 0 C--N 1.282 -2.336 0 CA-C-N 114.503 -1.226 . . . . 0.0 111.348 -177.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.493 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 88.0 mt-30 -91.94 -11.42 36.27 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -176.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 9' ' ' VAL . 3.8 p -74.36 -25.83 19.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 CA-C-O 122.026 0.917 . . . . 0.0 108.545 178.642 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.44 ' HA ' HD12 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -69.76 -28.95 66.19 Favored 'General case' 0 N--CA 1.427 -1.583 0 CA-C-N 114.505 -1.225 . . . . 0.0 111.519 -176.139 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' HIS . . . . . 0.493 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 37.8 m-70 -63.61 -32.51 74.0 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.946 0.403 . . . . 0.0 110.15 -177.403 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.487 ' O ' HD23 ' A' ' 19' ' ' LEU . 27.5 t90 -69.41 -58.49 3.93 Favored 'General case' 0 N--CA 1.436 -1.147 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.46 175.317 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.461 HD11 ' CD2' ' A' ' 28' ' ' PHE . 48.3 mt -46.84 -50.39 18.57 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.307 1.043 . . . . 0.0 112.539 -177.139 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.0 t -60.2 -30.19 45.46 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.1 0 CA-C-O 120.822 0.344 . . . . 0.0 111.135 -178.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.01 -27.04 74.27 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 116.027 -0.533 . . . . 0.0 112.148 -176.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.487 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -107.28 15.93 24.52 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 178.845 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.5 m 70.64 25.62 4.09 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-O 121.694 0.759 . . . . 0.0 111.589 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.406 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.2 mm? -102.74 19.46 19.17 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 124.828 1.251 . . . . 0.0 110.516 -179.537 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -51.92 -30.6 25.03 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.214 0.531 . . . . 0.0 111.243 175.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -58.74 -23.13 59.36 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.87 0.868 . . . . 0.0 111.84 177.465 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -88.45 -22.98 23.4 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 94.8 t -54.44 -36.39 34.29 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 CA-C-O 120.885 0.374 . . . . 0.0 110.889 -178.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 22.7 t -46.62 -40.98 13.93 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.585 1.554 . . . . 0.0 111.649 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 39.2 tp10 -108.17 -28.93 9.2 Favored 'General case' 0 N--CA 1.438 -1.027 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.676 -179.024 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.461 ' CD2' HD11 ' A' ' 16' ' ' LEU . 1.1 m-85 -54.39 -46.1 73.02 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-O 121.432 0.634 . . . . 0.0 110.775 177.371 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 41.3 m -83.43 -6.33 59.43 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.038 -178.344 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.93 -37.14 20.89 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -91.4 0.79 57.46 Favored 'General case' 0 CA--C 1.506 -0.725 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.223 -178.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 66.17 38.64 4.57 Favored 'General case' 0 CA--C 1.512 -0.507 0 O-C-N 124.059 0.849 . . . . 0.0 109.731 -178.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.3 mm -67.75 116.06 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 178.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 90.8 p -105.94 -166.71 1.23 Allowed 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.465 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -63.35 -25.02 68.06 Favored Glycine 0 N--CA 1.439 -1.154 0 N-CA-C 110.956 -0.858 . . . . 0.0 110.956 177.444 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -56.65 -45.98 81.3 Favored 'General case' 0 CA--C 1.508 -0.635 0 C-N-CA 123.474 0.71 . . . . 0.0 109.786 177.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.573 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -92.61 -14.85 27.62 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.925 -177.485 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.437 HD12 HG23 ' A' ' 12' ' ' VAL . 3.7 tt -69.2 -50.41 47.65 Favored 'General case' 0 C--N 1.311 -1.076 0 O-C-N 123.955 0.784 . . . . 0.0 109.092 179.592 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 37.8 mt -63.92 -42.71 97.32 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.454 -177.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.8 14.97 13.9 Favored 'General case' 0 CA--C 1.564 1.519 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -176.595 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' A' ' 37' ' ' GLN . 35.4 mt -57.01 158.42 4.98 Favored 'General case' 0 C--O 1.246 0.909 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 176.834 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.417 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 3.1 p-10 -165.4 -178.67 5.1 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 177.136 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.81 -41.28 83.09 Favored Glycine 0 C--O 1.214 -1.154 0 CA-C-O 119.256 -0.747 . . . . 0.0 113.464 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -55.63 -46.09 77.47 Favored 'General case' 0 CA--C 1.485 -1.521 0 CA-C-N 117.355 0.578 . . . . 0.0 111.376 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.465 ' HD3' HD23 ' A' ' 41' ' ' LEU . 14.5 mtpp -66.12 -45.67 80.27 Favored 'General case' 0 C--O 1.198 -1.652 0 O-C-N 123.522 0.514 . . . . 0.0 110.724 177.2 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 92.2 mt -60.85 -24.1 65.64 Favored 'General case' 0 C--O 1.258 1.548 0 CA-C-O 121.391 0.615 . . . . 0.0 111.601 -178.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.735 ' HA ' HG22 ' A' ' 52' ' ' THR . 58.1 mtpt -85.16 -39.54 17.75 Favored 'General case' 0 N--CA 1.433 -1.285 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.044 176.589 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.23 -14.15 61.28 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.744 0.783 . . . . 0.0 110.956 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.553 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 3.6 mm? -75.74 3.27 10.13 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.296 172.356 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 63.75 19.22 62.71 Favored Glycine 0 C--N 1.342 0.891 0 CA-C-O 121.283 0.38 . . . . 0.0 112.506 177.608 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 23.1 mmt -103.57 -63.1 1.22 Allowed 'General case' 0 N--CA 1.421 -1.921 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -176.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.735 HG22 ' HA ' ' A' ' 47' ' ' LYS . 29.5 p 57.64 22.25 8.09 Favored 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 124.447 1.099 . . . . 0.0 112.24 176.544 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 35.6 t -61.08 118.74 7.17 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 124.47 1.108 . . . . 0.0 111.248 -174.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.9 m -53.29 -41.24 65.41 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 124.414 1.086 . . . . 0.0 113.609 -176.172 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -65.77 -51.91 55.29 Favored 'General case' 0 CA--C 1.5 -0.945 0 CA-C-O 122.295 1.045 . . . . 0.0 109.922 177.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.674 ' O ' HG12 ' A' ' 60' ' ' VAL . 63.7 m-20 -66.66 -35.92 81.32 Favored 'General case' 0 N--CA 1.419 -2.013 0 CA-C-N 113.734 -1.575 . . . . 0.0 111.364 -170.703 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.7 mmm180 -58.53 -14.68 8.6 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 175.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -107.56 -35.57 6.7 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-O 120.656 0.265 . . . . 0.0 110.965 174.254 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 48.8 tp -81.14 -57.57 3.45 Favored 'General case' 0 C--O 1.241 0.612 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -176.285 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.674 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.7 p -61.31 -21.03 23.94 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.801 0 CA-C-O 121.535 0.683 . . . . 0.0 110.31 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.455 ' HD2' HD21 ' A' ' 64' ' ' LEU . 0.9 OUTLIER -70.22 -26.17 63.74 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.579 -179.689 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.492 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 51.5 tttp -86.98 -40.58 14.63 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 114.939 -1.028 . . . . 0.0 108.828 178.095 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.486 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.6 OUTLIER -69.76 -43.63 71.83 Favored 'General case' 0 C--O 1.19 -2.065 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.801 -175.054 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.455 HD21 ' HD2' ' A' ' 61' ' ' LYS . 3.7 pp -61.58 -30.03 70.41 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.028 0.442 . . . . 0.0 111.805 -175.457 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 53.7 pttt -84.98 -18.97 32.85 Favored 'General case' 0 C--N 1.315 -0.93 0 C-N-CA 119.675 -0.81 . . . . 0.0 112.504 -178.083 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 12.0 pt-20 -111.65 -3.54 15.02 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-O 121.169 0.509 . . . . 0.0 111.116 178.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.457 ' HB3' ' O ' ' A' ' 63' ' ' LYS . 2.6 ppp? -66.41 -28.55 68.71 Favored 'General case' 0 C--O 1.202 -1.435 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -179.264 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -70.76 -9.5 57.49 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.943 178.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 48.6 mtp -109.93 -18.49 13.38 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.433 175.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 23.1 t -103.34 -26.11 13.05 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -171.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.5 ' HG ' HG13 ' A' ' 4' ' ' VAL . 0.0 OUTLIER -53.5 -33.33 53.97 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -175.03 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -68.01 -37.19 81.14 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 121.514 0.673 . . . . 0.0 110.795 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -85.7 -22.18 27.96 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 114.92 -1.036 . . . . 0.0 109.992 -170.603 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.483 0 C-N-CA 125.414 1.485 . . . . 0.0 111.588 178.445 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.618 0 N-CA-C 110.764 -0.934 . . . . 0.0 110.764 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.1 p80 -168.15 10.86 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.911 0.386 . . . . 0.0 110.428 -176.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 62.9 mtt -84.27 168.44 15.68 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 120.656 0.265 . . . . 0.0 111.106 -171.646 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.557 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.5 m -67.4 -29.79 46.84 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.003 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 -169.275 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 19.7 p80 -72.89 -4.54 32.57 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-O 121.445 0.64 . . . . 0.0 110.828 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -103.36 -2.47 26.98 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.291 178.132 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.54 ' CD2' ' HA ' ' A' ' 4' ' ' VAL . 53.2 m0 -83.19 136.99 34.22 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.327 -177.592 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.7 m -90.69 -72.88 0.55 Allowed 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.899 -176.039 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.45 ' O ' HG12 ' A' ' 12' ' ' VAL . 79.4 t -143.56 -65.91 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.199 -1.564 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 -179.476 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 -66.91 -17.92 65.13 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.153 0.501 . . . . 0.0 112.349 -175.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -81.05 -17.75 49.09 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.98 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.495 ' HA ' ' CE3' ' A' ' 7' ' ' TRP . 2.2 p -69.45 -24.95 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-O 121.912 0.863 . . . . 0.0 109.47 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.415 ' HA ' HD12 ' A' ' 16' ' ' LEU . 1.0 OUTLIER -70.58 -23.87 62.67 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-N 114.609 -1.178 . . . . 0.0 111.449 -176.881 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 51.5 m-70 -62.19 -39.19 91.89 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 110.285 -0.265 . . . . 0.0 110.285 -178.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.498 ' O ' HD23 ' A' ' 19' ' ' LEU . 32.6 t90 -67.91 -58.29 4.8 Favored 'General case' 0 N--CA 1.44 -0.94 0 O-C-N 123.816 0.697 . . . . 0.0 109.827 176.274 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.539 HD11 ' CD2' ' A' ' 28' ' ' PHE . 43.9 mt -47.1 -50.17 20.48 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.141 0.976 . . . . 0.0 112.511 -177.369 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 86.1 t -61.5 -26.38 39.36 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.076 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.463 -178.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.76 -26.09 68.06 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 116.33 -0.396 . . . . 0.0 112.197 -177.235 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.498 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -105.6 13.68 29.59 Favored 'General case' 0 C--N 1.321 -0.666 0 O-C-N 122.405 -0.467 . . . . 0.0 111.349 177.89 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.6 m 70.74 21.45 5.24 Favored 'General case' 0 C--O 1.211 -0.94 0 CA-C-O 121.866 0.841 . . . . 0.0 111.611 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.412 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.9 mm? -98.52 19.8 13.91 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.984 178.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -53.04 -25.76 13.51 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.829 0.852 . . . . 0.0 111.163 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -69.63 -18.77 63.62 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 123.504 0.722 . . . . 0.0 110.723 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -85.92 -22.06 27.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.526 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 89.3 t -54.49 -37.98 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 O-C-N 123.633 0.583 . . . . 0.0 111.132 -179.508 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.3 m -52.31 -33.09 40.76 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.077 0.951 . . . . 0.0 112.296 -177.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 53.3 tp10 -111.63 -27.69 8.44 Favored 'General case' 0 N--CA 1.444 -0.732 0 O-C-N 122.358 -0.214 . . . . 0.0 110.802 179.122 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.539 ' CD2' HD11 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -56.68 -42.29 78.79 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 121.677 0.751 . . . . 0.0 109.884 175.138 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 31.0 t -73.73 -21.56 60.17 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.709 -1.132 . . . . 0.0 109.605 -179.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.54 -39.79 24.1 Favored 'General case' 0 N--CA 1.436 -1.132 0 O-C-N 121.905 -0.497 . . . . 0.0 110.907 -176.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -87.36 2.51 50.15 Favored 'General case' 0 CA--C 1.501 -0.94 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.182 -177.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 65.07 34.94 8.34 Favored 'General case' 0 CA--C 1.501 -0.922 0 O-C-N 124.322 1.014 . . . . 0.0 109.713 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.8 mm -66.32 112.41 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.529 0 CA-C-N 114.7 -1.136 . . . . 0.0 108.244 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.489 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 97.5 p -103.46 -170.33 1.77 Allowed 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 178.56 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.557 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.43 -30.04 75.15 Favored Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -51.7 -48.0 63.69 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 123.986 0.914 . . . . 0.0 110.02 175.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.09 -22.51 25.36 Favored 'General case' 0 CA--C 1.502 -0.894 0 C-N-CA 120.49 -0.484 . . . . 0.0 111.786 -177.197 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.4 tt -61.33 -48.63 80.44 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 124.84 1.256 . . . . 0.0 109.272 178.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 35' ' ' GLY . 28.2 mt -65.89 -39.61 90.79 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.604 -178.235 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.55 22.17 7.38 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -177.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.459 HD23 ' HD3' ' A' ' 45' ' ' LYS . 59.7 mt -64.04 158.85 21.5 Favored 'General case' 0 C--O 1.247 0.923 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 176.025 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.478 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 2.8 p30 -164.52 178.28 7.5 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 175.298 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.51 -38.35 70.27 Favored Glycine 0 C--O 1.218 -0.883 0 O-C-N 123.764 0.665 . . . . 0.0 113.898 -177.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -59.89 -42.56 94.06 Favored 'General case' 0 CA--C 1.483 -1.603 0 CA-C-N 117.39 0.595 . . . . 0.0 111.325 -178.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.459 ' HD3' HD23 ' A' ' 41' ' ' LEU . 11.6 mtpp -66.45 -45.01 81.25 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.929 178.127 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 78.3 mt -61.1 -25.28 66.86 Favored 'General case' 0 C--O 1.256 1.419 0 CA-C-O 121.599 0.714 . . . . 0.0 110.966 -179.162 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.814 ' HA ' HG22 ' A' ' 52' ' ' THR . 7.3 mtpm? -82.63 -41.39 19.51 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 114.782 -1.099 . . . . 0.0 110.297 176.016 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.73 -13.44 62.29 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.462 0.705 . . . . 0.0 111.396 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.493 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 3.9 mm? -75.33 -2.36 27.98 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.52 172.289 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 70.65 16.06 73.82 Favored Glycine 0 C--N 1.342 0.864 0 CA-C-O 121.774 0.652 . . . . 0.0 111.598 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 97.7 mmm -100.97 -67.58 0.85 Allowed 'General case' 0 N--CA 1.423 -1.821 0 CA-C-N 114.782 -0.709 . . . . 0.0 110.002 -176.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.814 HG22 ' HA ' ' A' ' 47' ' ' LYS . 20.9 p 65.64 -3.41 0.71 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.863 1.665 . . . . 0.0 113.938 175.202 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.6 m -50.75 121.39 5.82 Favored 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 126.665 1.986 . . . . 0.0 112.427 -173.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.1 p -54.31 -48.77 70.96 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -173.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -56.05 -50.06 72.02 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-O 121.844 0.83 . . . . 0.0 109.832 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.701 ' O ' HG12 ' A' ' 60' ' ' VAL . 4.8 m-20 -63.39 -47.95 79.91 Favored 'General case' 0 CA--C 1.486 -1.485 0 CA-C-N 113.874 -1.512 . . . . 0.0 109.622 -176.114 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 39.1 mmm-85 -49.05 -38.49 24.09 Favored 'General case' 0 CA--C 1.506 -0.721 0 C-N-CA 124.587 1.155 . . . . 0.0 112.44 -179.644 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -83.11 -33.74 26.25 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-O 121.197 0.523 . . . . 0.0 111.402 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.422 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 45.9 tp -80.36 -51.08 9.29 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -174.689 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.701 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.4 p -64.25 -21.26 28.61 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.217 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 4.9 tppp? -69.28 -35.95 76.57 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.149 -178.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.422 ' HG2' ' O ' ' A' ' 59' ' ' LEU . 19.1 ptmt -90.2 -18.75 25.15 Favored 'General case' 0 N--CA 1.419 -1.99 0 CA-C-N 115.089 -0.96 . . . . 0.0 109.507 -176.057 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.438 ' HG2' HD13 ' A' ' 19' ' ' LEU . 1.8 tppt? -84.56 -38.79 19.55 Favored 'General case' 0 C--O 1.199 -1.588 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.035 177.166 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.6 pp -66.42 -14.55 62.33 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.619 0.368 . . . . 0.0 111.731 -176.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 59.4 pttt -90.03 -12.99 36.94 Favored 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.477 176.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.501 ' O ' ' HG2' ' A' ' 69' ' ' MET . 11.7 pt-20 -135.02 18.93 3.45 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-O 123.041 1.4 . . . . 0.0 109.985 -176.544 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.524 ' N ' ' SD ' ' A' ' 67' ' ' MET . 0.0 OUTLIER -59.66 -20.68 57.79 Favored 'General case' 0 C--N 1.293 -1.869 0 C-N-CA 127.162 2.185 . . . . 0.0 110.245 178.246 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -68.33 -23.7 64.74 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.689 178.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.501 ' HG2' ' O ' ' A' ' 66' ' ' GLU . 23.0 ptp -102.42 -30.67 10.88 Favored 'General case' 0 C--O 1.248 0.983 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 174.337 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.428 ' HB2' ' HA ' ' A' ' 67' ' ' MET . 38.0 m -71.85 -27.18 62.71 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.655 -177.023 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.483 HD12 ' N ' ' A' ' 72' ' ' GLU . 4.5 pp -54.12 -33.61 58.21 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-O 121.419 0.628 . . . . 0.0 112.056 176.101 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.483 ' N ' HD12 ' A' ' 71' ' ' LEU . 18.7 tt0 -84.41 -44.61 13.55 Favored 'General case' 0 N--CA 1.4 -2.958 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.822 -175.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -80.32 -51.93 8.3 Favored 'General case' 0 N--CA 1.432 -1.329 0 C-N-CA 119.898 -0.721 . . . . 0.0 111.407 -172.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.257 1.489 0 C-N-CA 125.362 1.465 . . . . 0.0 112.702 179.399 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.056 0 N-CA-C 112.228 -0.349 . . . . 0.0 112.228 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -124.87 -29.3 3.39 Favored 'General case' 0 C--N 1.314 -0.955 0 O-C-N 122.521 -0.4 . . . . 0.0 110.352 -178.183 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.46 ' HB3' ' CE1' ' A' ' 5' ' ' HIS . 23.0 mmt -84.87 154.3 22.36 Favored 'General case' 0 N--CA 1.427 -1.596 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.183 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.682 HG13 HD22 ' A' ' 71' ' ' LEU . 6.8 m -74.09 -28.7 23.89 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.991 0 CA-C-N 116.03 -0.532 . . . . 0.0 112.311 -171.377 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.46 ' CE1' ' HB3' ' A' ' 3' ' ' MET . 20.5 p-80 -71.67 -12.8 61.51 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-O 120.97 0.414 . . . . 0.0 110.801 178.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -91.03 -19.43 23.2 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.625 177.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.448 ' CH2' HG12 ' A' ' 4' ' ' VAL . 50.7 m0 -58.36 145.38 38.39 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -174.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.4 m -95.43 -80.36 0.42 Allowed 'General case' 0 N--CA 1.415 -2.184 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.465 -175.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.513 ' O ' HG12 ' A' ' 12' ' ' VAL . 73.8 t -146.03 -61.85 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.554 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 -178.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.5 pm0 -67.34 -17.69 64.85 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.542 -177.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -80.02 -17.68 52.16 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.402 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.513 HG12 ' O ' ' A' ' 9' ' ' VAL . 2.6 p -74.27 -21.86 17.78 Favored 'Isoleucine or valine' 0 C--O 1.245 0.847 0 CA-C-O 121.908 0.861 . . . . 0.0 109.096 -177.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.87 -26.58 64.26 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.957 -177.539 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 -62.47 -32.59 73.51 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.332 0.587 . . . . 0.0 109.7 -177.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.483 ' CH2' HG23 ' A' ' 60' ' ' VAL . 28.4 t90 -74.24 -58.82 3.04 Favored 'General case' 0 N--CA 1.427 -1.591 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.473 175.781 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.439 HD11 ' CG ' ' A' ' 28' ' ' PHE . 38.8 mt -48.05 -48.85 32.97 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.261 1.024 . . . . 0.0 112.5 -176.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 77.2 t -60.5 -29.25 44.18 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 CA-C-O 120.769 0.319 . . . . 0.0 110.97 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -71.72 -22.2 78.74 Favored Glycine 0 N--CA 1.442 -0.952 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.406 -176.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.485 HD13 ' HG2' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -113.7 17.8 17.91 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 117.076 0.438 . . . . 0.0 111.716 177.791 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.5 m 68.84 20.82 7.87 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.699 0.8 . . . . 0.0 112.063 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.464 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.8 mm? -98.94 18.34 17.42 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.963 179.573 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.501 ' HA ' HG23 ' A' ' 25' ' ' VAL . 8.7 p-10 -52.34 -25.2 9.03 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.912 0.885 . . . . 0.0 111.216 175.284 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -64.47 -23.75 67.39 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 124.023 0.929 . . . . 0.0 111.373 178.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.501 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 3.0 m-85 -86.57 -20.79 27.43 Favored 'General case' 0 N--CA 1.437 -1.087 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.87 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.501 HG23 ' HA ' ' A' ' 22' ' ' ASP . 90.7 t -53.08 -40.87 39.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 C-N-CA 123.495 0.718 . . . . 0.0 111.404 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.9 m -53.7 -35.49 61.19 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.237 0.615 . . . . 0.0 112.163 -177.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.612 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 21.2 tp10 -103.7 -28.94 11.37 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.851 -179.694 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.439 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.9 m-85 -56.22 -32.99 64.94 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-O 121.851 0.834 . . . . 0.0 109.965 176.403 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.485 ' HA ' HG13 ' A' ' 9' ' ' VAL . 21.6 p -80.76 -31.73 35.79 Favored 'General case' 0 N--CA 1.423 -1.823 0 CA-C-N 114.809 -1.087 . . . . 0.0 111.722 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.36 -45.5 76.15 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-O 121.819 0.819 . . . . 0.0 110.441 -176.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -94.72 14.72 20.29 Favored 'General case' 0 C--N 1.299 -1.617 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.815 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . 0.285 4.3 p30 46.05 60.92 2.93 Favored 'General case' 0 CA--C 1.502 -0.892 0 CA-C-O 122.476 1.132 . . . . 0.0 113.429 177.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 49.5 mm -85.11 117.51 30.43 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.846 0 CA-C-N 113.86 -1.518 . . . . 0.0 107.024 176.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.6 p -106.59 -166.03 1.14 Allowed 'General case' 0 C--N 1.293 -1.861 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 177.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.472 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -64.15 -25.81 69.91 Favored Glycine 0 N--CA 1.441 -1.007 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 178.702 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -57.38 -45.21 84.7 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 123.693 0.797 . . . . 0.0 109.381 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.57 -3.22 43.42 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.539 -179.2 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.477 HD12 HG23 ' A' ' 12' ' ' VAL . 3.5 tt -81.85 -51.11 8.44 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 46.6 mt -61.08 -30.85 70.59 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.473 -176.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.09 13.63 33.7 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 -179.3 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.443 ' HB2' HD22 ' A' ' 64' ' ' LEU . 37.8 mt -47.32 148.39 1.31 Allowed 'General case' 0 C--O 1.246 0.872 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 179.267 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.456 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 12.8 t70 -143.9 165.44 27.71 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 106.368 -1.716 . . . . 0.0 106.368 -175.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -57.28 -38.23 85.29 Favored Glycine 0 C--O 1.214 -1.143 0 N-CA-C 109.646 -1.382 . . . . 0.0 109.646 175.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -54.28 -47.98 71.75 Favored 'General case' 0 CA--C 1.495 -1.146 0 C-N-CA 123.806 0.843 . . . . 0.0 111.168 177.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.426 ' O ' HD23 ' A' ' 49' ' ' LEU . 14.2 mtpp -63.97 -46.64 83.71 Favored 'General case' 0 C--O 1.199 -1.555 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.531 177.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 83.4 mt -58.73 -25.49 63.02 Favored 'General case' 0 C--O 1.256 1.435 0 CA-C-O 121.604 0.716 . . . . 0.0 111.181 -179.272 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.775 ' HA ' HG22 ' A' ' 52' ' ' THR . 23.8 mtpp -83.43 -36.62 24.08 Favored 'General case' 0 N--CA 1.432 -1.357 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.467 176.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.34 -16.38 61.88 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.541 0.686 . . . . 0.0 111.127 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.612 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.6 mm? -73.68 -6.66 48.19 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.631 0.729 . . . . 0.0 109.094 172.479 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 69.87 4.52 48.16 Favored Glycine 0 CA--C 1.502 -0.779 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.512 177.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.605 ' HG3' ' OG ' ' A' ' 53' ' ' SER . 30.2 tpp -88.0 -51.16 5.97 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 -176.76 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.775 HG22 ' HA ' ' A' ' 47' ' ' LYS . 62.0 p 51.66 23.45 1.96 Allowed 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 125.257 1.423 . . . . 0.0 113.826 174.346 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.605 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 12.9 m -62.27 127.02 29.35 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 124.29 1.036 . . . . 0.0 111.939 -174.264 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.1 m -55.2 -51.25 67.15 Favored 'General case' 0 CA--C 1.553 1.079 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -172.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -58.33 -54.27 48.95 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 122.836 1.303 . . . . 0.0 109.634 178.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.743 ' O ' HG12 ' A' ' 60' ' ' VAL . 6.2 m-20 -59.57 -44.16 93.38 Favored 'General case' 0 C--N 1.282 -2.368 0 CA-C-N 112.279 -2.237 . . . . 0.0 111.026 -172.071 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.1 mmm180 -54.26 -23.17 13.88 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 177.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -100.18 -34.16 10.14 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.962 0.41 . . . . 0.0 110.78 176.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 48.7 tp -77.22 -57.29 3.92 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -176.35 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.743 HG12 ' O ' ' A' ' 56' ' ' ASP . 4.8 p -60.15 -21.01 21.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 CA-C-O 121.729 0.776 . . . . 0.0 110.628 -179.292 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 15.1 tppt? -65.62 -35.03 79.62 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 114.296 -1.32 . . . . 0.0 109.846 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -91.68 -30.25 16.41 Favored 'General case' 0 C--N 1.292 -1.897 0 CA-C-N 114.788 -1.097 . . . . 0.0 109.989 -177.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.485 ' HG2' HD13 ' A' ' 19' ' ' LEU . 2.8 tppt? -72.08 -40.73 68.03 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 115.067 -0.969 . . . . 0.0 111.29 -178.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.443 HD22 ' HB2' ' A' ' 41' ' ' LEU . 3.8 pp -59.2 -30.09 67.97 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.884 0.373 . . . . 0.0 111.677 -176.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -82.63 -22.27 34.78 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 120.37 -0.532 . . . . 0.0 111.901 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -101.03 -13.6 18.17 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 121.062 0.458 . . . . 0.0 110.178 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.46 ' HA ' ' HB3' ' A' ' 70' ' ' SER . 1.9 ppp? -60.85 -25.51 66.71 Favored 'General case' 0 C--O 1.195 -1.779 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.905 -173.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.573 ' HA ' HD23 ' A' ' 71' ' ' LEU . 17.3 ptmt -71.02 -18.87 62.57 Favored 'General case' 0 C--N 1.294 -1.847 0 CA-C-O 121.05 0.452 . . . . 0.0 112.116 -178.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 54.5 mtm -100.48 -33.4 10.36 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 122.257 1.027 . . . . 0.0 108.279 174.376 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.46 ' HB3' ' HA ' ' A' ' 67' ' ' MET . 32.4 t -81.85 -23.93 36.11 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 114.189 -1.369 . . . . 0.0 112.453 -171.825 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.682 HD22 HG13 ' A' ' 4' ' ' VAL . 4.5 pp -49.42 -34.67 17.03 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.579 1.152 . . . . 0.0 112.322 -177.555 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.478 ' N ' HD12 ' A' ' 71' ' ' LEU . 20.8 tt0 -69.59 -47.46 63.46 Favored 'General case' 0 N--CA 1.421 -1.89 0 CA-C-N 114.422 -1.263 . . . . 0.0 112.678 -178.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 43.3 mtpt -95.61 -44.1 7.64 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.189 -166.652 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.163 0 C-N-CA 125.256 1.422 . . . . 0.0 109.89 -172.816 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.883 0 N-CA-C 109.98 -1.248 . . . . 0.0 109.98 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -100.88 -12.63 18.83 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 117.389 0.594 . . . . 0.0 110.72 -178.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 67.7 mtt -78.66 158.49 28.37 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.224 -178.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.572 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 4.4 m -65.02 -31.18 52.81 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.022 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -167.611 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 15.0 p80 -70.62 -13.39 62.07 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 121.478 0.656 . . . . 0.0 110.719 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -96.17 -4.27 42.9 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.138 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.523 ' CD2' ' HA ' ' A' ' 4' ' ' VAL . 52.3 m0 -83.77 142.16 30.88 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.62 -178.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 21.3 m -103.58 -72.14 0.71 Allowed 'General case' 0 N--CA 1.423 -1.813 0 CA-C-O 121.195 0.522 . . . . 0.0 110.918 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.539 ' O ' HG12 ' A' ' 12' ' ' VAL . 69.9 t -139.57 -61.7 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.208 -1.12 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 -176.771 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.7 pm0 -66.01 -19.86 66.0 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.305 -176.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.401 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 37.2 mt-30 -86.23 -17.74 33.96 Favored 'General case' 0 N--CA 1.435 -1.212 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.477 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.539 HG12 ' O ' ' A' ' 9' ' ' VAL . 3.2 p -72.39 -24.27 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 CA-C-O 121.79 0.805 . . . . 0.0 109.785 -177.513 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.455 ' O ' HG23 ' A' ' 17' ' ' VAL . 1.1 m -71.22 -27.89 63.81 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.357 -177.19 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' HIS . . . . . 0.401 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 33.2 m-70 -59.54 -40.57 87.66 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-O 120.978 0.418 . . . . 0.0 110.095 -178.225 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.466 ' CH2' HG23 ' A' ' 60' ' ' VAL . 35.6 t90 -64.65 -57.22 9.65 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.51 177.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.447 HD11 ' CG ' ' A' ' 28' ' ' PHE . 41.4 mt -49.02 -46.32 43.91 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.932 0.893 . . . . 0.0 112.138 -177.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 13' ' ' SER . 98.1 t -61.2 -26.21 38.58 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.208 0 CA-C-O 121.208 0.528 . . . . 0.0 111.114 -179.293 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.95 -24.84 73.04 Favored Glycine 0 N--CA 1.438 -1.198 0 C-N-CA 121.32 -0.467 . . . . 0.0 112.491 -177.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.516 HD13 ' CB ' ' A' ' 63' ' ' LYS . 0.7 OUTLIER -114.49 21.97 14.08 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -179.06 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.1 m 71.49 17.5 5.69 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.756 0.789 . . . . 0.0 111.266 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.468 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.3 mm? -100.54 15.12 29.05 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.311 -177.15 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.453 ' HA ' HG23 ' A' ' 25' ' ' VAL . 7.2 p-10 -56.02 -19.6 13.34 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 121.253 0.549 . . . . 0.0 111.6 174.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -68.38 -23.72 64.7 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 124.125 0.97 . . . . 0.0 111.112 176.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -86.86 -19.81 28.38 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.592 -179.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.453 HG23 ' HA ' ' A' ' 22' ' ' ASP . 88.7 t -52.21 -39.24 26.76 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 C-N-CA 123.117 0.567 . . . . 0.0 111.654 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.1 m -51.25 -37.63 48.18 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.085 0.954 . . . . 0.0 112.166 -178.144 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 14.9 tp10 -103.28 -31.73 9.93 Favored 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.112 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.447 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.3 m-85 -54.49 -45.33 73.23 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 121.198 0.523 . . . . 0.0 111.618 178.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 35.2 m -76.32 -16.88 59.67 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.71 -178.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -79.69 -35.04 39.68 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.699 -178.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -90.87 2.56 56.05 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 119.844 -0.742 . . . . 0.0 110.04 -177.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 67.0 32.84 6.08 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.105 178.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.3 mm -64.39 118.73 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.051 -178.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.505 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 93.3 p -107.07 -172.35 2.06 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 176.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.572 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -64.43 -22.77 67.9 Favored Glycine 0 N--CA 1.439 -1.164 0 N-CA-C 111.184 -0.767 . . . . 0.0 111.184 179.38 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -59.5 -45.78 90.7 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 123.219 0.608 . . . . 0.0 109.366 176.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.435 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -88.48 -17.05 31.17 Favored 'General case' 0 CA--C 1.494 -1.21 0 C-N-CA 120.413 -0.515 . . . . 0.0 111.47 -178.447 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.453 HD12 HG23 ' A' ' 12' ' ' VAL . 2.1 tt -69.51 -49.59 53.17 Favored 'General case' 0 C--N 1.308 -1.198 0 O-C-N 124.367 1.042 . . . . 0.0 108.802 -179.654 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.9 mt -59.6 -42.54 92.8 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.551 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.57 25.84 3.77 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -178.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.499 ' CB ' HD22 ' A' ' 64' ' ' LEU . 28.2 mt -65.74 161.4 20.85 Favored 'General case' 0 C--O 1.247 0.924 0 CA-C-O 121.173 0.511 . . . . 0.0 111.869 175.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -167.94 176.73 6.03 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.79 -39.09 93.32 Favored Glycine 0 CA--C 1.497 -1.07 0 CA-C-O 119.608 -0.551 . . . . 0.0 112.193 -178.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -51.12 -48.18 61.81 Favored 'General case' 0 CA--C 1.506 -0.731 0 C-N-CA 123.331 0.652 . . . . 0.0 110.667 178.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.423 ' HD3' HD23 ' A' ' 41' ' ' LEU . 11.2 mtpp -67.65 -44.88 76.85 Favored 'General case' 0 C--O 1.197 -1.67 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.297 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 91.3 mt -59.46 -28.84 67.35 Favored 'General case' 0 C--O 1.255 1.343 0 CA-C-O 121.488 0.661 . . . . 0.0 111.734 -179.134 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.685 ' HA ' HG22 ' A' ' 52' ' ' THR . 22.2 mtpp -76.77 -33.07 58.08 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.906 176.593 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.03 -12.78 60.02 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.685 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.523 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.5 mm? -78.56 -2.16 37.46 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.347 0.594 . . . . 0.0 109.421 173.11 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.07 -0.72 37.03 Favored Glycine 0 C--O 1.216 -1.017 0 CA-C-N 115.832 -0.622 . . . . 0.0 113.185 176.169 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 24.6 mmt -85.33 -53.72 5.04 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 120.721 0.296 . . . . 0.0 111.365 -177.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.685 HG22 ' HA ' ' A' ' 47' ' ' LYS . 20.0 p 56.11 25.22 8.75 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.584 1.154 . . . . 0.0 112.547 174.1 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 47.4 t -68.28 127.66 33.74 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 123.289 0.636 . . . . 0.0 111.158 -174.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.6 m -58.01 -44.33 87.21 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -175.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -58.94 -55.34 36.44 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.969 0.89 . . . . 0.0 109.658 178.172 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.733 ' O ' HG12 ' A' ' 60' ' ' VAL . 48.5 m-20 -62.33 -38.58 90.03 Favored 'General case' 0 N--CA 1.42 -1.967 0 CA-C-N 113.838 -1.528 . . . . 0.0 111.245 -173.172 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 46.9 mmm-85 -56.53 -15.7 4.74 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 176.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -108.57 -39.29 5.44 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-O 121.042 0.449 . . . . 0.0 110.169 175.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 47.6 tp -73.68 -54.93 6.97 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -173.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.733 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.0 p -64.64 -25.13 37.12 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.02 0 CA-C-O 121.352 0.596 . . . . 0.0 110.195 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.489 ' HD2' HD21 ' A' ' 64' ' ' LEU . 19.1 mmmt -70.91 -23.75 62.33 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.662 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.503 ' O ' ' HG2' ' A' ' 65' ' ' LYS . 22.5 ttmm -87.39 -40.88 14.02 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 114.656 -1.156 . . . . 0.0 108.964 178.158 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.516 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -72.6 -34.11 67.16 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-N 115.344 -0.844 . . . . 0.0 112.699 -178.344 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.499 HD22 ' CB ' ' A' ' 41' ' ' LEU . 3.2 pp -72.34 -24.56 61.31 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.003 0.43 . . . . 0.0 111.352 -177.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 21.5 ptmt -83.98 -9.33 58.76 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 120.465 -0.494 . . . . 0.0 111.339 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -119.9 7.77 10.98 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.441 ' SD ' HG11 ' A' ' 4' ' ' VAL . 3.8 tmm? -60.59 -31.07 70.23 Favored 'General case' 0 C--O 1.188 -2.147 0 CA-C-N 114.291 -1.322 . . . . 0.0 111.181 -170.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.447 ' HA ' HD23 ' A' ' 71' ' ' LEU . 22.7 pttm -68.63 -16.19 63.76 Favored 'General case' 0 C--N 1.282 -2.34 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 178.326 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 27.4 ptm -112.62 -11.18 13.59 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.421 0.629 . . . . 0.0 109.342 174.069 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 67.1 m -107.77 -11.02 15.48 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -176.354 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.507 HD12 ' N ' ' A' ' 72' ' ' GLU . 4.4 pp -54.63 -31.6 57.53 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.874 0.845 . . . . 0.0 111.353 173.453 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.507 ' N ' HD12 ' A' ' 71' ' ' LEU . 6.8 tt0 -68.31 -29.5 68.28 Favored 'General case' 0 N--CA 1.427 -1.617 0 CA-C-N 114.12 -1.4 . . . . 0.0 111.303 179.36 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -98.7 26.02 6.0 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 121.678 0.751 . . . . 0.0 110.437 -169.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.28 -2.446 0 CA-C-N 114.432 -1.258 . . . . 0.0 108.638 -178.062 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.555 0 N-CA-C 111.114 -0.794 . . . . 0.0 111.114 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -116.64 -0.29 12.43 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -176.581 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 78.0 mtm -76.84 167.77 21.26 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.564 -179.017 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.52 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.5 m -64.21 -29.93 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 N-CA-C 113.842 1.052 . . . . 0.0 113.842 -167.594 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 15.6 p-80 -70.77 -8.47 52.55 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-O 121.175 0.512 . . . . 0.0 111.223 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -99.75 -8.02 24.78 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.631 0.772 . . . . 0.0 109.862 177.234 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.521 ' O ' ' HB2' ' A' ' 34' ' ' SER . 50.1 m0 -74.53 133.01 42.32 Favored 'General case' 0 CA--C 1.489 -1.373 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -178.477 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.41 ' O ' ' HB3' ' A' ' 34' ' ' SER . 3.3 m -91.3 -75.51 0.47 Allowed 'General case' 0 N--CA 1.428 -1.56 0 CA-C-O 121.317 0.579 . . . . 0.0 110.156 -175.936 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.474 ' O ' HG12 ' A' ' 12' ' ' VAL . 97.9 t -140.83 -63.83 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.2 -1.535 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 179.129 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -62.88 -18.79 63.46 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.98 -177.442 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.459 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 46.7 mt-30 -82.13 -20.97 36.92 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.142 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.509 HG23 HD12 ' A' ' 38' ' ' LEU . 1.3 p -76.49 -26.42 16.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 CA-C-O 122.114 0.959 . . . . 0.0 108.652 -178.119 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.426 ' HA ' HD12 ' A' ' 16' ' ' LEU . 2.5 m -66.05 -33.41 75.73 Favored 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 114.479 -1.237 . . . . 0.0 112.342 -176.684 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' HIS . . . . . 0.459 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 44.6 m-70 -59.35 -37.67 78.45 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.666 0.746 . . . . 0.0 109.028 -178.013 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.543 ' O ' HD23 ' A' ' 19' ' ' LEU . 42.3 t90 -67.67 -58.89 3.87 Favored 'General case' 0 N--CA 1.424 -1.766 0 CA-C-N 114.374 -1.285 . . . . 0.0 109.983 176.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.448 HD11 ' CD2' ' A' ' 28' ' ' PHE . 46.8 mt -47.99 -49.83 29.49 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 124.181 0.992 . . . . 0.0 111.945 -178.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 94.5 t -67.21 -18.09 23.59 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.225 -178.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -86.79 -33.13 13.25 Favored Glycine 0 N--CA 1.438 -1.213 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 -176.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.543 HD23 ' O ' ' A' ' 15' ' ' TRP . 1.8 pt? -95.09 12.19 29.48 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.207 178.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.7 m 66.06 40.58 3.93 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 122.295 1.045 . . . . 0.0 110.29 -178.149 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.434 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.7 mm? -119.63 20.04 12.44 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 113.947 -1.479 . . . . 0.0 109.36 177.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.466 ' HA ' HG12 ' A' ' 25' ' ' VAL . 4.6 p-10 -55.57 -14.74 2.26 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-O 121.57 0.7 . . . . 0.0 112.139 174.189 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -65.97 -26.13 67.42 Favored 'General case' 0 C--N 1.293 -1.879 0 C-N-CA 123.978 0.911 . . . . 0.0 110.343 174.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.589 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 6.8 m-85 -89.77 -25.13 21.28 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -177.534 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.556 ' HA ' ' HB2' ' A' ' 28' ' ' PHE 0.325 1.4 p -59.64 -26.6 35.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 178.81 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.2 m -59.15 -27.88 66.06 Favored 'General case' 0 CA--C 1.562 1.439 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.887 177.14 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 16.0 tp10 -112.02 -33.31 6.31 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 179.305 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.556 ' HB2' ' HA ' ' A' ' 25' ' ' VAL . 3.5 m-85 -54.39 -40.96 68.7 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 121.011 0.434 . . . . 0.0 110.407 175.817 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.1 t -72.37 -22.91 61.07 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.252 -178.441 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -80.03 -37.56 33.79 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.611 -177.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -94.88 4.83 53.36 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 119.844 -0.743 . . . . 0.0 111.291 -178.485 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 61.1 39.13 16.49 Favored 'General case' 0 C--N 1.351 0.65 0 C-N-CA 123.148 0.579 . . . . 0.0 109.586 179.299 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.2 mm -66.37 110.02 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.049 0 CA-C-N 115.304 -0.862 . . . . 0.0 108.698 -179.607 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.521 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 78.5 p -105.76 -169.68 1.62 Allowed 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.52 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -58.73 -31.83 68.41 Favored Glycine 0 N--CA 1.445 -0.716 0 O-C-N 123.575 0.547 . . . . 0.0 112.102 -179.557 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -53.49 -50.12 66.05 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 123.678 0.791 . . . . 0.0 110.075 176.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.533 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -86.79 -17.3 33.85 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.229 -177.799 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.509 HD12 HG23 ' A' ' 12' ' ' VAL . 2.1 tt -70.51 -51.38 29.29 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.924 0.89 . . . . 0.0 109.171 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 47.1 mt -61.01 -36.05 78.47 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-O 121.341 0.591 . . . . 0.0 112.419 -176.316 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.76 17.63 23.38 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.05 -177.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 37' ' ' GLN . 21.4 mt -54.6 154.94 4.42 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 121.789 0.804 . . . . 0.0 112.203 176.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -161.89 168.24 23.32 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 -175.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.15 -38.05 65.88 Favored Glycine 0 C--O 1.209 -1.41 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 177.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -51.48 -48.48 62.85 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 122.674 0.389 . . . . 0.0 111.093 176.089 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.3 mtpp -70.06 -45.31 67.35 Favored 'General case' 0 C--O 1.193 -1.915 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.89 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 94.3 mt -56.61 -38.04 71.5 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-O 121.825 0.821 . . . . 0.0 110.751 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.785 ' HA ' HG22 ' A' ' 52' ' ' THR . 24.5 mtpp -69.73 -36.58 75.98 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.161 177.493 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.85 -10.68 59.73 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 123.223 0.609 . . . . 0.0 111.378 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.521 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.2 mm? -84.55 -1.94 56.61 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.522 0.677 . . . . 0.0 109.286 173.739 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 70.62 7.11 60.59 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.761 -0.654 . . . . 0.0 114.284 174.193 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.589 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 40.3 tpp -90.29 -53.93 4.24 Favored 'General case' 0 C--N 1.311 -1.078 0 C-N-CA 119.07 -1.052 . . . . 0.0 109.3 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.785 HG22 ' HA ' ' A' ' 47' ' ' LYS . 63.7 p 54.9 33.25 19.57 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 124.586 1.154 . . . . 0.0 112.714 172.118 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.524 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 60.5 m -70.66 -174.68 0.93 Allowed 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 123.473 0.709 . . . . 0.0 112.909 -178.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.1 p -102.01 -41.18 6.54 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -60.8 -45.36 94.72 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.498 0.666 . . . . 0.0 111.036 -177.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.637 ' O ' HG12 ' A' ' 60' ' ' VAL . 11.5 p-10 -66.01 -45.21 82.37 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.89 -172.445 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 56.6 mmm-85 -56.33 -18.59 11.28 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 123.332 0.653 . . . . 0.0 111.954 -176.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -104.15 -44.26 5.03 Favored 'General case' 0 N--CA 1.419 -1.994 0 CA-C-O 121.048 0.451 . . . . 0.0 110.213 174.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 23.4 tp -76.84 -55.99 5.0 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -172.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.637 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.6 p -65.51 -22.04 30.24 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.779 0 CA-C-O 121.419 0.628 . . . . 0.0 109.37 -178.483 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -68.92 -31.21 69.94 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 114.254 -1.339 . . . . 0.0 108.8 -177.004 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -86.41 -42.14 13.88 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.425 -1.261 . . . . 0.0 109.39 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.505 ' HE3' ' HB2' ' A' ' 19' ' ' LEU . 0.9 OUTLIER -65.29 -40.84 94.37 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.213 -176.785 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.544 ' HA ' ' HG2' ' A' ' 67' ' ' MET . 3.6 pp -64.1 -32.36 73.89 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.163 -177.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -80.81 -18.88 46.04 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.287 -0.565 . . . . 0.0 111.999 -178.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -108.3 9.98 27.78 Favored 'General case' 0 C--N 1.318 -0.775 0 O-C-N 122.474 -0.141 . . . . 0.0 111.082 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.544 ' HG2' ' HA ' ' A' ' 64' ' ' LEU . 89.6 mmm -51.09 -41.11 59.77 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 121.091 0.472 . . . . 0.0 112.066 -178.434 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 14.6 ptpt -64.12 -22.46 66.94 Favored 'General case' 0 C--N 1.291 -1.943 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -174.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 27.3 ptt? -112.17 9.13 20.1 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-O 121.248 0.547 . . . . 0.0 109.939 178.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 40.0 m -122.51 -32.85 3.53 Favored 'General case' 0 C--O 1.209 -1.06 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.276 -178.037 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.483 HD22 HG13 ' A' ' 4' ' ' VAL . 4.5 pp -51.56 -30.17 19.83 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 -174.146 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.47 ' N ' HD12 ' A' ' 71' ' ' LEU . 11.8 tt0 -98.27 -36.2 10.1 Favored 'General case' 0 N--CA 1.414 -2.243 0 CA-C-O 121.382 0.61 . . . . 0.0 111.492 178.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -84.52 -37.73 20.91 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.401 -169.324 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.429 -1.494 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -176.465 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.324 0 N-CA-C 111.648 -0.581 . . . . 0.0 111.648 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 50.2 p-80 -95.21 -8.22 36.82 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 122.959 0.504 . . . . 0.0 110.452 -175.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.442 ' O ' ' HB2' ' A' ' 6' ' ' GLU . 66.5 mtt -70.31 165.04 23.16 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.544 -173.565 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.528 HG13 HD22 ' A' ' 71' ' ' LEU . 3.6 m -68.24 -30.34 47.46 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -168.857 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.7 p80 -70.54 -7.27 42.52 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-O 121.498 0.666 . . . . 0.0 110.783 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.442 ' HB2' ' O ' ' A' ' 3' ' ' MET . 9.1 mm-40 -99.61 -9.41 23.23 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 124.268 1.027 . . . . 0.0 110.298 178.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.551 ' HA ' ' NE2' ' A' ' 11' ' ' GLN . 54.4 m0 -76.03 142.35 41.85 Favored 'General case' 0 CA--C 1.504 -0.794 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.307 -175.696 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.9 m -94.81 -79.42 0.43 Allowed 'General case' 0 N--CA 1.418 -2.039 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.862 -178.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.506 ' O ' HG12 ' A' ' 12' ' ' VAL . 94.9 t -141.77 -59.66 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -179.46 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.6 pm0 -60.46 -26.45 66.78 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.03 -0.987 . . . . 0.0 111.437 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.551 ' NE2' ' HA ' ' A' ' 7' ' ' TRP . 23.8 mt-30 -81.31 -16.99 50.8 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 115.01 -0.995 . . . . 0.0 112.356 -175.425 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.506 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.7 p -79.91 -20.17 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 121.894 0.854 . . . . 0.0 109.073 -179.379 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.44 ' HA ' HD12 ' A' ' 16' ' ' LEU . 2.5 m -77.15 -23.51 51.64 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.461 -174.306 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 45.3 m80 -60.63 -41.01 94.01 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 178.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.497 ' O ' HD23 ' A' ' 19' ' ' LEU . 31.3 t90 -61.99 -60.03 4.22 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 114.649 -1.16 . . . . 0.0 110.163 177.699 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.459 HD11 ' CG ' ' A' ' 28' ' ' PHE . 43.3 mt -47.97 -47.61 32.72 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.262 1.025 . . . . 0.0 112.441 -177.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 89.4 t -64.43 -22.55 31.46 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.168 0 CA-C-O 121.257 0.551 . . . . 0.0 111.018 -179.258 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.11 -29.84 61.95 Favored Glycine 0 N--CA 1.442 -0.913 0 CA-C-N 116.23 -0.441 . . . . 0.0 112.105 -179.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.523 HD13 ' CB ' ' A' ' 63' ' ' LYS . 0.6 OUTLIER -108.69 17.67 21.66 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -178.821 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.2 m 68.17 25.28 7.36 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 121.845 0.831 . . . . 0.0 111.169 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.473 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.1 mm? -103.62 16.29 26.79 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 124.247 1.019 . . . . 0.0 109.383 178.857 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -51.5 -26.51 8.52 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.078 0.951 . . . . 0.0 111.606 175.504 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -64.38 -23.52 67.32 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 124.066 0.946 . . . . 0.0 111.129 178.523 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.447 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 2.0 m-85 -85.89 -19.01 31.19 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.34 -178.431 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 95.7 t -53.64 -38.56 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.863 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.9 t -50.01 -39.23 40.69 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.774 0.829 . . . . 0.0 111.734 -179.067 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 12.3 tp10 -104.22 -30.53 10.12 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 120.978 -0.289 . . . . 0.0 110.829 -178.621 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.459 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.7 m-85 -56.18 -39.22 72.05 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 121.48 0.657 . . . . 0.0 110.238 176.656 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.8 t -76.05 -30.16 58.31 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.403 179.013 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.76 -45.18 72.06 Favored 'General case' 0 CA--C 1.504 -0.817 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.01 -176.524 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.439 ' HG3' HG12 ' A' ' 33' ' ' ILE . 4.3 pt20 -94.7 13.94 22.78 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 -178.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 57.57 39.91 27.32 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.857 0.863 . . . . 0.0 111.837 174.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.439 HG12 ' HG3' ' A' ' 31' ' ' GLN . 49.9 mm -68.84 115.47 7.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -179.526 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.475 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 89.6 p -108.7 -170.21 1.63 Allowed 'General case' 0 N--CA 1.423 -1.789 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 178.179 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.481 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -60.04 -32.72 76.51 Favored Glycine 0 CA--C 1.507 -0.406 0 N-CA-C 111.379 -0.688 . . . . 0.0 111.379 -179.748 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -50.28 -45.27 54.32 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 125.146 1.378 . . . . 0.0 110.387 176.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.471 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -96.79 -14.8 21.69 Favored 'General case' 0 C--O 1.214 -0.765 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 179.778 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.465 HD22 ' HG3' ' A' ' 67' ' ' MET . 2.6 tt -69.03 -53.06 22.47 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 -179.226 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 36.3 mt -60.3 -36.23 77.4 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.949 -176.645 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.36 10.51 39.45 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 113.755 1.021 . . . . 0.0 113.755 -175.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.721 ' HB2' HD22 ' A' ' 64' ' ' LEU . 41.0 mt -54.51 136.14 45.01 Favored 'General case' 0 C--O 1.243 0.745 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 179.28 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.408 ' OD1' ' HG3' ' A' ' 45' ' ' LYS . 4.0 p-10 -134.78 -177.77 4.77 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 177.148 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.18 -41.99 95.05 Favored Glycine 0 C--O 1.211 -1.338 0 CA-C-O 119.169 -0.795 . . . . 0.0 113.412 -178.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -62.52 -37.43 86.0 Favored 'General case' 0 CA--C 1.475 -1.932 0 CA-C-N 117.654 0.727 . . . . 0.0 112.442 -177.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HG3' ' OD1' ' A' ' 42' ' ' ASP . 8.5 mtpp -63.48 -49.6 72.97 Favored 'General case' 0 C--N 1.299 -1.6 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.791 175.232 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.6 mt -60.99 -22.58 64.64 Favored 'General case' 0 C--O 1.261 1.694 0 CA-C-O 121.328 0.585 . . . . 0.0 111.725 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.734 ' HA ' HG22 ' A' ' 52' ' ' THR . 62.2 mtpt -82.98 -41.67 18.48 Favored 'General case' 0 N--CA 1.433 -1.304 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.966 176.699 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.37 -11.23 60.79 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.554 0.693 . . . . 0.0 110.795 177.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.47 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 3.7 mm? -77.01 -3.28 38.24 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 172.37 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.14 1.85 51.0 Favored Glycine 0 CA--C 1.506 -0.506 0 CA-C-N 116.226 -0.443 . . . . 0.0 113.591 175.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.447 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 15.7 tpt -91.89 -50.89 5.48 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.367 -177.602 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.734 HG22 ' HA ' ' A' ' 47' ' ' LYS . 68.6 p 53.51 20.17 1.98 Allowed 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 124.959 1.304 . . . . 0.0 113.736 176.161 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 42.4 t -68.78 130.19 42.09 Favored 'General case' 0 C--N 1.31 -1.122 0 C-N-CA 123.057 0.543 . . . . 0.0 111.472 -172.243 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 31.7 t -56.38 -47.57 78.65 Favored 'General case' 0 C--O 1.247 0.931 0 C-N-CA 124.633 1.173 . . . . 0.0 111.631 -175.497 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 -53.88 -58.2 8.12 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-O 122.165 0.984 . . . . 0.0 110.471 177.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.72 ' O ' HG12 ' A' ' 60' ' ' VAL . 7.7 m-20 -63.15 -40.85 98.76 Favored 'General case' 0 N--CA 1.422 -1.869 0 CA-C-N 113.451 -1.704 . . . . 0.0 110.592 -171.736 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -54.06 -26.3 26.08 Favored 'General case' 0 C--O 1.218 -0.571 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 178.397 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -104.79 -14.92 15.37 Favored 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 121.134 -0.226 . . . . 0.0 111.504 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.405 ' C ' HD13 ' A' ' 59' ' ' LEU . 3.4 tm? -96.57 -59.01 1.91 Allowed 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 -175.12 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.72 HG12 ' O ' ' A' ' 56' ' ' ASP . 4.8 p -57.41 -26.77 27.17 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.553 0 CA-C-O 120.805 0.336 . . . . 0.0 110.865 -177.082 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.689 ' HD2' HD21 ' A' ' 64' ' ' LEU . 24.7 mmmt -62.12 -30.53 71.09 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.84 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.459 ' HA ' ' HE2' ' A' ' 65' ' ' LYS . 37.9 ttmt -79.25 -44.69 21.25 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 121.952 0.882 . . . . 0.0 109.114 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.523 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -70.54 -31.74 68.92 Favored 'General case' 0 C--N 1.295 -1.795 0 CA-C-N 114.01 -1.45 . . . . 0.0 112.404 -174.356 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.721 HD22 ' HB2' ' A' ' 41' ' ' LEU . 3.9 pp -75.05 -32.15 61.47 Favored 'General case' 0 N--CA 1.437 -1.107 0 N-CA-C 112.0 0.371 . . . . 0.0 112.0 179.507 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.459 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 64.2 pttt -80.07 -29.2 39.13 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 119.491 -0.884 . . . . 0.0 111.022 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.488 ' HG2' ' HA ' ' A' ' 63' ' ' LYS . 12.1 pt-20 -84.12 -2.54 56.96 Favored 'General case' 0 C--O 1.242 0.677 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 178.768 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.465 ' HG3' HD22 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -46.68 -36.8 7.48 Favored 'General case' 0 CA--C 1.488 -1.408 0 C-N-CA 123.597 0.759 . . . . 0.0 112.654 -178.457 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -55.13 -30.49 59.88 Favored 'General case' 0 C--N 1.309 -1.186 0 O-C-N 124.05 0.844 . . . . 0.0 112.622 -175.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 25.9 ptt? -107.79 -32.0 7.81 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.227 0.537 . . . . 0.0 110.029 177.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 49.2 m -78.53 -19.75 52.22 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -173.689 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.528 HD22 HG13 ' A' ' 4' ' ' VAL . 4.3 pp -68.98 -32.01 71.28 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-O 121.463 0.649 . . . . 0.0 109.941 176.235 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -87.25 -51.17 6.12 Favored 'General case' 0 N--CA 1.413 -2.319 0 CA-C-N 114.584 -1.189 . . . . 0.0 112.283 -174.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.411 ' HB2' ' NZ ' ' A' ' 73' ' ' LYS . 6.8 mtmp? -80.61 -73.97 0.34 Allowed 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 121.613 0.721 . . . . 0.0 109.147 -174.636 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.409 ' H ' ' HB2' ' A' ' 73' ' ' LYS . . . . . . . . 0 N--CA 1.416 -2.141 1 N-CA-C 99.948 -4.093 . . . . 0.0 99.948 -175.2 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.174 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 29.5 p80 53.05 16.23 0.71 Allowed 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 126.682 1.993 . . . . 0.0 115.124 177.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 67.4 mtt -85.41 156.5 20.83 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 178.276 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.561 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.4 m -70.79 -28.63 34.6 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.249 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -167.846 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 22.8 p-80 -73.38 -6.77 48.36 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 121.044 0.45 . . . . 0.0 110.606 178.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -105.25 -2.22 24.33 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.611 178.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.5 ' HA ' ' NE2' ' A' ' 11' ' ' GLN . 53.5 m0 -78.74 142.12 37.29 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.337 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.9 m -96.41 -81.92 0.41 Allowed 'General case' 0 N--CA 1.415 -2.222 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.98 -177.476 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.556 ' O ' HG12 ' A' ' 12' ' ' VAL . 87.2 t -139.71 -58.62 0.31 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.951 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 -178.426 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.4 pm0 -63.07 -29.47 70.84 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.523 0.678 . . . . 0.0 111.356 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.5 ' NE2' ' HA ' ' A' ' 7' ' ' TRP . 20.4 mt-30 -75.66 -15.63 60.29 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.802 -176.712 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.556 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.9 p -80.73 -18.32 12.06 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-O 121.285 0.564 . . . . 0.0 109.789 -179.423 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.437 ' O ' HG23 ' A' ' 17' ' ' VAL . 86.1 p -73.6 -39.27 64.72 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.448 -174.499 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 39.7 m80 -50.69 -41.07 55.49 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 114.831 -1.077 . . . . 0.0 110.842 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.477 ' O ' HD23 ' A' ' 19' ' ' LEU . 28.6 t90 -65.52 -58.81 4.9 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.988 176.581 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 40.4 mt -48.66 -48.28 39.99 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.963 0.905 . . . . 0.0 112.189 -178.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 13' ' ' SER . 60.6 t -65.68 -16.34 20.26 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.393 0 CA-C-O 121.069 0.462 . . . . 0.0 111.162 -178.373 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -85.81 -21.26 53.86 Favored Glycine 0 N--CA 1.444 -0.807 0 N-CA-C 112.336 -0.306 . . . . 0.0 112.336 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.485 ' HB2' ' HE3' ' A' ' 63' ' ' LYS . 1.3 pt? -112.45 21.66 15.46 Favored 'General case' 0 C--O 1.213 -0.839 0 O-C-N 122.154 -0.615 . . . . 0.0 111.572 177.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.4 m 68.82 22.26 7.33 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.613 0.765 . . . . 0.0 111.747 -179.312 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -103.11 17.74 23.36 Favored 'General case' 0 C--N 1.3 -1.564 0 C-N-CA 123.905 0.882 . . . . 0.0 110.55 -178.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -54.68 -26.82 35.92 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.468 0.707 . . . . 0.0 111.312 176.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -64.88 -21.66 66.85 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 124.599 1.16 . . . . 0.0 111.327 177.144 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.476 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 3.2 m-85 -89.65 -20.63 23.44 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.784 -179.097 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.1 t -55.73 -38.15 49.78 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 O-C-N 123.321 0.388 . . . . 0.0 111.532 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.4 m -51.12 -41.09 59.83 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.812 0.845 . . . . 0.0 111.282 -178.552 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.581 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 16.1 tp10 -99.31 -34.58 10.26 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.267 -177.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -54.21 -48.19 71.31 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-O 121.297 0.57 . . . . 0.0 110.919 178.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 45.8 m -77.81 -11.23 59.86 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.516 -178.161 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.22 -29.63 26.38 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.878 0.371 . . . . 0.0 110.401 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.74 2.45 47.02 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 120.132 -0.627 . . . . 0.0 109.871 178.718 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 65.53 32.44 9.38 Favored 'General case' 0 CA--C 1.514 -0.439 0 C-N-CA 123.981 0.912 . . . . 0.0 110.826 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.401 ' HA ' ' HG3' ' A' ' 37' ' ' GLN . 47.9 mm -62.63 113.13 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 O-C-N 123.643 0.589 . . . . 0.0 109.628 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 71.1 p -100.09 -172.09 2.16 Favored 'General case' 0 N--CA 1.423 -1.822 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.561 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -65.17 -23.05 69.54 Favored Glycine 0 N--CA 1.439 -1.159 0 N-CA-C 111.513 -0.635 . . . . 0.0 111.513 178.331 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -62.45 -40.44 96.62 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 123.641 0.776 . . . . 0.0 109.917 179.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.433 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -93.04 -17.37 23.94 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.909 179.743 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.523 HD12 HG23 ' A' ' 12' ' ' VAL . 3.2 tt -69.0 -51.48 38.84 Favored 'General case' 0 C--N 1.314 -0.96 0 C-N-CA 124.593 1.157 . . . . 0.0 109.217 179.404 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 63.5 mt -58.63 -38.91 79.07 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.369 0.604 . . . . 0.0 111.776 -178.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.77 13.73 29.4 Favored 'General case' 0 C--N 1.299 -1.611 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.715 -176.568 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.546 ' HB2' HD22 ' A' ' 64' ' ' LEU . 31.4 mt -54.22 139.22 36.56 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.801 0.81 . . . . 0.0 112.271 177.443 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -139.39 170.62 15.59 Favored 'General case' 0 C--N 1.284 -2.264 0 N-CA-C 106.296 -1.742 . . . . 0.0 106.296 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -53.3 -37.56 55.41 Favored Glycine 0 C--O 1.211 -1.324 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 177.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -49.56 -49.87 44.59 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.834 0.853 . . . . 0.0 110.352 178.362 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.433 ' HE3' ' HB3' ' A' ' 45' ' ' LYS . 13.3 mtpp -71.31 -44.04 65.92 Favored 'General case' 0 N--CA 1.421 -1.879 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.624 -177.455 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 88.2 mt -60.17 -28.38 67.89 Favored 'General case' 0 C--O 1.255 1.387 0 CA-C-O 121.49 0.662 . . . . 0.0 111.121 -179.454 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.784 ' HA ' HG22 ' A' ' 52' ' ' THR . 54.3 mtpt -78.92 -33.13 45.72 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 115.151 -0.932 . . . . 0.0 109.952 176.762 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.98 -4.89 46.35 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 123.127 0.571 . . . . 0.0 111.574 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.581 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.4 mm? -87.53 -2.15 58.42 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 173.17 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.06 -9.76 6.46 Favored Glycine 0 C--O 1.222 -0.602 0 CA-C-N 115.713 -0.676 . . . . 0.0 114.128 175.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.782 ' SD ' ' HB2' ' A' ' 53' ' ' SER . 0.0 OUTLIER -79.49 -50.36 10.88 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -176.336 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.784 HG22 ' HA ' ' A' ' 47' ' ' LYS . 70.1 p 53.21 27.44 6.0 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.833 1.253 . . . . 0.0 113.103 175.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.782 ' HB2' ' SD ' ' A' ' 51' ' ' MET . 40.0 t -65.7 123.55 20.02 Favored 'General case' 0 C--N 1.313 -1.015 0 C-N-CA 123.532 0.733 . . . . 0.0 111.944 -174.6 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.1 m -54.6 -41.72 70.27 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.958 0.903 . . . . 0.0 113.198 -177.067 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -61.07 -55.83 28.09 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.982 0.896 . . . . 0.0 109.557 176.582 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.727 ' O ' HG12 ' A' ' 60' ' ' VAL . 67.0 m-20 -62.61 -40.55 97.31 Favored 'General case' 0 N--CA 1.427 -1.577 0 CA-C-N 113.593 -1.64 . . . . 0.0 111.135 -171.768 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.1 mmm180 -53.79 -22.39 9.38 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 124.058 0.943 . . . . 0.0 113.045 177.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -106.8 -26.2 11.37 Favored 'General case' 0 N--CA 1.444 -0.752 0 O-C-N 123.138 0.274 . . . . 0.0 111.425 177.399 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 47.8 tp -86.42 -52.57 5.52 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -176.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.727 HG12 ' O ' ' A' ' 56' ' ' ASP . 6.5 p -62.77 -22.88 31.36 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.244 0 CA-C-O 121.414 0.625 . . . . 0.0 109.485 178.063 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.433 ' HA ' ' CD2' ' A' ' 64' ' ' LEU . 26.7 tptp -71.22 -27.53 63.56 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 114.422 -1.263 . . . . 0.0 108.797 -176.594 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -83.44 -46.78 12.11 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.909 -1.496 . . . . 0.0 108.995 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.485 ' HE3' ' HB2' ' A' ' 19' ' ' LEU . 0.9 OUTLIER -67.58 -40.01 84.84 Favored 'General case' 0 N--CA 1.426 -1.657 0 CA-C-N 114.143 -1.39 . . . . 0.0 110.933 -174.885 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.546 HD22 ' HB2' ' A' ' 41' ' ' LEU . 3.9 pp -64.05 -30.72 71.77 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.012 -176.279 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -87.29 -10.17 53.03 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 118.078 -1.449 . . . . 0.0 111.639 -178.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -113.45 15.76 19.02 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 120.364 -0.534 . . . . 0.0 109.605 178.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.485 ' HG2' ' HA ' ' A' ' 64' ' ' LEU . 90.6 mmm -47.49 -33.12 5.88 Favored 'General case' 0 C--O 1.19 -2.069 0 C-N-CA 123.567 0.747 . . . . 0.0 112.291 177.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.1 ptpt -52.35 -28.81 20.84 Favored 'General case' 0 C--N 1.283 -2.304 0 C-N-CA 124.804 1.242 . . . . 0.0 112.781 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 23.0 ptp -113.08 -27.28 8.09 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 174.038 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.5 t -74.19 -29.0 61.54 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.751 -175.099 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.1 pp -63.62 -31.8 73.08 Favored 'General case' 0 CA--C 1.491 -1.323 0 CA-C-O 121.101 0.477 . . . . 0.0 110.988 179.25 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -68.81 -50.01 53.72 Favored 'General case' 0 N--CA 1.409 -2.495 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.707 -178.111 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -65.95 -56.76 10.05 Favored 'General case' 0 N--CA 1.427 -1.621 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.448 -176.545 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.633 0 O-C-N 124.598 1.186 . . . . 0.0 110.029 -177.309 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.171 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.1 p80 -118.71 -5.02 10.7 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 111.725 0.268 . . . . 0.0 111.725 -177.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 94.4 mmm -82.7 156.83 23.58 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.557 HG13 HD22 ' A' ' 71' ' ' LEU . 3.4 m -69.85 -30.02 42.84 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -169.126 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 18.0 p-80 -71.55 -12.85 61.58 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-O 121.292 0.568 . . . . 0.0 110.969 178.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -96.73 -12.6 23.53 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.994 178.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.407 ' CD2' ' HA ' ' A' ' 4' ' ' VAL . 51.0 m0 -66.45 141.03 58.06 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.171 -178.818 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.1 m -94.54 -80.06 0.41 Allowed 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.647 -178.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.546 ' O ' HG12 ' A' ' 12' ' ' VAL . 91.9 t -141.12 -60.43 0.22 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.143 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 -176.351 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.424 ' H ' ' CD ' ' A' ' 10' ' ' GLN . 4.1 pm0 -64.01 -23.29 67.28 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 115.186 -0.916 . . . . 0.0 112.265 -179.674 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -81.16 -18.26 46.94 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 179.375 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.546 HG12 ' O ' ' A' ' 9' ' ' VAL . 2.0 p -73.77 -24.34 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-O 121.63 0.728 . . . . 0.0 109.699 -179.102 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.453 ' O ' HG23 ' A' ' 17' ' ' VAL . 0.7 OUTLIER -70.8 -30.1 66.46 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.195 -176.214 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 42.0 m80 -58.09 -39.33 78.33 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-O 121.037 0.446 . . . . 0.0 110.039 -178.258 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.564 ' O ' HD23 ' A' ' 19' ' ' LEU . 35.4 t90 -65.17 -60.47 2.98 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.936 176.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.499 HD11 ' CG ' ' A' ' 28' ' ' PHE . 50.3 mt -48.59 -51.08 29.7 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.103 0.961 . . . . 0.0 112.441 -177.674 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 13' ' ' SER . 59.2 t -66.22 -20.78 27.78 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 CA-C-O 121.044 0.449 . . . . 0.0 110.572 -177.841 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -76.6 -30.33 56.53 Favored Glycine 0 N--CA 1.439 -1.158 0 N-CA-C 111.174 -0.77 . . . . 0.0 111.174 -177.373 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.564 HD23 ' O ' ' A' ' 15' ' ' TRP . 1.0 OUTLIER -102.11 14.11 32.87 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.995 -0.282 . . . . 0.0 110.579 177.197 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.9 m 65.03 37.82 6.57 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-O 121.591 0.71 . . . . 0.0 112.255 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.699 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -109.82 22.31 15.82 Favored 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 127.082 2.153 . . . . 0.0 107.889 176.61 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -53.24 -27.77 23.93 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.321 0.648 . . . . 0.0 112.621 177.456 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.699 ' NE2' ' HA ' ' A' ' 21' ' ' LEU . 3.5 pm0 -66.39 -18.38 65.32 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 175.653 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.42 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 2.5 m-85 -87.45 -21.53 25.49 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.225 178.381 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 90.8 t -57.48 -37.96 60.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 122.508 0.323 . . . . 0.0 110.705 179.046 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 7.2 m -49.66 -36.76 25.87 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 124.81 1.244 . . . . 0.0 111.929 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 19.8 tp10 -106.62 -34.06 7.45 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.507 -178.531 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.499 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.2 m-85 -53.02 -48.14 67.81 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 121.37 0.605 . . . . 0.0 110.811 177.785 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.4 m -76.83 -21.17 55.45 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.385 -177.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.69 -31.82 63.62 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.818 0.342 . . . . 0.0 111.273 -178.105 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.74 7.58 44.96 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 119.78 -0.768 . . . . 0.0 111.94 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 65.24 36.98 6.72 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.68 0.792 . . . . 0.0 110.695 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.49 HG23 ' HB2' ' A' ' 37' ' ' GLN . 45.0 mm -69.04 119.2 14.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 178.467 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 63.1 p -106.33 -172.31 2.06 Favored 'General case' 0 N--CA 1.419 -2.003 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 179.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.521 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -64.48 -22.96 68.17 Favored Glycine 0 N--CA 1.447 -0.592 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 177.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -60.08 -44.29 94.88 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 123.673 0.789 . . . . 0.0 109.791 177.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.49 ' HB2' HG23 ' A' ' 33' ' ' ILE . 0.3 OUTLIER -83.96 -26.25 29.41 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 -177.703 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.434 ' HA ' ' HG ' ' A' ' 41' ' ' LEU . 3.1 tt -62.79 -50.64 70.2 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.007 1.323 . . . . 0.0 110.724 -174.428 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 38.6 mt -62.96 -31.47 72.58 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.161 -177.313 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.41 13.08 34.41 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-N 115.575 -0.738 . . . . 0.0 112.553 -177.139 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.434 ' HG ' ' HA ' ' A' ' 38' ' ' LEU . 48.7 mt -53.49 145.67 14.3 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 177.761 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.418 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 24.5 t70 -142.39 169.04 18.33 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 105.827 -1.916 . . . . 0.0 105.827 179.016 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.495 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -54.03 -36.32 55.97 Favored Glycine 0 CA--C 1.487 -1.705 0 N-CA-C 110.502 -1.039 . . . . 0.0 110.502 176.286 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.467 ' HA ' ' HD3' ' A' ' 47' ' ' LYS . 66.1 t30 -50.67 -51.25 50.99 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-O 121.748 0.785 . . . . 0.0 110.238 178.765 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.466 ' HB3' ' HE3' ' A' ' 45' ' ' LYS . 13.5 mtpp -68.27 -39.8 82.06 Favored 'General case' 0 C--O 1.198 -1.64 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.3 -177.718 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 81.6 mt -62.89 -24.7 67.95 Favored 'General case' 0 C--O 1.254 1.299 0 CA-C-O 121.452 0.644 . . . . 0.0 110.767 179.211 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.858 ' HA ' HG22 ' A' ' 52' ' ' THR . 6.8 mtpm? -80.11 -35.78 36.31 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.067 -0.97 . . . . 0.0 108.931 175.605 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.45 -9.24 58.29 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 123.63 0.772 . . . . 0.0 111.581 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.481 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 2.9 mm? -86.06 -4.49 59.18 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 172.747 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 69.71 -0.07 22.34 Favored Glycine 0 C--N 1.328 0.135 0 CA-C-N 116.088 -0.506 . . . . 0.0 114.11 176.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 0.6 OUTLIER -84.37 -43.6 14.57 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 179.212 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.858 HG22 ' HA ' ' A' ' 47' ' ' LYS . 72.0 p 50.39 21.09 0.77 Allowed 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 125.721 1.608 . . . . 0.0 114.406 172.49 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.405 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 30.1 t -73.04 121.92 20.94 Favored 'General case' 0 C--N 1.3 -1.565 0 C-N-CA 122.428 0.291 . . . . 0.0 111.331 -174.605 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.2 m -63.59 -28.74 70.14 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -178.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.93 -54.59 24.36 Favored 'General case' 0 CA--C 1.503 -0.839 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 176.62 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.605 ' O ' HG12 ' A' ' 60' ' ' VAL . 4.6 m-20 -61.13 -45.71 93.55 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.182 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.521 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 12.0 mtm180 -63.51 -17.4 62.73 Favored 'General case' 0 C--O 1.207 -1.152 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.78 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.7 -15.5 30.21 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 121.373 0.606 . . . . 0.0 110.332 177.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.531 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 39.3 tp -100.81 -49.06 4.27 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.181 -178.416 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.605 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.5 p -60.62 -25.81 35.98 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.767 0 CA-C-O 121.727 0.775 . . . . 0.0 109.998 179.16 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.521 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 56.8 tptt -71.85 -34.03 68.92 Favored 'General case' 0 C--N 1.295 -1.776 0 CA-C-N 114.246 -1.343 . . . . 0.0 109.701 -172.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 59' ' ' LEU . 21.0 ptmt -87.9 -31.86 19.24 Favored 'General case' 0 N--CA 1.418 -2.061 0 CA-C-N 114.78 -1.1 . . . . 0.0 108.306 -177.847 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.443 ' O ' ' HB3' ' A' ' 67' ' ' MET . 2.6 tppt? -70.98 -44.87 65.06 Favored 'General case' 0 N--CA 1.417 -2.09 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.854 -178.466 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.411 HD22 ' HB2' ' A' ' 41' ' ' LEU . 3.7 pp -59.15 -31.42 68.95 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.959 0.409 . . . . 0.0 111.858 -176.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -87.86 -5.04 58.79 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -177.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -118.35 -13.17 9.82 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 120.268 -0.573 . . . . 0.0 109.685 174.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.477 ' HA ' ' HB2' ' A' ' 70' ' ' SER . 2.5 ppp? -61.2 -18.81 60.14 Favored 'General case' 0 C--O 1.191 -1.989 0 C-N-CA 124.021 0.928 . . . . 0.0 111.8 -172.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -68.85 -23.58 64.26 Favored 'General case' 0 C--N 1.29 -1.997 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.772 178.032 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 39.4 mtt -106.39 -35.06 7.24 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 107.775 -1.195 . . . . 0.0 107.775 174.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.477 ' HB2' ' HA ' ' A' ' 67' ' ' MET . 19.0 m -75.43 -21.29 58.3 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 -175.444 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.557 HD22 HG13 ' A' ' 4' ' ' VAL . 2.3 pp -57.21 -33.65 67.74 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-O 122.039 0.923 . . . . 0.0 109.245 178.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -78.73 -52.26 8.64 Favored 'General case' 0 N--CA 1.403 -2.82 0 CA-C-N 114.209 -1.36 . . . . 0.0 111.979 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.458 ' HG2' ' HA ' ' A' ' 70' ' ' SER . 55.8 pttt -82.95 -31.89 27.42 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -171.244 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.392 0 CA-C-O 119.413 -0.327 . . . . 0.0 110.952 -173.69 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.625 0 N-CA-C 111.091 -0.804 . . . . 0.0 111.091 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 34.7 p80 -82.61 0.74 41.6 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 121.163 0.506 . . . . 0.0 111.327 -179.004 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -73.67 154.48 39.68 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.126 -176.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.525 HG12 ' CH2' ' A' ' 7' ' ' TRP . 10.9 m -69.0 -33.0 56.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -171.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.6 p80 -69.37 -13.08 62.18 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-O 121.603 0.716 . . . . 0.0 110.75 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -88.95 -12.45 41.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.671 178.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.525 ' CH2' HG12 ' A' ' 4' ' ' VAL . 50.2 m0 -79.12 142.84 36.07 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 -179.525 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 13.1 m -99.83 -72.16 0.67 Allowed 'General case' 0 C--N 1.294 -1.819 0 O-C-N 123.657 0.598 . . . . 0.0 110.374 -178.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.534 ' O ' HG12 ' A' ' 12' ' ' VAL . 54.6 t -141.48 -65.76 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.209 -1.076 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 -179.713 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -62.4 -22.86 66.49 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -176.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -80.32 -18.47 49.09 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 176.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.534 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.4 p -75.25 -23.0 16.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 179.706 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.442 ' HA ' HD12 ' A' ' 16' ' ' LEU . 1.4 m -76.04 -27.56 57.36 Favored 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.246 -176.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 37.2 m80 -63.16 -34.82 78.45 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.475 ' O ' HD23 ' A' ' 19' ' ' LEU . 30.4 t90 -66.38 -62.21 1.59 Allowed 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.483 175.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.505 HD11 ' CG ' ' A' ' 28' ' ' PHE . 56.8 mt -44.83 -50.18 10.4 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.354 1.061 . . . . 0.0 112.946 -177.527 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 99.0 t -62.01 -27.73 42.99 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.277 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.688 -178.052 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.63 -35.44 74.39 Favored Glycine 0 N--CA 1.444 -0.831 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 -177.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.475 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -98.55 10.0 41.96 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 -179.305 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.3 m 75.59 19.47 2.06 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 124.206 1.002 . . . . 0.0 112.301 179.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.413 ' HG ' ' CD1' ' A' ' 19' ' ' LEU . 1.4 mm? -95.99 19.32 11.75 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.103 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -48.21 -33.56 8.73 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.231 1.412 . . . . 0.0 111.187 173.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -62.56 -22.05 66.05 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.77 -1.105 . . . . 0.0 111.124 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.51 ' HD2' HD13 ' A' ' 49' ' ' LEU . 13.4 m-85 -90.77 -20.24 22.59 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.877 -178.209 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 99.0 t -52.84 -37.62 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 C-N-CA 123.055 0.542 . . . . 0.0 111.855 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 29.7 t -57.58 -33.27 67.99 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 122.902 0.481 . . . . 0.0 111.923 -177.288 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.442 ' HG2' ' HA ' ' A' ' 49' ' ' LEU . 19.7 tp10 -106.91 -28.21 10.22 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 121.176 -0.21 . . . . 0.0 110.898 -179.376 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.505 ' CG ' HD11 ' A' ' 16' ' ' LEU . 2.1 m-85 -54.79 -38.76 67.68 Favored 'General case' 0 C--N 1.347 0.476 0 CA-C-O 121.829 0.823 . . . . 0.0 109.462 174.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 31.1 p -74.17 -27.56 60.89 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 114.841 -1.072 . . . . 0.0 111.887 -179.081 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.09 -31.95 64.68 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-O 121.166 0.508 . . . . 0.0 110.387 -175.157 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.402 ' HB2' HG12 ' A' ' 33' ' ' ILE . 0.4 OUTLIER -95.16 -1.39 51.95 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 119.815 -0.754 . . . . 0.0 110.41 179.768 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 63.58 38.69 9.45 Favored 'General case' 0 CA--C 1.512 -0.486 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -179.142 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.517 HG23 ' HB2' ' A' ' 37' ' ' GLN . 44.7 mm -65.01 114.75 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.603 -179.094 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.4 p -97.34 -175.53 3.24 Favored 'General case' 0 N--CA 1.407 -2.584 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 176.26 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.49 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -65.25 -21.46 68.31 Favored Glycine 0 N--CA 1.433 -1.533 0 N-CA-C 111.563 -0.615 . . . . 0.0 111.563 178.126 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -65.49 -38.7 90.54 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.517 ' HB2' HG23 ' A' ' 33' ' ' ILE . 0.2 OUTLIER -84.85 -28.39 26.07 Favored 'General case' 0 CA--C 1.507 -0.685 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 -179.227 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.526 HD12 HG23 ' A' ' 12' ' ' VAL . 2.6 tt -58.56 -51.05 71.54 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 125.196 1.398 . . . . 0.0 109.654 -178.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 21.7 mt -57.37 -37.94 73.43 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.366 -178.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -100.48 21.49 13.16 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -177.718 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.485 ' HB2' HD22 ' A' ' 64' ' ' LEU . 27.9 mt -62.37 139.02 58.55 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.116 0.484 . . . . 0.0 111.786 175.253 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.476 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 0.6 OUTLIER -138.95 178.05 7.44 Favored 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 177.656 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.59 -37.93 69.45 Favored Glycine 0 C--O 1.203 -1.815 0 CA-C-O 119.322 -0.71 . . . . 0.0 113.209 178.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -62.35 -41.67 98.77 Favored 'General case' 0 CA--C 1.482 -1.636 0 CA-C-N 117.747 0.774 . . . . 0.0 112.666 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.541 ' O ' ' HG ' ' A' ' 49' ' ' LEU . 16.5 mtpp -66.02 -40.6 91.2 Favored 'General case' 0 C--N 1.31 -1.141 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.087 175.662 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.766 ' HA ' HD12 ' A' ' 49' ' ' LEU . 87.5 mt -63.96 -34.16 77.35 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-O 121.773 0.797 . . . . 0.0 110.548 178.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.676 ' HA ' HG22 ' A' ' 52' ' ' THR . 43.1 mtpt -71.39 -37.1 71.58 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.242 176.634 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.11 3.74 16.65 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.455 0.645 . . . . 0.0 110.87 -179.329 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.766 HD12 ' HA ' ' A' ' 46' ' ' LEU . 72.4 mt -95.94 -0.84 50.26 Favored 'General case' 0 N--CA 1.428 -1.535 0 CA-C-O 121.663 0.744 . . . . 0.0 109.215 176.738 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 81.14 -23.26 4.63 Favored Glycine 0 CA--C 1.501 -0.79 0 CA-C-N 115.271 -0.877 . . . . 0.0 113.58 173.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 16.4 mmt -74.97 -55.4 5.8 Favored 'General case' 0 C--N 1.296 -1.742 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 -176.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.676 HG22 ' HA ' ' A' ' 47' ' ' LYS . 14.7 p 60.49 23.37 13.01 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.312 1.045 . . . . 0.0 110.922 174.643 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.8 m -68.38 126.11 28.58 Favored 'General case' 0 N--CA 1.421 -1.877 0 C-N-CA 124.531 1.133 . . . . 0.0 112.426 -173.042 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.9 m -58.98 -40.85 86.09 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.391 1.077 . . . . 0.0 113.398 -175.103 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -55.23 -57.87 10.01 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 122.817 1.294 . . . . 0.0 109.072 177.17 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.765 ' O ' HG12 ' A' ' 60' ' ' VAL . 9.8 m-20 -60.42 -42.53 96.18 Favored 'General case' 0 N--CA 1.415 -2.219 0 CA-C-N 112.462 -2.154 . . . . 0.0 110.961 -174.198 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.5 mmm-85 -52.35 -24.48 7.68 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 177.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -104.08 -36.56 7.67 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-O 120.97 0.414 . . . . 0.0 111.081 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.45 HD12 HD12 ' A' ' 19' ' ' LEU . 2.1 tm? -72.59 -60.67 2.12 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.301 -176.249 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.765 HG12 ' O ' ' A' ' 56' ' ' ASP . 8.2 p -60.63 -25.28 34.42 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.72 0 CA-C-O 121.837 0.827 . . . . 0.0 109.417 -176.882 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -71.02 -25.92 62.88 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.059 -175.203 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.435 ' HA ' ' HE3' ' A' ' 65' ' ' LYS . 58.3 tttm -85.14 -39.56 17.75 Favored 'General case' 0 N--CA 1.424 -1.769 0 CA-C-N 115.428 -0.806 . . . . 0.0 109.057 176.52 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.429 ' HG2' HD13 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -67.06 -40.76 87.13 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.408 -176.086 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.535 ' HA ' ' HG2' ' A' ' 67' ' ' MET . 4.1 pp -66.36 -29.02 69.12 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.934 -177.133 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.435 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 22.4 pttp -88.24 -1.87 58.27 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 120.099 -0.64 . . . . 0.0 111.773 -179.558 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.508 ' O ' ' HG2' ' A' ' 69' ' ' MET . 12.8 pt-20 -124.52 15.86 8.88 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 176.664 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.535 ' HG2' ' HA ' ' A' ' 64' ' ' LEU . 89.0 mmm -49.54 -36.99 25.3 Favored 'General case' 0 CA--C 1.469 -2.154 0 CA-C-O 121.319 0.581 . . . . 0.0 111.739 179.419 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -61.59 -20.18 63.03 Favored 'General case' 0 C--N 1.277 -2.556 0 CA-C-N 114.658 -1.156 . . . . 0.0 113.015 -176.2 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.508 ' HG2' ' O ' ' A' ' 66' ' ' GLU . 23.4 ptp -113.77 -3.96 13.43 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 120.611 -0.436 . . . . 0.0 109.9 178.367 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 22.7 t -107.92 -33.31 7.26 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.192 -175.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.566 HD12 ' N ' ' A' ' 72' ' ' GLU . 3.8 pp -47.96 -35.09 10.19 Favored 'General case' 0 CA--C 1.501 -0.923 0 N-CA-C 115.244 1.572 . . . . 0.0 115.244 -174.461 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.566 ' N ' HD12 ' A' ' 71' ' ' LEU . 16.8 tt0 -63.28 -39.46 94.65 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.005 -179.659 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -90.37 -69.95 0.7 Allowed 'General case' 0 N--CA 1.415 -2.211 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 -175.048 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.815 0 C-N-CA 127.638 2.375 . . . . 0.0 105.031 178.447 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.718 0 N-CA-C 111.122 -0.791 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' HIS . . . . . 0.448 ' NE2' ' HA ' ' A' ' 72' ' ' GLU . 46.4 p-80 -96.22 -9.01 31.47 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.804 0.302 . . . . 0.0 110.611 -178.414 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -65.99 165.12 13.87 Favored 'General case' 0 C--N 1.322 -0.603 0 O-C-N 124.326 1.016 . . . . 0.0 111.877 -173.504 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.504 HG12 ' CH2' ' A' ' 7' ' ' TRP . 4.5 m -70.58 -30.2 41.54 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -170.381 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 11.1 p-80 -68.34 -15.91 63.74 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.338 0.589 . . . . 0.0 110.895 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -86.48 -11.85 50.61 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.555 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.504 ' CH2' HG12 ' A' ' 4' ' ' VAL . 51.2 m0 -78.8 142.32 37.04 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-O 121.436 0.636 . . . . 0.0 111.132 -176.517 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.98 -80.66 0.33 Allowed 'General case' 0 N--CA 1.417 -2.1 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.104 -178.567 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.48 ' O ' HG12 ' A' ' 12' ' ' VAL . 59.5 t -143.27 -60.76 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.839 0 CA-C-N 113.82 -1.537 . . . . 0.0 108.882 -177.869 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.0 pm0 -74.12 -10.94 60.12 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.296 0.57 . . . . 0.0 112.091 -175.625 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -86.32 -17.46 34.5 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.72 176.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.48 HG12 ' O ' ' A' ' 9' ' ' VAL . 2.5 p -70.66 -24.12 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-O 122.125 0.964 . . . . 0.0 108.979 -178.565 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.489 ' HA ' HD12 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -70.06 -26.24 63.93 Favored 'General case' 0 N--CA 1.418 -2.064 0 CA-C-N 114.425 -1.261 . . . . 0.0 111.31 -176.733 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 29.3 m-70 -63.67 -39.36 94.14 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -177.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.495 ' O ' HD23 ' A' ' 19' ' ' LEU . 28.0 t90 -63.93 -55.83 19.67 Favored 'General case' 0 CA--C 1.511 -0.544 0 O-C-N 123.814 0.696 . . . . 0.0 109.743 176.802 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.489 HD12 ' HA ' ' A' ' 13' ' ' SER . 46.4 mt -48.11 -48.71 33.64 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.269 1.028 . . . . 0.0 112.458 -178.213 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 13' ' ' SER . 86.7 t -61.16 -27.08 41.01 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 C-N-CA 122.471 0.308 . . . . 0.0 111.381 -178.797 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.24 -28.73 65.56 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.735 -0.546 . . . . 0.0 111.735 -176.531 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.495 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.9 OUTLIER -106.34 17.95 22.68 Favored 'General case' 0 C--O 1.212 -0.87 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.336 179.114 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.5 t 65.91 29.88 10.12 Favored 'General case' 0 C--O 1.208 -1.111 0 CA-C-O 121.575 0.702 . . . . 0.0 110.55 179.297 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.41 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.7 mm? -107.71 18.79 20.97 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 123.552 0.741 . . . . 0.0 109.989 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -48.91 -32.09 8.39 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.921 0.889 . . . . 0.0 111.444 174.583 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -59.51 -20.67 57.13 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 124.686 1.195 . . . . 0.0 112.014 178.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -90.45 -19.9 23.35 Favored 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 179.141 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 92.6 t -53.13 -38.01 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 C-N-CA 122.798 0.439 . . . . 0.0 110.722 179.061 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.1 m -50.63 -29.38 10.86 Favored 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 125.706 1.602 . . . . 0.0 112.881 -179.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.581 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 18.3 tp10 -117.49 -30.47 5.52 Favored 'General case' 0 N--CA 1.432 -1.359 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.289 178.347 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.423 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.6 m-85 -54.61 -42.83 71.63 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-O 121.508 0.671 . . . . 0.0 110.938 177.787 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 45.8 m -84.36 -9.44 58.44 Favored 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.87 -178.062 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -83.07 -41.24 18.86 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.674 0.75 . . . . 0.0 110.059 179.606 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.478 ' HG3' HG12 ' A' ' 33' ' ' ILE . 3.7 pt20 -93.21 17.0 11.78 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 59.84 36.57 21.99 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.668 174.022 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.478 HG12 ' HG3' ' A' ' 31' ' ' GLN . 49.6 mm -70.35 118.19 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.087 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 -179.789 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 91.5 p -107.04 -167.74 1.31 Allowed 'General case' 0 N--CA 1.423 -1.797 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 176.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.486 ' O ' ' HG ' ' A' ' 39' ' ' LEU . . . -63.07 -28.43 72.1 Favored Glycine 0 N--CA 1.43 -1.737 0 N-CA-C 110.647 -0.981 . . . . 0.0 110.647 177.666 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -54.64 -46.34 73.93 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.538 0.735 . . . . 0.0 110.112 178.342 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.84 -19.98 23.99 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 120.27 -0.572 . . . . 0.0 112.271 -177.727 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.8 tt -63.94 -48.37 76.79 Favored 'General case' 0 C--N 1.316 -0.882 0 O-C-N 124.536 1.147 . . . . 0.0 108.53 177.353 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 35' ' ' GLY . 21.7 mt -63.68 -37.29 86.78 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.827 -178.791 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.9 20.88 14.59 Favored 'General case' 0 C--N 1.309 -1.161 0 N-CA-C 114.141 1.163 . . . . 0.0 114.141 -177.365 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.1 mt -54.79 153.53 5.98 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 176.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.501 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 14.3 t70 -159.8 161.93 34.68 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 -176.641 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.91 -34.32 61.42 Favored Glycine 0 CA--C 1.49 -1.504 0 O-C-N 123.569 0.543 . . . . 0.0 112.032 178.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -56.72 -43.94 81.13 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-O 121.031 0.443 . . . . 0.0 110.456 176.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.417 ' HE3' ' HB3' ' A' ' 45' ' ' LYS . 12.2 mtpp -68.79 -48.46 63.58 Favored 'General case' 0 C--O 1.193 -1.893 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.82 176.433 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 80.3 mt -54.99 -35.15 64.05 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-O 121.59 0.71 . . . . 0.0 111.451 -178.129 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.742 ' HA ' HG22 ' A' ' 52' ' ' THR . 22.6 mttm -75.57 -35.72 60.55 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.167 176.582 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.32 -12.72 60.93 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.144 0.578 . . . . 0.0 111.35 -179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.581 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.4 mm? -74.88 -8.71 57.28 Favored 'General case' 0 C--O 1.22 -0.5 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 172.003 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 71.35 1.29 42.35 Favored Glycine 0 C--O 1.225 -0.418 0 CA-C-N 115.935 -0.575 . . . . 0.0 112.543 178.05 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.586 ' HG3' ' OG ' ' A' ' 53' ' ' SER . 12.0 tpt -87.67 -49.36 7.2 Favored 'General case' 0 N--CA 1.433 -1.314 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -177.353 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.742 HG22 ' HA ' ' A' ' 47' ' ' LYS . 70.7 p 57.93 10.23 1.1 Allowed 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.783 1.633 . . . . 0.0 114.393 172.616 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.586 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 16.2 m -57.29 118.41 5.07 Favored 'General case' 0 C--N 1.31 -1.135 0 C-N-CA 124.807 1.243 . . . . 0.0 112.22 -175.107 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 p -63.69 -39.93 95.53 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 -172.196 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.25 -32.17 68.41 Favored 'General case' 0 CA--C 1.49 -1.336 0 CA-C-O 122.338 1.066 . . . . 0.0 108.904 -179.11 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.651 ' O ' HG12 ' A' ' 60' ' ' VAL . 17.7 m-20 -74.65 -40.85 61.22 Favored 'General case' 0 N--CA 1.413 -2.282 0 CA-C-N 113.137 -1.847 . . . . 0.0 109.369 -178.285 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.593 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 24.7 mmm-85 -51.43 -36.35 43.42 Favored 'General case' 0 C--O 1.2 -1.519 0 C-N-CA 124.3 1.04 . . . . 0.0 111.132 175.687 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.44 -35.67 27.33 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.035 0.445 . . . . 0.0 111.894 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 30.7 tp -80.23 -43.79 20.83 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 120.306 -0.558 . . . . 0.0 112.216 -174.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.651 HG12 ' O ' ' A' ' 56' ' ' ASP . 9.7 p -65.26 -26.1 38.82 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.737 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.178 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.593 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 55.0 tptt -70.36 -31.98 69.47 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 122.734 1.254 . . . . 0.0 108.896 -175.502 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -80.62 -44.75 18.38 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-N 113.118 -1.856 . . . . 0.0 109.026 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.46 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.3 OUTLIER -72.31 -35.68 68.71 Favored 'General case' 0 N--CA 1.423 -1.824 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.191 -176.776 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.7 pp -70.0 -13.74 62.37 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 -176.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -98.84 -5.12 31.65 Favored 'General case' 0 C--N 1.309 -1.167 0 C-N-CA 119.026 -1.069 . . . . 0.0 112.275 175.212 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -125.78 4.47 7.4 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 122.159 0.98 . . . . 0.0 109.381 -179.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.492 ' N ' ' SD ' ' A' ' 67' ' ' MET . 0.0 OUTLIER -54.24 -24.74 19.78 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 127.585 2.354 . . . . 0.0 112.173 -176.532 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -69.88 -20.46 63.38 Favored 'General case' 0 C--N 1.298 -1.631 0 CA-C-N 115.087 -0.961 . . . . 0.0 111.854 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 25.9 ptt? -110.11 -14.59 14.18 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 173.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.424 ' HB2' ' HA ' ' A' ' 67' ' ' MET . 9.0 m -76.95 -36.07 56.81 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.937 178.094 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.545 HD12 ' N ' ' A' ' 72' ' ' GLU . 4.3 pp -53.16 -29.17 29.91 Favored 'General case' 0 CA--C 1.495 -1.149 0 C-N-CA 124.01 0.924 . . . . 0.0 112.825 179.446 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.545 ' N ' HD12 ' A' ' 71' ' ' LEU . 10.2 tt0 -70.69 -31.17 67.97 Favored 'General case' 0 N--CA 1.402 -2.863 0 CA-C-N 114.073 -1.421 . . . . 0.0 111.99 -174.619 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 57.3 mttp -99.53 -87.97 0.35 Allowed 'General case' 0 N--CA 1.405 -2.713 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.654 -169.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.012 0 N-CA-C 107.807 -1.182 . . . . 0.0 107.807 -178.971 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.759 0 N-CA-C 111.611 -0.595 . . . . 0.0 111.611 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 25.3 p80 -113.56 5.29 16.53 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 121.112 0.482 . . . . 0.0 110.259 -178.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -72.6 174.78 7.05 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.367 -176.398 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.686 HG13 HD22 ' A' ' 71' ' ' LEU . 3.9 m -68.48 -29.81 45.32 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.158 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 -169.344 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.4 p80 -72.41 -6.39 43.17 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 121.467 0.651 . . . . 0.0 110.941 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -103.08 -7.01 21.69 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.822 178.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.519 ' CH2' HG12 ' A' ' 4' ' ' VAL . 54.2 m0 -79.69 156.59 27.49 Favored 'General case' 0 CA--C 1.473 -1.996 0 CA-C-O 121.821 0.82 . . . . 0.0 111.607 -178.141 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.453 ' H ' ' HB2' ' A' ' 11' ' ' GLN . 7.8 m -111.91 -131.22 0.32 Allowed 'General case' 1 N--CA 1.37 -4.446 0 CA-C-N 113.578 -1.647 . . . . 0.0 106.866 177.037 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.569 ' O ' HG12 ' A' ' 12' ' ' VAL . 59.8 t -95.41 -52.4 9.52 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.991 0 C-N-CA 123.524 0.729 . . . . 0.0 110.628 -170.231 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.406 ' CD ' ' H ' ' A' ' 10' ' ' GLN . 4.7 pm0 -71.18 -19.77 62.37 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 122.36 1.076 . . . . 0.0 109.83 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.453 ' HB2' ' H ' ' A' ' 8' ' ' SER . 29.3 mt-30 -86.03 -19.4 30.36 Favored 'General case' 0 N--CA 1.413 -2.297 0 CA-C-N 114.158 -1.383 . . . . 0.0 111.787 -176.771 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.569 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.3 p -78.54 -20.98 13.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.778 0.799 . . . . 0.0 109.007 -179.373 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.5 ' HA ' HD12 ' A' ' 16' ' ' LEU . 1.8 m -74.94 -23.85 58.39 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.814 -176.125 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -61.34 -36.16 79.41 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-O 120.998 0.428 . . . . 0.0 110.44 -179.03 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.438 ' O ' HD23 ' A' ' 19' ' ' LEU . 31.3 t90 -68.09 -59.3 3.35 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.698 176.226 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.515 HD11 ' CD2' ' A' ' 28' ' ' PHE . 44.9 mt -46.49 -50.61 16.77 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.283 1.033 . . . . 0.0 112.326 -177.505 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 13' ' ' SER . 94.0 t -60.55 -26.09 36.6 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.174 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.308 -178.054 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -70.91 -34.35 65.55 Favored Glycine 0 N--CA 1.449 -0.492 0 CA-C-N 116.413 -0.358 . . . . 0.0 112.332 -178.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.466 ' HG ' ' HB2' ' A' ' 21' ' ' LEU . 0.5 OUTLIER -100.52 15.71 27.09 Favored 'General case' 0 C--N 1.317 -0.841 0 O-C-N 122.731 -0.276 . . . . 0.0 111.357 -179.565 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 43.4 m 70.21 18.34 6.94 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.413 1.085 . . . . 0.0 111.415 -179.369 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.466 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.6 mm? -94.25 18.81 10.31 Favored 'General case' 0 C--N 1.301 -1.537 0 C-N-CA 124.17 0.988 . . . . 0.0 109.422 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.446 ' HB3' HG22 ' A' ' 17' ' ' VAL . 1.1 p30 -51.64 -26.63 9.38 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.341 1.056 . . . . 0.0 111.212 172.513 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -62.51 -26.97 68.82 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 124.098 0.959 . . . . 0.0 111.344 177.238 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.422 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 1.8 m-85 -85.1 -19.85 31.25 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.627 -178.004 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 91.0 t -54.53 -33.35 26.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 122.842 0.457 . . . . 0.0 110.91 178.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 4.4 m -48.61 -39.62 24.58 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.201 1.4 . . . . 0.0 112.266 178.447 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.628 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 15.5 tp10 -108.59 -30.09 8.41 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.33 -177.328 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.515 ' CD2' HD11 ' A' ' 16' ' ' LEU . 2.7 m-85 -54.09 -36.89 63.67 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.356 0.598 . . . . 0.0 110.795 176.019 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.2 p -73.04 -32.28 64.98 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.359 178.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.08 -31.16 61.15 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.864 -174.38 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -96.82 0.93 50.09 Favored 'General case' 0 CA--C 1.509 -0.604 0 C-N-CA 119.931 -0.708 . . . . 0.0 110.246 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 62.66 40.1 10.61 Favored 'General case' 0 CA--C 1.509 -0.617 0 O-C-N 123.939 0.774 . . . . 0.0 109.988 179.047 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 43.7 mm -65.61 128.17 27.99 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.131 0 CA-C-N 115.12 -0.945 . . . . 0.0 108.57 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.437 ' H ' ' HG2' ' A' ' 37' ' ' GLN . 74.9 p -120.14 -168.85 1.69 Allowed 'General case' 0 N--CA 1.428 -1.528 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 174.663 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.532 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.09 -29.62 73.28 Favored Glycine 0 CA--C 1.502 -0.781 0 N-CA-C 111.881 -0.487 . . . . 0.0 111.881 -177.849 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -54.47 -47.74 72.6 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 123.252 0.621 . . . . 0.0 109.657 176.183 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.437 ' HG2' ' H ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -87.03 -19.89 27.99 Favored 'General case' 0 C--N 1.312 -1.062 0 C-N-CA 119.535 -0.866 . . . . 0.0 111.52 -177.752 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.405 ' HA ' ' HG ' ' A' ' 41' ' ' LEU . 2.7 tt -67.66 -51.16 53.14 Favored 'General case' 0 CA--C 1.548 0.884 0 O-C-N 124.192 0.932 . . . . 0.0 109.745 -178.399 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 50.8 mt -62.46 -34.57 77.08 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.473 0.654 . . . . 0.0 111.592 -177.398 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.9 24.92 9.27 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.589 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.478 ' HA ' ' HD3' ' A' ' 45' ' ' LYS . 32.6 mt -63.35 153.1 36.1 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.063 173.718 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -157.06 172.81 18.01 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 -177.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.426 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -58.8 -40.68 95.38 Favored Glycine 0 C--O 1.204 -1.73 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -51.35 -46.95 62.86 Favored 'General case' 0 CA--C 1.507 -0.705 0 C-N-CA 123.58 0.752 . . . . 0.0 111.539 176.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.48 ' O ' HD23 ' A' ' 49' ' ' LEU . 15.0 mtpp -67.02 -44.05 81.29 Favored 'General case' 0 C--O 1.193 -1.894 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.8 176.856 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 98.1 mt -59.55 -27.19 65.99 Favored 'General case' 0 C--O 1.256 1.423 0 CA-C-O 121.704 0.764 . . . . 0.0 111.646 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.654 ' HA ' HG22 ' A' ' 52' ' ' THR . 56.3 mtpt -83.98 -34.37 24.4 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.157 178.079 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.67 -12.67 60.24 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 121.79 0.805 . . . . 0.0 110.263 176.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.628 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 3.7 mm? -82.14 2.17 32.72 Favored 'General case' 0 C--O 1.211 -0.949 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.009 173.89 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 63.06 6.04 11.77 Favored Glycine 0 C--N 1.333 0.397 0 CA-C-N 115.7 -0.682 . . . . 0.0 114.446 175.238 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.422 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 6.5 tpt -88.15 -48.73 7.5 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 -177.477 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.654 HG22 ' HA ' ' A' ' 47' ' ' LYS . 81.7 p 53.99 21.26 2.8 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 125.471 1.509 . . . . 0.0 114.618 174.449 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.9 t -66.41 117.65 8.94 Favored 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 123.536 0.734 . . . . 0.0 110.032 -179.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.2 m -67.51 -26.78 66.51 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-O 121.005 0.431 . . . . 0.0 110.449 -177.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -58.14 -53.64 55.96 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 122.11 0.957 . . . . 0.0 108.522 173.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.621 ' O ' HG12 ' A' ' 60' ' ' VAL . 67.5 m-20 -71.23 -37.17 72.03 Favored 'General case' 0 N--CA 1.427 -1.596 0 CA-C-N 114.15 -1.386 . . . . 0.0 110.78 -176.476 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -52.76 -27.15 16.58 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.674 0.79 . . . . 0.0 112.768 177.453 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.34 -37.79 13.79 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.973 176.717 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -81.21 -64.4 1.2 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.434 -172.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.621 HG12 ' O ' ' A' ' 56' ' ' ASP . 3.4 p -58.9 -23.01 22.77 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.839 0 CA-C-O 121.431 0.634 . . . . 0.0 111.249 -175.268 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -68.05 -33.25 74.22 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.809 -178.811 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt -84.22 -30.87 25.38 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-N 114.882 -1.054 . . . . 0.0 109.727 -178.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.428 ' HG2' HD13 ' A' ' 19' ' ' LEU . 1.4 tppt? -77.43 -41.46 39.73 Favored 'General case' 0 C--N 1.298 -1.647 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.041 -177.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.41 HD22 ' CB ' ' A' ' 41' ' ' LEU . 3.9 pp -61.89 -32.67 73.06 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.02 0.438 . . . . 0.0 112.049 -175.933 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -76.77 -28.14 55.58 Favored 'General case' 0 C--N 1.31 -1.113 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.098 -178.34 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -102.6 0.5 33.44 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.34 0.59 . . . . 0.0 110.195 -178.373 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.449 ' CE ' HG11 ' A' ' 4' ' ' VAL . 2.3 ppp? -69.31 -23.2 63.77 Favored 'General case' 0 C--O 1.197 -1.677 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.915 -175.356 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.664 ' HA ' HD23 ' A' ' 71' ' ' LEU . 54.7 pttt -71.97 -14.37 61.88 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-O 121.507 0.67 . . . . 0.0 111.805 178.08 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.2 mtp -99.9 -28.9 12.88 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 174.265 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 16.9 m -91.93 -24.73 19.19 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.167 -0.924 . . . . 0.0 113.465 -170.571 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.686 HD22 HG13 ' A' ' 4' ' ' VAL . 4.5 pp -50.24 -30.36 11.5 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 124.628 1.171 . . . . 0.0 113.309 -177.572 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.49 ' N ' HD12 ' A' ' 71' ' ' LEU . 10.6 tt0 -68.2 -44.89 74.82 Favored 'General case' 0 N--CA 1.417 -2.081 0 CA-C-N 114.382 -1.281 . . . . 0.0 111.285 -178.453 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -78.29 -53.39 7.37 Favored 'General case' 0 C--N 1.298 -1.674 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.426 -170.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.421 -1.898 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 -176.018 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.805 0 N-CA-C 111.305 -0.718 . . . . 0.0 111.305 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 68.5 t60 67.39 -71.01 0.11 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.704 1.202 . . . . 0.0 113.639 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 56.5 mtt -77.03 152.09 35.27 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.578 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.1 m -73.82 -27.61 22.99 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.134 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -165.439 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 16.7 p80 -68.65 -12.05 60.88 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-O 121.272 0.558 . . . . 0.0 111.154 176.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -97.88 -0.3 45.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.127 178.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.523 ' O ' ' HB2' ' A' ' 34' ' ' SER . 52.2 m0 -82.31 143.77 31.06 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.983 -179.114 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.5 m -99.63 -73.74 0.62 Allowed 'General case' 0 N--CA 1.428 -1.538 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.355 -175.012 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.431 ' O ' HG12 ' A' ' 12' ' ' VAL . 98.4 t -143.44 -65.48 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.198 -1.615 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.483 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 -59.74 -27.24 66.33 Favored 'General case' 0 C--N 1.312 -1.024 0 C-N-CA 124.076 0.951 . . . . 0.0 112.465 -177.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -72.6 -18.88 61.56 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.881 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.466 HG23 HD12 ' A' ' 38' ' ' LEU . 0.8 OUTLIER -78.83 -28.14 13.93 Favored 'Isoleucine or valine' 0 C--O 1.243 0.731 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -178.179 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.521 ' O ' HG23 ' A' ' 17' ' ' VAL . 1.2 m -67.88 -34.5 76.77 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.359 -176.599 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 23.5 m170 -59.13 -36.41 75.15 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.737 0.648 . . . . 0.0 109.631 -179.653 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.443 ' CH2' HG23 ' A' ' 60' ' ' VAL . 25.0 t90 -67.18 -59.04 3.78 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.74 176.626 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.445 HD12 ' HA ' ' A' ' 13' ' ' SER . 31.4 mt -47.3 -48.82 24.88 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 124.441 1.088 . . . . 0.0 112.218 -177.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 13' ' ' SER . 64.9 t -61.2 -25.82 37.44 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.014 0 CA-C-O 120.882 0.373 . . . . 0.0 111.198 -178.062 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.76 -28.63 64.7 Favored Glycine 0 CA--C 1.505 -0.567 0 N-CA-C 111.754 -0.539 . . . . 0.0 111.754 -176.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.453 HD23 ' H ' ' A' ' 19' ' ' LEU . 1.2 pt? -105.78 16.02 25.87 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.223 178.603 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.8 m 66.59 21.69 10.65 Favored 'General case' 0 C--O 1.206 -1.197 0 C-N-CA 123.825 0.85 . . . . 0.0 112.318 -179.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.406 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 2.1 mm? -95.98 19.98 10.74 Favored 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 123.795 0.838 . . . . 0.0 109.129 178.384 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.45 ' HA ' HG23 ' A' ' 25' ' ' VAL . 7.6 p-10 -55.22 -20.66 11.42 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.091 0.956 . . . . 0.0 111.399 175.883 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -69.14 -22.17 63.96 Favored 'General case' 0 C--N 1.305 -1.353 0 C-N-CA 124.065 0.946 . . . . 0.0 111.033 177.525 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.534 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 2.6 m-85 -87.5 -20.65 26.23 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.384 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.45 HG23 ' HA ' ' A' ' 22' ' ' ASP . 93.6 t -52.14 -38.18 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -179.365 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 36.7 t -54.01 -41.19 67.71 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 123.455 0.472 . . . . 0.0 111.168 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.533 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 13.1 tp10 -96.56 -31.31 12.83 Favored 'General case' 0 N--CA 1.44 -0.961 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.264 -177.279 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.43 ' CG ' HD11 ' A' ' 16' ' ' LEU . 2.7 m-85 -55.91 -39.86 72.23 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.197 0.522 . . . . 0.0 110.438 175.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.4 m -71.83 -30.78 65.84 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.336 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.11 -35.75 71.91 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.681 -175.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -98.27 2.72 48.49 Favored 'General case' 0 C--N 1.313 -1.012 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.91 -178.799 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 62.66 37.56 12.74 Favored 'General case' 0 CA--C 1.504 -0.792 0 C-N-CA 123.383 0.673 . . . . 0.0 109.553 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.7 mm -67.45 110.69 1.85 Allowed 'Isoleucine or valine' 0 N--CA 1.434 -1.246 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.523 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 84.7 p -99.3 -169.79 1.81 Allowed 'General case' 0 N--CA 1.421 -1.886 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.584 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.578 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -66.69 -23.19 72.23 Favored Glycine 0 N--CA 1.436 -1.346 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 179.216 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.53 -46.34 89.16 Favored 'General case' 0 N--CA 1.442 -0.828 0 C-N-CA 124.09 0.956 . . . . 0.0 109.546 178.243 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.421 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -88.76 -19.97 25.36 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.6 -179.802 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.466 HD12 HG23 ' A' ' 12' ' ' VAL . 2.8 tt -62.78 -50.39 71.23 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 124.492 1.117 . . . . 0.0 108.927 178.151 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.0 mt -58.71 -41.53 86.58 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.13 -177.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -97.07 16.17 20.39 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.443 -175.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.478 ' HB2' HD22 ' A' ' 64' ' ' LEU . 34.1 mt -57.42 154.59 10.59 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.69 0.757 . . . . 0.0 112.556 176.738 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -159.9 168.17 26.38 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -50.78 -40.09 40.69 Favored Glycine 0 C--O 1.204 -1.75 0 O-C-N 123.95 0.781 . . . . 0.0 111.739 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -51.99 -49.02 64.11 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 178.117 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.439 ' O ' HD23 ' A' ' 49' ' ' LEU . 12.8 mtpp -67.99 -46.86 70.12 Favored 'General case' 0 C--O 1.196 -1.724 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.259 177.577 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 74.1 mt -59.27 -26.49 64.98 Favored 'General case' 0 C--O 1.255 1.381 0 C-N-CA 123.554 0.742 . . . . 0.0 112.271 -177.67 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.74 ' HA ' HG22 ' A' ' 52' ' ' THR . 57.0 mtpt -79.5 -37.23 37.21 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.735 175.596 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.98 -9.88 59.2 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.532 0.682 . . . . 0.0 110.682 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.533 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.2 mm? -82.24 0.6 40.53 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.423 -0.808 . . . . 0.0 108.987 173.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 67.78 4.12 31.71 Favored Glycine 0 C--O 1.224 -0.484 0 N-CA-C 114.607 0.603 . . . . 0.0 114.607 174.549 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.534 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 14.5 tpt -94.76 -48.86 5.86 Favored 'General case' 0 C--N 1.311 -1.108 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.343 -178.862 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.74 HG22 ' HA ' ' A' ' 47' ' ' LYS . 62.3 p 59.38 2.9 0.34 Allowed 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 126.489 1.916 . . . . 0.0 115.471 174.296 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.503 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 20.3 m -55.35 123.52 14.11 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 125.191 1.397 . . . . 0.0 113.705 -174.073 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.8 t -61.76 -48.02 82.57 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 -173.184 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.0 pp0? -64.81 -38.35 90.69 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 122.135 0.969 . . . . 0.0 108.576 -176.242 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.63 ' O ' HG12 ' A' ' 60' ' ' VAL . 7.5 m-20 -70.24 -47.24 62.21 Favored 'General case' 0 N--CA 1.42 -1.934 0 CA-C-N 113.458 -1.701 . . . . 0.0 109.553 -174.086 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.527 ' HA ' HG12 ' A' ' 60' ' ' VAL . 44.2 mtm180 -68.28 -11.98 60.31 Favored 'General case' 0 C--O 1.213 -0.829 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 179.26 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.69 -30.04 19.42 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 174.108 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 36.9 tp -86.38 -44.99 11.61 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.478 -176.209 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.63 HG12 ' O ' ' A' ' 56' ' ' ASP . 5.0 p -61.62 -26.59 40.07 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.134 0 CA-C-O 121.405 0.622 . . . . 0.0 109.538 177.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 54.1 tptt -74.4 -27.0 60.44 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.135 -174.736 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -82.22 -45.87 14.48 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 113.827 -1.533 . . . . 0.0 108.478 177.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.407 ' HE3' ' CB ' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -67.01 -42.16 85.43 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.513 -175.613 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.521 ' HA ' ' HG2' ' A' ' 67' ' ' MET . 3.7 pp -62.9 -30.6 71.66 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -177.234 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.3 ptmm? -87.13 -11.12 51.01 Favored 'General case' 0 C--N 1.309 -1.165 0 C-N-CA 118.927 -1.109 . . . . 0.0 111.68 -177.255 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -112.97 7.53 18.21 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 120.939 -0.304 . . . . 0.0 110.313 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.521 ' HG2' ' HA ' ' A' ' 64' ' ' LEU . 92.5 mmm -46.14 -33.35 3.5 Favored 'General case' 0 C--O 1.191 -1.997 0 C-N-CA 123.899 0.88 . . . . 0.0 112.168 -179.179 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 6.7 ptpp? -50.15 -41.0 48.21 Favored 'General case' 0 C--N 1.297 -1.714 0 C-N-CA 124.386 1.074 . . . . 0.0 112.526 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 20.2 ptt? -106.55 -24.11 12.27 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-O 121.435 0.636 . . . . 0.0 109.97 177.754 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 42.1 m -81.91 -21.58 37.27 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -175.259 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.4 pp -64.16 -32.62 74.27 Favored 'General case' 0 CA--C 1.499 -1.0 0 CA-C-O 122.126 0.965 . . . . 0.0 109.057 173.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -72.97 -41.02 64.83 Favored 'General case' 0 N--CA 1.411 -2.377 0 CA-C-N 113.912 -1.495 . . . . 0.0 111.736 -177.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 83.1 mttt -89.83 26.76 1.71 Allowed 'General case' 0 C--N 1.311 -1.067 0 CA-C-O 121.927 0.87 . . . . 0.0 111.152 -172.697 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.282 -2.369 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 177.238 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.492 -1.383 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 44.2 p-80 -126.0 -29.53 3.06 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 64.0 mtt -90.07 149.48 22.49 Favored 'General case' 0 N--CA 1.419 -2.023 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 176.022 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.648 HG13 ' HB3' ' A' ' 71' ' ' LEU . 3.9 m -67.77 -28.58 42.09 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.112 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -168.095 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.2 p-80 -74.19 -9.77 58.95 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-O 121.179 0.514 . . . . 0.0 111.494 -178.208 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -90.42 -9.82 46.12 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 178.301 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.541 ' CD2' ' HA ' ' A' ' 4' ' ' VAL . 48.3 m0 -84.0 135.37 34.47 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.237 -177.047 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.433 ' O ' ' HB3' ' A' ' 34' ' ' SER . 16.1 m -93.3 -69.63 0.74 Allowed 'General case' 0 C--N 1.298 -1.631 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.638 -178.339 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.54 ' O ' HG12 ' A' ' 12' ' ' VAL . 61.4 t -143.81 -62.33 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 -179.748 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.35 -37.47 48.05 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 124.667 1.187 . . . . 0.0 111.952 179.217 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -78.57 -20.07 51.41 Favored 'General case' 0 N--CA 1.435 -1.177 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -174.505 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.54 HG12 ' O ' ' A' ' 9' ' ' VAL . 2.6 p -70.88 -22.36 23.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 CA-C-O 121.707 0.765 . . . . 0.0 109.218 -178.526 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.492 ' O ' HG23 ' A' ' 17' ' ' VAL . 1.4 m -73.76 -26.49 60.69 Favored 'General case' 0 N--CA 1.423 -1.807 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.363 -176.159 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 33.1 m170 -60.48 -42.33 96.05 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 123.414 0.446 . . . . 0.0 110.142 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.486 ' O ' HD23 ' A' ' 19' ' ' LEU . 36.0 t90 -63.13 -59.21 5.07 Favored 'General case' 0 N--CA 1.442 -0.831 0 O-C-N 123.825 0.703 . . . . 0.0 109.749 177.329 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.428 HD11 ' CD2' ' A' ' 28' ' ' PHE . 43.9 mt -47.53 -51.21 21.46 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 124.43 1.081 . . . . 0.0 112.266 -178.0 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 13' ' ' SER . 78.1 t -61.92 -26.86 41.09 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 CA-C-O 120.822 0.344 . . . . 0.0 111.219 -177.95 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -71.13 -29.2 69.04 Favored Glycine 0 C--O 1.223 -0.544 0 N-CA-C 111.945 -0.462 . . . . 0.0 111.945 -177.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.488 HD13 ' CB ' ' A' ' 63' ' ' LYS . 0.5 OUTLIER -104.96 16.16 26.43 Favored 'General case' 0 C--N 1.314 -0.94 0 O-C-N 122.334 -0.51 . . . . 0.0 111.04 177.649 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 62.5 m 62.65 34.3 15.02 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 122.326 1.06 . . . . 0.0 111.497 -178.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.418 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 0.9 OUTLIER -104.02 17.14 24.72 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 125.105 1.362 . . . . 0.0 108.552 176.792 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -54.96 -25.41 29.47 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.561 178.44 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.36 -20.31 63.84 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 119.996 -0.682 . . . . 0.0 111.853 177.126 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.423 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 3.8 m-85 -82.08 -19.49 40.11 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.153 -179.694 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 97.7 t -56.05 -36.32 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 O-C-N 123.212 0.32 . . . . 0.0 110.506 177.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 39.0 t -50.37 -38.75 44.05 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.246 1.018 . . . . 0.0 111.573 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.655 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 19.0 tp10 -105.12 -32.71 8.56 Favored 'General case' 0 C--N 1.312 -1.058 0 O-C-N 121.962 -0.461 . . . . 0.0 110.917 -178.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.428 ' CD2' HD11 ' A' ' 16' ' ' LEU . 2.1 m-85 -55.17 -40.6 70.86 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-O 121.72 0.771 . . . . 0.0 110.3 176.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 33.8 t -79.03 -21.81 46.37 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.52 -178.07 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.47 -38.41 62.93 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.0 0.429 . . . . 0.0 110.654 -177.512 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -101.35 16.35 25.85 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 -179.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 59.03 39.56 23.26 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 121.194 0.521 . . . . 0.0 111.362 174.703 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.529 HG23 ' HB2' ' A' ' 37' ' ' GLN . 49.9 mm -71.44 111.43 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.385 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.473 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.433 ' HB3' ' O ' ' A' ' 8' ' ' SER . 65.9 p -105.81 -169.85 1.65 Allowed 'General case' 0 N--CA 1.418 -2.051 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.496 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.14 -25.8 66.82 Favored Glycine 0 N--CA 1.436 -1.303 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.695 176.861 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -59.78 -36.74 77.3 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 123.379 0.672 . . . . 0.0 109.621 179.083 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.529 ' HB2' HG23 ' A' ' 33' ' ' ILE . 0.9 OUTLIER -89.96 -40.08 12.58 Favored 'General case' 0 C--O 1.215 -0.747 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.326 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.517 HD12 HG23 ' A' ' 12' ' ' VAL . 3.4 tt -49.7 -48.69 49.63 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.971 1.708 . . . . 0.0 111.268 -174.807 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 29.5 mt -61.96 -40.73 96.57 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.018 -177.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.14 11.37 36.52 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -176.064 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.435 ' HG ' ' HA ' ' A' ' 38' ' ' LEU . 46.8 mt -53.86 150.29 7.77 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 121.446 0.641 . . . . 0.0 112.618 178.427 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.431 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 25.8 t70 -153.82 179.51 8.8 Favored 'General case' 0 C--N 1.295 -1.793 0 N-CA-C 105.707 -1.96 . . . . 0.0 105.707 178.187 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -60.92 -35.98 91.37 Favored Glycine 0 CA--C 1.488 -1.655 0 N-CA-C 110.971 -0.852 . . . . 0.0 110.971 -179.552 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -52.93 -47.66 67.86 Favored 'General case' 0 CA--C 1.498 -1.036 0 C-N-CA 123.322 0.649 . . . . 0.0 111.453 177.776 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.431 ' HD3' HD23 ' A' ' 41' ' ' LEU . 13.4 mtpp -68.82 -44.04 74.32 Favored 'General case' 0 C--O 1.192 -1.962 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.063 177.176 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 90.0 mt -58.58 -31.0 67.61 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-O 121.702 0.763 . . . . 0.0 111.392 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.733 ' HA ' HG22 ' A' ' 52' ' ' THR . 74.1 mttt -77.71 -26.55 50.18 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.897 177.845 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.21 -5.48 58.53 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-O 121.691 0.758 . . . . 0.0 110.215 178.193 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.655 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.5 mm? -83.97 -5.49 59.23 Favored 'General case' 0 C--O 1.203 -1.371 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 172.768 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.21 -7.29 8.27 Favored Glycine 0 C--O 1.222 -0.626 0 CA-C-N 116.114 -0.494 . . . . 0.0 113.534 176.158 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.423 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 14.1 tpt -81.08 -50.42 9.66 Favored 'General case' 0 N--CA 1.432 -1.364 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 -177.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.733 HG22 ' HA ' ' A' ' 47' ' ' LYS . 80.5 p 57.3 14.37 2.1 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.422 1.489 . . . . 0.0 114.507 173.531 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.404 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 70.9 m -63.26 129.2 39.27 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 123.801 0.84 . . . . 0.0 112.238 -174.818 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.8 t -61.15 -47.28 86.94 Favored 'General case' 0 C--O 1.241 0.631 0 C-N-CA 124.59 1.156 . . . . 0.0 112.81 -172.749 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -54.22 -55.48 27.61 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 122.234 1.016 . . . . 0.0 108.983 177.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.771 ' O ' HG12 ' A' ' 60' ' ' VAL . 4.5 m-20 -60.16 -45.89 91.54 Favored 'General case' 0 N--CA 1.417 -2.121 0 CA-C-N 113.161 -1.836 . . . . 0.0 109.425 -175.797 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -48.52 -34.13 10.76 Favored 'General case' 0 CA--C 1.507 -0.71 0 C-N-CA 124.411 1.084 . . . . 0.0 112.958 178.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -94.47 -40.34 9.94 Favored 'General case' 0 C--N 1.306 -1.314 0 O-C-N 123.714 0.634 . . . . 0.0 110.873 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.7 tp -68.81 -51.99 34.93 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -175.126 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.771 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.5 p -67.2 -21.84 28.48 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.249 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.9 tmtt? -70.8 -30.34 66.78 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -178.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.659 ' O ' ' HG2' ' A' ' 65' ' ' LYS . 85.8 tttt -83.17 -42.13 17.67 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 114.447 -1.252 . . . . 0.0 109.134 179.368 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.488 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -69.54 -28.5 66.07 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.399 -179.396 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.739 ' O ' ' HG3' ' A' ' 67' ' ' MET . 1.9 pp -79.88 -16.71 54.83 Favored 'General case' 0 C--O 1.204 -1.311 0 CA-C-O 120.971 0.415 . . . . 0.0 111.198 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.659 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 14.5 ptmm? -82.65 -17.07 45.91 Favored 'General case' 0 C--N 1.295 -1.8 0 C-N-CA 118.026 -1.47 . . . . 0.0 109.201 175.665 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -118.38 18.43 13.64 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.913 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.739 ' HG3' ' O ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -55.33 -21.7 16.12 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 -179.557 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -64.65 -28.07 69.36 Favored 'General case' 0 C--N 1.287 -2.132 0 CA-C-N 114.648 -1.16 . . . . 0.0 111.478 178.002 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.472 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 15.9 ptp -108.45 -18.65 13.69 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.084 -0.647 . . . . 0.0 109.557 174.694 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.517 ' HB2' ' HA ' ' A' ' 67' ' ' MET . 20.9 m -74.18 -29.2 61.64 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 116.614 -0.266 . . . . 0.0 110.824 178.383 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.648 ' HB3' HG13 ' A' ' 4' ' ' VAL . 4.4 pp -57.55 -33.03 67.7 Favored 'General case' 0 CA--C 1.487 -1.453 0 CA-C-O 122.299 1.047 . . . . 0.0 110.602 173.814 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.495 ' N ' HD12 ' A' ' 71' ' ' LEU . 9.1 tt0 -78.75 -33.74 46.33 Favored 'General case' 0 N--CA 1.383 -3.801 0 CA-C-N 113.497 -1.683 . . . . 0.0 111.262 -177.136 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 69' ' ' MET . 76.7 mttt -72.41 -52.58 15.35 Favored 'General case' 0 N--CA 1.432 -1.341 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 -178.071 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.958 0 O-C-N 124.817 1.323 . . . . 0.0 110.279 -176.984 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.79 0 N-CA-C 111.58 -0.608 . . . . 0.0 111.58 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -137.71 11.03 2.92 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 117.255 0.527 . . . . 0.0 111.444 -177.016 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.447 ' HA ' HD13 ' A' ' 71' ' ' LEU . 76.6 mtm -77.77 160.85 28.12 Favored 'General case' 0 N--CA 1.441 -0.911 0 C-N-CA 120.422 -0.511 . . . . 0.0 111.025 -178.661 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.579 HG13 HD22 ' A' ' 71' ' ' LEU . 17.2 m -65.58 -32.71 59.39 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.974 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -170.078 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 11.3 p-80 -73.36 -11.51 60.51 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-O 121.533 0.682 . . . . 0.0 110.749 -178.715 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -95.42 1.46 54.17 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.133 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.505 ' CH2' HG12 ' A' ' 4' ' ' VAL . 54.5 m0 -85.64 139.85 31.05 Favored 'General case' 0 CA--C 1.492 -1.259 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 176.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.2 m -94.18 -77.48 0.46 Allowed 'General case' 0 N--CA 1.419 -1.991 0 O-C-N 123.698 0.624 . . . . 0.0 110.701 -177.056 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.488 ' O ' HG12 ' A' ' 12' ' ' VAL . 55.2 t -141.43 -54.23 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-O 121.601 0.715 . . . . 0.0 109.661 -176.415 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.1 pm0 -77.31 -14.9 59.65 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.644 -178.764 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -83.57 -19.55 35.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.211 179.36 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.9 p -72.63 -25.39 22.56 Favored 'Isoleucine or valine' 0 C--O 1.242 0.671 0 CA-C-O 121.851 0.834 . . . . 0.0 109.489 -177.627 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.07 -29.21 65.02 Favored 'General case' 0 N--CA 1.427 -1.623 0 CA-C-N 115.012 -0.994 . . . . 0.0 111.397 -175.497 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 33.4 m80 -59.91 -36.9 77.96 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 121.417 0.627 . . . . 0.0 109.77 -178.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.502 ' O ' HD23 ' A' ' 19' ' ' LEU . 32.6 t90 -68.04 -59.65 3.09 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.123 177.448 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.457 HD11 ' CD2' ' A' ' 28' ' ' PHE . 44.1 mt -48.22 -51.01 27.27 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.103 0.961 . . . . 0.0 112.231 -177.688 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 90.7 t -60.35 -24.54 31.32 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.959 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.317 -178.641 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.88 -37.67 50.38 Favored Glycine 0 N--CA 1.441 -1.02 0 N-CA-C 111.413 -0.675 . . . . 0.0 111.413 -177.294 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.502 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.9 OUTLIER -98.13 18.18 16.78 Favored 'General case' 0 C--N 1.32 -0.704 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.672 -179.844 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.8 m 67.89 23.52 8.34 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-O 122.151 0.977 . . . . 0.0 111.466 179.109 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.429 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.3 mm? -99.94 20.06 15.04 Favored 'General case' 0 C--N 1.299 -1.611 0 C-N-CA 124.321 1.048 . . . . 0.0 109.538 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.413 ' HA ' HG23 ' A' ' 25' ' ' VAL . 9.5 p-10 -53.08 -27.0 18.13 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.422 1.089 . . . . 0.0 110.373 174.644 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -61.46 -21.8 64.49 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 125.414 1.486 . . . . 0.0 111.374 178.207 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.597 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 5.3 m-85 -93.35 -21.02 19.8 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 116.031 -0.532 . . . . 0.0 112.152 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.413 HG23 ' HA ' ' A' ' 22' ' ' ASP . 98.4 t -53.14 -39.53 34.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 O-C-N 123.346 0.404 . . . . 0.0 111.843 -179.389 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.2 m -52.46 -38.29 58.98 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 123.76 0.663 . . . . 0.0 112.1 -177.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.471 ' HG3' HD13 ' A' ' 49' ' ' LEU . 15.3 tp10 -103.93 -30.04 10.57 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.565 -177.43 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.457 ' CD2' HD11 ' A' ' 16' ' ' LEU . 1.7 m-85 -56.99 -47.55 80.56 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-O 121.529 0.68 . . . . 0.0 110.541 177.062 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.1 m -81.3 -5.26 57.62 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.351 -178.082 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -87.85 -41.21 13.39 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.747 178.294 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -91.5 8.16 37.82 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 120.088 -0.645 . . . . 0.0 110.793 -177.637 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 64.89 38.06 6.73 Favored 'General case' 0 CA--C 1.507 -0.7 0 O-C-N 124.045 0.841 . . . . 0.0 109.168 179.166 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 49.0 mm -71.64 109.52 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.311 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 -179.622 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.433 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 97.1 p -103.94 -167.22 1.34 Allowed 'General case' 0 N--CA 1.432 -1.367 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.574 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.535 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -63.82 -24.62 68.43 Favored Glycine 0 N--CA 1.436 -1.353 0 N-CA-C 111.685 -0.566 . . . . 0.0 111.685 178.697 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -60.27 -43.43 96.22 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 177.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.6 -17.74 25.11 Favored 'General case' 0 N--CA 1.436 -1.132 0 C-N-CA 119.921 -0.711 . . . . 0.0 112.489 179.506 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.442 HD12 HG23 ' A' ' 12' ' ' VAL . 4.2 tt -66.34 -49.99 65.1 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 124.18 0.992 . . . . 0.0 109.48 179.085 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.9 mt -63.9 -34.6 78.33 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.223 0.535 . . . . 0.0 112.0 -177.408 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.47 15.1 29.01 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -177.099 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.455 ' HB2' HD22 ' A' ' 64' ' ' LEU . 40.8 mt -53.11 152.17 4.42 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-O 121.759 0.79 . . . . 0.0 112.976 177.311 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -155.35 167.48 30.23 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 105.666 -1.975 . . . . 0.0 105.666 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.533 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -54.17 -38.8 62.19 Favored Glycine 0 CA--C 1.493 -1.339 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 177.873 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -50.9 -49.19 59.95 Favored 'General case' 0 CA--C 1.503 -0.844 0 C-N-CA 123.244 0.618 . . . . 0.0 111.843 178.66 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.434 ' HD3' HD23 ' A' ' 41' ' ' LEU . 13.2 mtpp -64.67 -46.48 82.26 Favored 'General case' 0 C--O 1.196 -1.762 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.119 178.448 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 93.3 mt -57.22 -35.41 69.63 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-O 121.735 0.779 . . . . 0.0 111.272 -179.106 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.686 ' HA ' HG22 ' A' ' 52' ' ' THR . 55.5 mtpt -71.48 -35.12 70.71 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.315 178.14 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.6 -8.73 58.93 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.254 0.55 . . . . 0.0 110.864 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.471 HD13 ' HG3' ' A' ' 27' ' ' GLU . 4.0 mm? -85.26 -2.51 58.13 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.76 0.791 . . . . 0.0 108.963 174.144 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.84 0.84 57.19 Favored Glycine 0 N--CA 1.445 -0.76 0 CA-C-N 115.202 -0.908 . . . . 0.0 114.846 174.191 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.597 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 16.7 tpt -83.65 -56.11 3.9 Favored 'General case' 0 CA--C 1.492 -1.277 0 C-N-CA 119.359 -0.937 . . . . 0.0 109.84 -178.526 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.686 HG22 ' HA ' ' A' ' 47' ' ' LYS . 76.7 p 53.02 40.73 31.67 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.086 0.954 . . . . 0.0 111.991 175.246 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.605 ' HB3' ' OD1' ' A' ' 56' ' ' ASP . 32.6 t -75.88 -179.77 5.04 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 177.116 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.3 m -107.74 -23.23 12.18 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 174.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -69.52 -42.6 74.47 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.857 -178.722 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.654 ' O ' HG12 ' A' ' 60' ' ' VAL . 8.9 p-10 -75.14 -41.38 58.44 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.065 -175.042 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 54.5 mmm-85 -55.55 -19.8 11.19 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.958 0.903 . . . . 0.0 112.357 -176.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -101.19 -35.85 9.15 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.082 175.712 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 30.6 tp -84.01 -53.97 5.18 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 -174.051 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.654 HG12 ' O ' ' A' ' 56' ' ' ASP . 8.1 p -64.28 -24.41 35.61 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.239 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -178.693 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -69.53 -30.11 67.86 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 114.423 -1.262 . . . . 0.0 108.906 -176.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.41 ' NZ ' ' HB2' ' A' ' 62' ' ' LYS . 3.8 ttmp? -86.49 -38.52 17.18 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-N 114.026 -1.443 . . . . 0.0 109.353 -178.751 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.421 ' HG2' HD13 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -71.47 -41.5 69.29 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 114.954 -1.021 . . . . 0.0 111.382 -177.508 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.583 ' HA ' ' HG2' ' A' ' 67' ' ' MET . 3.6 pp -63.49 -31.5 72.69 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.996 -175.551 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -78.84 -26.91 44.15 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 119.841 -0.743 . . . . 0.0 111.644 -177.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -95.3 -1.37 51.52 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.037 -177.468 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.583 ' HG2' ' HA ' ' A' ' 64' ' ' LEU . 93.1 mmm -45.97 -39.6 9.17 Favored 'General case' 0 C--O 1.192 -1.937 0 CA-C-O 122.118 0.961 . . . . 0.0 112.068 -177.595 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.402 ' H ' ' HG2' ' A' ' 68' ' ' LYS . 20.8 pttp -72.44 -6.36 43.1 Favored 'General case' 0 C--N 1.261 -3.245 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -174.397 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 26.7 ptt? -133.38 5.64 3.77 Favored 'General case' 0 C--N 1.298 -1.668 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 174.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 51.2 m -131.67 -12.25 3.41 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -176.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.579 HD22 HG13 ' A' ' 4' ' ' VAL . 4.0 pp -60.04 -37.19 79.09 Favored 'General case' 0 CA--C 1.503 -0.842 0 CA-C-N 118.557 0.617 . . . . 0.0 111.371 -175.792 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -62.36 -40.8 97.61 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.421 177.559 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -87.02 -48.59 7.97 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.954 -173.241 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.996 0 C-N-CA 125.311 1.444 . . . . 0.0 110.693 -178.09 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.482 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 2.7 m . . . . . 0 CA--C 1.5 -0.959 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -70.58 -7.72 46.12 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.751 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -101.85 -7.83 22.16 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.203 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.507 ' HA ' HE21 ' A' ' 11' ' ' GLN . 53.5 m0 -71.28 144.59 49.94 Favored 'General case' 0 CA--C 1.501 -0.92 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.1 m -94.84 -71.73 0.65 Allowed 'General case' 0 N--CA 1.419 -1.98 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.615 -173.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 74.9 t -146.08 -68.13 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.203 -1.376 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.2 pm0 -63.76 -20.82 66.05 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.914 -0.585 . . . . 0.0 112.445 -175.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.507 HE21 ' HA ' ' A' ' 7' ' ' TRP . 28.0 mt-30 -77.71 -13.31 59.94 Favored 'General case' 0 C--O 1.217 -0.61 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.402 HG23 HD12 ' A' ' 38' ' ' LEU . 1.1 p -77.16 -19.58 14.36 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.379 0 CA-C-O 121.393 0.616 . . . . 0.0 109.48 178.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 83.3 p -70.81 -39.25 73.17 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.948 -175.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . 0.5 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 42.5 m-70 -50.37 -36.58 33.15 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 114.392 -1.276 . . . . 0.0 110.92 -179.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.489 ' CH2' HG23 ' A' ' 60' ' ' VAL . 24.7 t90 -71.15 -61.85 1.61 Allowed 'General case' 0 N--CA 1.423 -1.788 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.784 175.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.437 HD11 ' CD2' ' A' ' 28' ' ' PHE . 44.5 mt -46.68 -49.07 19.9 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.474 1.11 . . . . 0.0 112.419 -177.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 99.5 t -59.35 -29.53 42.19 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.321 0 C-N-CA 122.74 0.416 . . . . 0.0 111.176 -179.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -72.39 -27.37 69.87 Favored Glycine 0 N--CA 1.447 -0.621 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.179 -176.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.462 HD23 ' O ' ' A' ' 15' ' ' TRP . 1.2 pt? -106.94 15.51 25.3 Favored 'General case' 0 C--N 1.317 -0.847 0 O-C-N 122.586 -0.361 . . . . 0.0 111.064 179.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.3 t 74.46 16.42 3.28 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-O 122.178 0.989 . . . . 0.0 111.523 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -93.95 17.85 11.56 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 114.914 -1.039 . . . . 0.0 109.629 -177.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.429 ' HA ' HG23 ' A' ' 25' ' ' VAL . 13.3 t70 -50.94 -30.79 15.79 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-O 121.538 0.685 . . . . 0.0 111.196 174.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -59.54 -25.74 64.78 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 124.593 1.157 . . . . 0.0 110.834 178.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.411 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 14.3 m-85 -88.7 -21.96 23.63 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.774 -178.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.429 HG23 ' HA ' ' A' ' 22' ' ' ASP . 57.7 t -55.85 -35.09 38.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 122.665 0.386 . . . . 0.0 111.338 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.8 m -57.32 -30.05 64.44 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 123.815 0.846 . . . . 0.0 111.879 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.601 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 21.1 tp10 -109.55 -35.99 6.08 Favored 'General case' 0 N--CA 1.431 -1.377 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.416 -178.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.437 ' CD2' HD11 ' A' ' 16' ' ' LEU . 1.9 m-85 -53.67 -43.44 68.87 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-O 121.411 0.624 . . . . 0.0 110.795 177.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.7 m -77.07 -23.04 52.0 Favored 'General case' 0 N--CA 1.44 -0.972 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.718 -177.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.87 -39.48 69.62 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.624 -178.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.32 9.33 40.26 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.288 -178.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 61.63 42.2 11.31 Favored 'General case' 0 C--O 1.234 0.271 0 O-C-N 123.611 0.569 . . . . 0.0 110.453 177.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.9 mm -72.18 114.25 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.013 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 90.2 p -107.37 -167.85 1.32 Allowed 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 178.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.482 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.17 -27.74 69.56 Favored Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 111.311 -0.716 . . . . 0.0 111.311 178.181 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -55.34 -42.75 74.24 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.044 0.937 . . . . 0.0 110.224 178.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.562 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -94.61 -24.74 17.08 Favored 'General case' 0 N--CA 1.433 -1.286 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.218 -179.271 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.402 HD12 HG23 ' A' ' 12' ' ' VAL . 3.4 tt -57.2 -52.73 64.14 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.868 1.267 . . . . 0.0 109.605 177.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.8 mt -62.58 -38.71 91.17 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -175.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.411 HE22 ' HD2' ' A' ' 45' ' ' LYS . 5.2 pp0? -99.88 10.55 41.12 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -175.058 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.62 ' HB2' HD22 ' A' ' 64' ' ' LEU . 40.5 mt -50.71 135.1 24.03 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 178.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -134.21 179.48 6.24 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 176.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.67 -42.76 85.74 Favored Glycine 0 C--O 1.204 -1.764 0 CA-C-O 119.238 -0.757 . . . . 0.0 112.699 -179.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -55.33 -43.33 74.85 Favored 'General case' 0 CA--C 1.488 -1.409 0 CA-C-N 117.459 0.629 . . . . 0.0 111.873 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.411 ' HD2' HE22 ' A' ' 40' ' ' GLN . 12.6 mtpp -65.23 -49.5 69.42 Favored 'General case' 0 C--O 1.196 -1.754 0 O-C-N 123.763 0.665 . . . . 0.0 110.817 176.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 91.1 mt -60.0 -30.95 69.48 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.848 0.833 . . . . 0.0 111.391 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.714 ' HA ' HG22 ' A' ' 52' ' ' THR . 58.7 mtpt -77.68 -30.24 51.84 Favored 'General case' 0 N--CA 1.426 -1.659 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.127 177.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.38 -4.32 47.63 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.224 0.535 . . . . 0.0 111.267 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.601 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.3 mm? -84.94 -7.56 59.11 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 171.191 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.85 -1.26 39.95 Favored Glycine 0 C--O 1.223 -0.578 0 CA-C-N 115.879 -0.601 . . . . 0.0 113.719 176.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.411 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 15.3 tpt -85.32 -50.18 7.55 Favored 'General case' 0 C--N 1.307 -1.239 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 -178.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.714 HG22 ' HA ' ' A' ' 47' ' ' LYS . 74.8 p 52.88 31.72 11.24 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 123.995 0.918 . . . . 0.0 112.168 174.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.2 t -73.08 129.76 38.79 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.768 -175.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.6 t -53.66 -54.86 31.78 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 125.061 1.344 . . . . 0.0 113.118 -176.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -50.65 -55.88 14.4 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-O 122.513 1.149 . . . . 0.0 109.914 177.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.788 ' O ' HG12 ' A' ' 60' ' ' VAL . 6.3 m-20 -62.0 -42.16 98.85 Favored 'General case' 0 N--CA 1.412 -2.345 0 CA-C-N 113.055 -1.884 . . . . 0.0 111.105 -173.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -52.79 -25.64 11.95 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 177.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -101.35 -38.47 8.03 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-O 120.879 0.371 . . . . 0.0 110.985 176.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 56.0 tp -72.67 -55.2 7.18 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -174.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.788 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.4 p -59.88 -26.4 35.47 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.032 0 CA-C-O 121.637 0.732 . . . . 0.0 109.16 -179.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.416 ' HA ' ' CD2' ' A' ' 64' ' ' LEU . 55.9 tptt -72.01 -28.92 63.71 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 113.655 -1.612 . . . . 0.0 110.16 -172.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -84.44 -40.21 18.03 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 114.73 -1.123 . . . . 0.0 108.655 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.401 ' HG2' HD13 ' A' ' 19' ' ' LEU . 3.0 tppt? -69.43 -42.46 74.94 Favored 'General case' 0 C--N 1.297 -1.686 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.201 -175.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.62 HD22 ' HB2' ' A' ' 41' ' ' LEU . 3.7 pp -65.73 -30.06 70.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.343 -175.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -82.68 -22.13 34.68 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 119.701 -0.8 . . . . 0.0 111.711 -179.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 . . . . . 0 C--N 1.324 -0.51 0 CA-C-O 121.06 0.457 . . . . 0.0 110.205 179.458 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.469 HG12 ' CH2' ' A' ' 7' ' ' TRP . 4.3 m . . . . . 0 CA--C 1.51 -0.565 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 12.3 p-80 -71.12 -12.69 61.63 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-O 121.268 0.556 . . . . 0.0 110.643 178.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -91.66 -7.9 48.63 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.85 178.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.488 ' O ' ' HB2' ' A' ' 34' ' ' SER . 49.2 m0 -82.66 147.45 28.51 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 -179.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 58.0 m -115.75 -69.21 0.87 Allowed 'General case' 0 N--CA 1.416 -2.162 0 O-C-N 123.422 0.451 . . . . 0.0 110.917 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.416 ' O ' HG12 ' A' ' 12' ' ' VAL . 59.3 t -141.58 -60.56 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -178.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.7 pm0 -70.29 9.58 0.58 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.629 -1.168 . . . . 0.0 113.865 -177.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.443 HE21 ' HA ' ' A' ' 7' ' ' TRP . 18.8 mt-30 -123.15 -11.9 7.96 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 175.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.574 HG23 HD12 ' A' ' 38' ' ' LEU . 4.2 p -77.4 -19.52 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-O 122.488 1.137 . . . . 0.0 108.474 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.9 p -67.53 -40.38 85.05 Favored 'General case' 0 N--CA 1.425 -1.676 0 C-N-CA 125.692 1.597 . . . . 0.0 112.376 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . 0.418 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 45.1 m-70 -57.61 -38.57 75.15 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.266 -177.287 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.467 ' O ' HD23 ' A' ' 19' ' ' LEU . 42.5 t90 -64.94 -61.06 2.39 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.488 176.141 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.1 mt -45.37 -52.62 9.69 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.657 1.183 . . . . 0.0 112.389 -177.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 85.3 t -62.65 -27.39 42.83 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 CA-C-O 121.148 0.499 . . . . 0.0 111.489 -177.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.67 -30.76 70.57 Favored Glycine 0 C--O 1.217 -0.918 0 CA-C-N 115.914 -0.584 . . . . 0.0 112.034 -178.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.467 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.4 OUTLIER -102.63 15.52 29.06 Favored 'General case' 0 C--N 1.314 -0.953 0 O-C-N 122.503 -0.41 . . . . 0.0 111.215 177.74 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.0 m 67.4 26.99 8.24 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 122.422 1.106 . . . . 0.0 111.008 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.561 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 1.2 mm? -98.0 21.28 10.92 Favored 'General case' 0 C--N 1.31 -1.114 0 C-N-CA 125.173 1.389 . . . . 0.0 108.69 178.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.409 ' HA ' HG12 ' A' ' 25' ' ' VAL . 8.8 p-10 -60.45 -9.97 4.33 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 123.893 0.877 . . . . 0.0 112.939 176.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.561 ' NE2' ' HA ' ' A' ' 21' ' ' LEU . 0.3 OUTLIER -84.07 -18.14 37.95 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 118.957 -1.097 . . . . 0.0 111.431 172.497 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -84.75 -27.72 26.74 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -177.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.544 ' HA ' ' HB2' ' A' ' 28' ' ' PHE . 0.7 OUTLIER -58.89 -25.62 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 177.971 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.3 m -54.7 -40.78 69.53 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.836 0.854 . . . . 0.0 111.383 176.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 38.2 tp10 -105.97 -27.42 11.18 Favored 'General case' 0 C--O 1.219 -0.541 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.044 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.544 ' HB2' ' HA ' ' A' ' 25' ' ' VAL . 1.7 m-85 -53.73 -44.39 69.85 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 121.218 0.533 . . . . 0.0 110.473 176.066 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.414 ' HA ' HG13 ' A' ' 9' ' ' VAL . 17.6 m -69.5 -28.87 66.43 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.615 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -76.88 -19.82 56.99 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.949 -176.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -106.8 4.21 27.29 Favored 'General case' 0 CA--C 1.501 -0.917 0 C-N-CA 119.649 -0.82 . . . . 0.0 109.474 175.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 61.06 38.9 16.86 Favored 'General case' 0 C--O 1.245 0.868 0 O-C-N 124.087 0.867 . . . . 0.0 110.435 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 49.4 mm -67.95 114.64 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.874 0 CA-C-N 115.187 -0.915 . . . . 0.0 108.673 -179.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.488 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 89.1 p -103.49 -169.26 1.62 Allowed 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 178.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.464 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -60.96 -29.04 69.73 Favored Glycine 0 N--CA 1.439 -1.12 0 N-CA-C 111.42 -0.672 . . . . 0.0 111.42 178.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -58.4 -44.8 89.16 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.39 0.614 . . . . 0.0 109.631 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.44 ' HA ' HE21 ' A' ' 40' ' ' GLN . 0.0 OUTLIER -93.94 -4.46 49.75 Favored 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -179.255 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.574 HD12 HG23 ' A' ' 12' ' ' VAL . 3.3 tt -80.57 -49.47 11.27 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 178.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.5 mt -61.38 -39.52 90.97 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.524 -178.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.44 HE21 ' HA ' ' A' ' 37' ' ' GLN . 5.0 pp0? -93.47 15.4 16.0 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -178.31 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.412 ' CB ' HD22 ' A' ' 64' ' ' LEU . 40.8 mt -55.64 160.49 2.48 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.704 0.764 . . . . 0.0 112.674 178.11 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.446 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 15.5 t70 -162.08 172.36 16.0 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 105.784 -1.932 . . . . 0.0 105.784 -177.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.401 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -61.04 -34.73 89.05 Favored Glycine 0 C--O 1.204 -1.748 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 175.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -51.1 -48.55 61.68 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 123.455 0.702 . . . . 0.0 111.16 176.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.45 ' O ' HD23 ' A' ' 49' ' ' LEU . 14.0 mtpp -69.07 -43.08 75.32 Favored 'General case' 0 C--O 1.197 -1.702 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.266 176.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 91.0 mt -59.84 -27.23 66.47 Favored 'General case' 0 C--O 1.255 1.349 0 CA-C-O 121.603 0.716 . . . . 0.0 111.244 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.767 ' HA ' HG22 ' A' ' 52' ' ' THR . 58.4 mtpt -80.8 -40.34 25.19 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.701 175.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.26 -11.26 60.45 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.512 0.672 . . . . 0.0 111.59 179.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.469 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.0 mm? -78.21 -3.23 41.62 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 123.179 0.591 . . . . 0.0 110.029 171.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 70.57 8.99 64.22 Favored Glycine 0 C--N 1.341 0.845 0 CA-C-O 121.259 0.366 . . . . 0.0 112.665 177.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 22.0 mmt -92.13 -59.06 2.19 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 115.418 -0.391 . . . . 0.0 110.929 -178.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.767 HG22 ' HA ' ' A' ' 47' ' ' LYS . 25.5 p 57.68 25.57 11.92 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 124.588 1.155 . . . . 0.0 112.588 175.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.425 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 14.8 m -69.74 118.99 13.29 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 123.19 0.596 . . . . 0.0 111.559 -176.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.0 m -63.2 -34.42 77.61 Favored 'General case' 0 C--O 1.244 0.77 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -177.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.459 ' HG3' ' N ' ' A' ' 56' ' ' ASP . 5.3 pt20 -59.24 -45.26 91.63 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.548 0.689 . . . . 0.0 110.198 176.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.587 ' O ' HG12 ' A' ' 60' ' ' VAL . 70.9 m-20 -74.76 -35.08 62.58 Favored 'General case' 0 N--CA 1.425 -1.724 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.666 -175.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.425 ' HG2' ' O ' ' A' ' 53' ' ' SER . 49.0 mmm-85 -55.22 -25.81 35.51 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.684 0.394 . . . . 0.0 111.548 175.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -98.28 -17.69 18.79 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.889 0.375 . . . . 0.0 111.279 178.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -96.39 -66.55 0.9 Allowed 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 120.641 0.258 . . . . 0.0 110.801 -175.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.587 HG12 ' O ' ' A' ' 56' ' ' ASP . 3.9 p -61.55 -24.57 34.22 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.849 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.769 -174.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -63.59 -36.25 83.17 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 122.107 0.956 . . . . 0.0 109.442 -179.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.445 ' O ' ' HG2' ' A' ' 65' ' ' LYS . 82.5 tttt -81.98 -34.76 29.53 Favored 'General case' 0 C--N 1.29 -2.016 0 CA-C-N 114.163 -1.381 . . . . 0.0 109.571 -177.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.454 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.5 OUTLIER -74.54 -38.57 62.73 Favored 'General case' 0 C--O 1.191 -1.989 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.229 -176.99 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.412 HD22 ' CB ' ' A' ' 41' ' ' LEU . 3.5 pp -64.36 -29.96 71.02 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -176.003 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.445 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 21.6 pttp -75.25 -34.97 61.44 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 119.933 -0.707 . . . . 0.0 110.309 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 . . . . . 0 C--N 1.311 -1.089 0 CA-C-O 121.15 0.5 . . . . 0.0 111.062 -175.509 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.583 HG12 ' CH2' ' A' ' 7' ' ' TRP . 15.2 m . . . . . 0 C--O 1.214 -0.799 0 CA-C-O 121.238 0.542 . . . . 0.0 112.311 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.4 p-80 -73.37 -9.11 58.35 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.843 0.83 . . . . 0.0 110.725 179.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -98.74 -11.27 22.07 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.149 177.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.583 ' CH2' HG12 ' A' ' 4' ' ' VAL . 54.1 m0 -72.53 150.77 42.9 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 177.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.2 m -104.48 -75.0 0.63 Allowed 'General case' 0 N--CA 1.424 -1.759 0 CA-C-O 121.082 0.468 . . . . 0.0 109.992 -178.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.513 ' O ' HG12 ' A' ' 12' ' ' VAL . 94.5 t -139.06 -65.67 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.203 -1.353 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 -175.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -66.71 -14.04 62.06 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.153 0.501 . . . . 0.0 112.301 -176.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.493 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 26.3 mt-30 -88.34 -15.75 34.83 Favored 'General case' 0 N--CA 1.433 -1.299 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 178.038 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.513 HG12 ' O ' ' A' ' 9' ' ' VAL . 2.9 p -75.67 -25.76 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-O 122.028 0.918 . . . . 0.0 109.294 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.412 ' HA ' HD12 ' A' ' 16' ' ' LEU . 0.8 OUTLIER -67.09 -28.38 68.13 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 114.6 -1.182 . . . . 0.0 111.654 -177.039 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . 0.493 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 83.6 m-70 -59.5 -41.68 90.41 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 -178.078 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.528 ' O ' HD23 ' A' ' 19' ' ' LEU . 38.0 t90 -64.51 -57.46 9.13 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.819 177.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.473 HD11 ' CD2' ' A' ' 28' ' ' PHE . 48.5 mt -48.96 -51.24 31.44 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.104 0.962 . . . . 0.0 112.738 -178.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 13' ' ' SER . 88.2 t -62.47 -24.78 36.15 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.033 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.022 -178.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -75.03 -24.13 72.56 Favored Glycine 0 N--CA 1.444 -0.775 0 N-CA-C 112.017 -0.433 . . . . 0.0 112.017 -177.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.528 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.7 OUTLIER -105.56 15.98 26.15 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.143 0.496 . . . . 0.0 110.482 174.818 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.1 m 64.67 28.92 13.09 Favored 'General case' 0 C--O 1.213 -0.862 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.804 178.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.605 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 0.6 OUTLIER -100.51 20.86 14.19 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 126.851 2.06 . . . . 0.0 108.856 -179.593 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -49.59 -29.97 7.97 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.595 0.758 . . . . 0.0 112.242 176.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.605 ' NE2' ' HA ' ' A' ' 21' ' ' LEU . 2.6 pm0 -61.75 -22.37 65.33 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 176.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.414 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 8.4 m-85 -85.97 -22.87 27.14 Favored 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 86.9 t -54.86 -38.71 45.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 O-C-N 123.383 0.427 . . . . 0.0 111.254 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.8 m -50.86 -39.46 53.83 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.283 1.033 . . . . 0.0 111.745 -178.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.623 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 35.4 tp10 -103.34 -30.66 10.47 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.747 -178.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.473 ' CD2' HD11 ' A' ' 16' ' ' LEU . 1.6 m-85 -55.26 -41.13 71.8 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 121.389 0.614 . . . . 0.0 109.884 176.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.463 ' HA ' HG13 ' A' ' 9' ' ' VAL . 47.1 t -69.37 -34.81 75.1 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.911 178.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.52 -32.51 71.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.129 -173.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -99.33 6.44 46.15 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.124 -179.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 59.47 39.15 22.18 Favored 'General case' 0 C--O 1.244 0.783 0 O-C-N 123.867 0.729 . . . . 0.0 110.118 178.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.4 mm -67.76 112.54 2.98 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.219 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.34 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 87.6 p -107.13 -168.23 1.37 Allowed 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.484 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.9 -25.37 67.71 Favored Glycine 0 N--CA 1.441 -0.975 0 N-CA-C 111.458 -0.657 . . . . 0.0 111.458 177.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -56.26 -39.57 72.83 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.265 1.026 . . . . 0.0 108.955 178.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.404 ' HA ' HE21 ' A' ' 40' ' ' GLN . 0.0 OUTLIER -99.1 -20.71 16.54 Favored 'General case' 0 N--CA 1.434 -1.27 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 179.211 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.414 HD12 HG23 ' A' ' 12' ' ' VAL . 2.6 tt -64.75 -51.47 62.16 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.915 0.886 . . . . 0.0 109.856 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.405 HD21 HG21 ' A' ' 4' ' ' VAL . 25.6 mt -62.31 -34.32 76.38 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.547 0.689 . . . . 0.0 111.718 -175.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.404 HE21 ' HA ' ' A' ' 37' ' ' GLN . 5.0 pp0? -101.56 13.59 34.51 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -177.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.409 HD23 ' HD3' ' A' ' 45' ' ' LYS . 41.3 mt -55.03 155.19 4.73 Favored 'General case' 0 C--O 1.24 0.588 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 177.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -159.38 -176.66 5.92 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 176.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.95 -39.25 93.88 Favored Glycine 0 N--CA 1.429 -1.791 0 CA-C-O 118.982 -0.899 . . . . 0.0 113.014 -179.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 -57.55 -45.15 85.47 Favored 'General case' 0 CA--C 1.481 -1.686 0 CA-C-N 117.845 0.822 . . . . 0.0 111.896 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.409 ' HD3' HD23 ' A' ' 41' ' ' LEU . 15.1 mtpp -63.77 -46.31 85.82 Favored 'General case' 0 C--O 1.199 -1.58 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.999 177.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 83.8 mt -60.14 -32.48 71.07 Favored 'General case' 0 C--O 1.244 0.779 0 CA-C-O 121.679 0.752 . . . . 0.0 111.352 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.709 ' HA ' HG22 ' A' ' 52' ' ' THR . 40.9 mtpt -72.11 -34.74 68.83 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.922 175.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.07 -13.26 61.17 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 123.12 0.568 . . . . 0.0 111.434 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.623 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.3 mm? -77.71 -7.66 56.81 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-O 121.449 0.642 . . . . 0.0 109.544 173.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.89 -1.43 46.93 Favored Glycine 0 C--O 1.222 -0.614 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.955 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.414 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 37.6 tpp -85.15 -48.27 9.33 Favored 'General case' 0 N--CA 1.441 -0.885 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -178.395 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.709 HG22 ' HA ' ' A' ' 47' ' ' LYS . 70.5 p 55.72 17.02 2.21 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 125.579 1.552 . . . . 0.0 114.274 172.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.453 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 40.5 t -65.14 118.75 9.66 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 122.669 0.388 . . . . 0.0 111.25 -176.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.5 t -59.61 -46.46 88.89 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 123.745 0.818 . . . . 0.0 110.56 -177.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -57.13 -48.53 78.44 Favored 'General case' 0 C--O 1.241 0.619 0 O-C-N 123.427 0.455 . . . . 0.0 111.434 178.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.667 ' O ' HG12 ' A' ' 60' ' ' VAL . 29.0 m-20 -66.9 -44.81 79.84 Favored 'General case' 0 CA--C 1.474 -1.969 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.576 -177.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.666 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 28.5 mtm180 -58.15 -35.66 71.87 Favored 'General case' 0 C--O 1.196 -1.735 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 -178.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.81 -27.49 62.0 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.315 0.579 . . . . 0.0 110.648 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 47.8 tp -85.58 -51.57 6.4 Favored 'General case' 0 C--O 1.247 0.945 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.891 -177.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.667 HG12 ' O ' ' A' ' 56' ' ' ASP . 4.4 p -60.67 -22.52 26.31 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.513 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.003 178.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.666 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 26.5 tptp -70.55 -33.84 71.58 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 122.082 0.944 . . . . 0.0 108.877 -174.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -82.76 -43.28 16.94 Favored 'General case' 0 C--N 1.288 -2.103 0 CA-C-N 114.221 -1.354 . . . . 0.0 108.974 -178.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.462 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.8 OUTLIER -69.98 -36.31 75.09 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 114.734 -1.121 . . . . 0.0 112.198 -175.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.0 pp -69.7 -17.17 63.45 Favored 'General case' 0 C--O 1.205 -1.285 0 CA-C-N 116.757 -0.202 . . . . 0.0 111.303 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -98.47 0.57 45.45 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 119.719 -0.792 . . . . 0.0 112.342 176.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 . . . . . 0 C--N 1.322 -0.63 0 CA-C-O 122.82 1.295 . . . . 0.0 108.538 177.554 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.615 HG12 ' CH2' ' A' ' 7' ' ' TRP . 10.2 m . . . . . 0 CA--C 1.512 -0.506 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.4 p-80 -70.98 -12.98 61.84 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-O 121.39 0.615 . . . . 0.0 110.488 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -95.46 -2.18 49.29 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 123.908 0.883 . . . . 0.0 110.132 178.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.615 ' CH2' HG12 ' A' ' 4' ' ' VAL . 52.1 m0 -84.75 131.09 34.6 Favored 'General case' 0 N--CA 1.433 -1.304 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 179.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.2 m -87.57 -72.98 0.5 Allowed 'General case' 0 C--N 1.296 -1.754 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.801 -175.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.44 ' O ' HG12 ' A' ' 12' ' ' VAL . 66.7 t -143.49 -63.71 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.2 -1.514 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -179.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.427 ' NE2' ' HG3' ' A' ' 11' ' ' GLN . 4.3 pm0 -64.38 -24.7 67.73 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.051 -177.352 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.57 HE21 ' HA ' ' A' ' 7' ' ' TRP . 23.4 mt-30 -79.01 -14.51 59.15 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.44 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.8 p -73.12 -26.19 22.58 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 CA-C-O 121.666 0.746 . . . . 0.0 109.688 179.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.462 ' HA ' HD12 ' A' ' 16' ' ' LEU . 1.5 m -71.62 -26.4 62.56 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.538 -174.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . 0.545 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 78.5 m-70 -61.72 -34.48 75.87 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.194 0.521 . . . . 0.0 110.348 -178.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.489 ' O ' HD23 ' A' ' 19' ' ' LEU . 40.3 t90 -68.05 -61.44 1.86 Allowed 'General case' 0 N--CA 1.433 -1.287 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 174.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.492 HD11 ' CG ' ' A' ' 28' ' ' PHE . 46.9 mt -45.43 -51.75 11.03 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.67 1.188 . . . . 0.0 112.676 -177.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 13' ' ' SER . 93.1 t -59.5 -31.51 46.84 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.261 -177.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.7 -35.9 86.57 Favored Glycine 0 N--CA 1.438 -1.229 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.342 -176.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.489 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.5 OUTLIER -100.19 20.54 14.43 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 121.297 -0.161 . . . . 0.0 111.414 -179.214 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.5 m 68.43 20.3 8.58 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-O 121.638 0.732 . . . . 0.0 111.679 178.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.454 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -102.33 20.91 16.0 Favored 'General case' 0 C--N 1.294 -1.828 0 C-N-CA 123.961 0.904 . . . . 0.0 110.15 -178.745 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.43 ' HA ' HG23 ' A' ' 25' ' ' VAL . 5.9 p-10 -52.8 -24.33 8.7 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.533 0.733 . . . . 0.0 110.964 174.07 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -60.68 -25.14 66.15 Favored 'General case' 0 C--N 1.301 -1.502 0 C-N-CA 125.338 1.455 . . . . 0.0 111.692 176.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.556 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 3.9 m-85 -89.17 -20.24 24.47 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.43 HG23 ' HA ' ' A' ' 22' ' ' ASP . 88.5 t -54.15 -38.58 39.13 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 O-C-N 123.553 0.533 . . . . 0.0 111.95 -179.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.2 m -52.1 -37.25 53.42 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.505 0.722 . . . . 0.0 112.324 -177.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 12.9 tp10 -105.18 -30.11 9.91 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.431 -178.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.492 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.4 m-85 -54.74 -42.97 72.26 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.177 0.513 . . . . 0.0 110.894 177.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.9 m -73.57 -25.17 60.24 Favored 'General case' 0 N--CA 1.435 -1.221 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.531 -179.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -76.22 -33.39 59.22 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.482 -175.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -95.95 7.27 46.83 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 119.825 -0.75 . . . . 0.0 110.073 -179.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 60.29 37.11 20.55 Favored 'General case' 0 CA--C 1.505 -0.752 0 O-C-N 123.861 0.726 . . . . 0.0 109.569 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 50.0 mm -68.5 113.62 4.47 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 179.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.52 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 99.0 p -104.74 -170.74 1.81 Allowed 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 178.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.478 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.47 -28.26 70.89 Favored Glycine 0 C--O 1.224 -0.522 0 N-CA-C 110.895 -0.882 . . . . 0.0 110.895 179.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -54.64 -44.89 73.59 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 125.027 1.331 . . . . 0.0 110.282 177.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.78 -1.07 50.48 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.9 tt -84.07 -43.03 15.49 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 9.4 mt -58.82 -40.43 84.1 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.542 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -100.96 18.25 20.14 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -175.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.477 HD23 ' HD3' ' A' ' 45' ' ' LYS . 40.5 mt -53.74 146.67 13.12 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 178.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -153.08 172.33 17.04 Favored 'General case' 0 C--N 1.297 -1.674 0 N-CA-C 106.592 -1.632 . . . . 0.0 106.592 178.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -57.64 -30.92 62.99 Favored Glycine 0 CA--C 1.481 -2.076 0 N-CA-C 111.29 -0.724 . . . . 0.0 111.29 177.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -53.36 -47.44 69.41 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.477 ' HD3' HD23 ' A' ' 41' ' ' LEU . 14.5 mtpp -72.73 -43.96 62.3 Favored 'General case' 0 C--O 1.186 -2.255 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.378 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 91.8 mt -55.55 -37.55 68.14 Favored 'General case' 0 N--CA 1.485 1.317 0 CA-C-O 122.142 0.972 . . . . 0.0 110.835 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.798 ' HA ' HG22 ' A' ' 52' ' ' THR . 41.4 mttm -71.49 -38.73 71.16 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 114.867 -1.061 . . . . 0.0 111.106 175.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.51 -13.04 60.35 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.475 0.655 . . . . 0.0 111.357 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.47 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.0 mm? -84.09 -1.78 55.54 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 174.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 69.84 6.57 56.43 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 115.516 -0.765 . . . . 0.0 114.956 174.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.556 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 13.5 tpt -85.34 -50.92 6.93 Favored 'General case' 0 CA--C 1.494 -1.183 0 C-N-CA 118.708 -1.197 . . . . 0.0 108.007 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.798 HG22 ' HA ' ' A' ' 47' ' ' LYS . 68.5 p 54.07 28.94 9.46 Favored 'General case' 0 C--O 1.25 1.091 0 C-N-CA 125.007 1.323 . . . . 0.0 113.252 170.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.573 ' HB2' ' OD1' ' A' ' 56' ' ' ASP . 58.5 m -72.99 -166.43 0.3 Allowed 'General case' 0 N--CA 1.425 -1.695 0 C-N-CA 123.228 0.611 . . . . 0.0 112.158 -176.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.0 t -117.93 -38.57 3.22 Favored 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 121.802 -0.561 . . . . 0.0 111.13 -177.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -72.94 -32.43 65.25 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-O 121.312 0.577 . . . . 0.0 110.99 -175.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.684 ' O ' HG12 ' A' ' 60' ' ' VAL . 10.4 p-10 -70.85 -40.31 72.43 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 -176.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.9 mmm180 -57.98 -14.7 6.93 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 125.161 1.384 . . . . 0.0 112.203 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -106.02 -38.39 6.33 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.396 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.431 HD12 HD12 ' A' ' 19' ' ' LEU . 0.8 OUTLIER -75.3 -63.09 1.35 Allowed 'General case' 0 C--O 1.243 0.745 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.467 -176.17 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.684 HG12 ' O ' ' A' ' 56' ' ' ASP . 11.8 p -62.98 -24.39 35.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 122.083 0.944 . . . . 0.0 109.977 -174.204 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 51.8 tptt -68.87 -28.24 66.53 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 113.893 -1.503 . . . . 0.0 110.088 -175.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -89.98 -32.79 16.63 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.508 179.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.11 -39.89 60.32 Favored 'General case' 0 C--N 1.294 -1.843 0 CA-C-N 114.95 -1.023 . . . . 0.0 112.049 -177.06 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.1 pp -65.41 -28.31 69.16 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.184 0.516 . . . . 0.0 110.977 -176.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -83.81 -10.76 57.83 Favored 'General case' 0 C--N 1.316 -0.885 0 C-N-CA 120.665 -0.414 . . . . 0.0 111.894 -178.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 . . . . . 0 CA--C 1.489 -1.384 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 179.645 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.513 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 4.4 m . . . . . 0 CA--C 1.509 -0.632 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -67.79 -17.93 64.69 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 120.977 0.418 . . . . 0.0 110.775 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -91.6 -12.36 34.52 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 123.224 0.61 . . . . 0.0 110.117 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.491 ' O ' ' HB2' ' A' ' 34' ' ' SER . 51.4 m0 -65.84 140.17 58.36 Favored 'General case' 0 CA--C 1.494 -1.206 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.33 -178.279 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.52 -89.28 0.16 Allowed 'General case' 0 N--CA 1.412 -2.333 0 CA-C-N 114.992 -1.004 . . . . 0.0 111.501 -178.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.537 ' O ' HG12 ' A' ' 12' ' ' VAL . 91.9 t -137.36 -59.88 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.284 -2.254 0 CA-C-N 114.2 -1.364 . . . . 0.0 108.145 -177.376 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -71.85 -14.73 62.04 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-O 121.246 0.546 . . . . 0.0 111.697 -178.168 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.535 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 47.2 mt-30 -78.68 -22.67 46.41 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.109 176.609 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.537 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.4 p -75.28 -27.02 19.11 Favored 'Isoleucine or valine' 0 C--O 1.244 0.781 0 CA-C-O 121.761 0.791 . . . . 0.0 109.029 -177.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.2 -29.21 67.13 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 114.823 -1.08 . . . . 0.0 110.574 -178.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . 0.535 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 67.4 m-70 -60.19 -36.38 77.5 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.517 ' O ' HD23 ' A' ' 19' ' ' LEU . 37.6 t90 -69.41 -61.21 1.88 Allowed 'General case' 0 N--CA 1.426 -1.632 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.564 176.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.42 HD11 ' CD2' ' A' ' 28' ' ' PHE . 32.6 mt -47.53 -50.9 22.45 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.137 0.975 . . . . 0.0 112.466 -176.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.5 t -60.85 -28.74 43.89 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 C-N-CA 122.311 0.244 . . . . 0.0 111.092 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -72.37 -23.16 78.4 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 116.177 -0.465 . . . . 0.0 112.147 -176.065 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.517 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -110.55 19.59 18.56 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 121.009 -0.276 . . . . 0.0 110.933 176.623 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.4 m 66.81 24.42 9.83 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.384 0.673 . . . . 0.0 112.139 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.468 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -99.72 19.81 15.25 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 124.978 1.311 . . . . 0.0 108.836 -179.02 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -52.6 -28.41 21.05 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 124.228 1.011 . . . . 0.0 111.773 176.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.468 ' NE2' ' HA ' ' A' ' 21' ' ' LEU . 0.4 OUTLIER -70.23 -14.67 62.72 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 120.071 -0.652 . . . . 0.0 112.468 177.901 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.427 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 2.3 m-85 -88.53 -20.69 24.76 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.114 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 96.8 t -58.0 -34.19 48.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.344 178.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.7 m -48.41 -42.11 31.11 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.701 1.2 . . . . 0.0 111.457 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 10.9 tp10 -106.52 -29.62 9.56 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.569 -177.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.42 ' CD2' HD11 ' A' ' 16' ' ' LEU . 1.9 m-85 -55.0 -42.2 72.23 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-O 121.524 0.678 . . . . 0.0 110.316 176.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.417 ' HA ' HG13 ' A' ' 9' ' ' VAL . 39.7 t -71.96 -24.68 61.64 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.158 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -80.13 -31.37 39.09 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.531 -174.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -99.1 3.47 46.68 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 119.734 -0.787 . . . . 0.0 110.266 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 60.46 41.37 15.98 Favored 'General case' 0 C--O 1.243 0.743 0 O-C-N 123.881 0.738 . . . . 0.0 109.398 -179.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 42.7 mm -70.4 108.79 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.097 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.491 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 80.7 p -100.57 -170.43 1.86 Allowed 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 108.496 -0.928 . . . . 0.0 108.496 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.513 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -61.49 -27.05 67.3 Favored Glycine 0 N--CA 1.448 -0.552 0 N-CA-C 111.468 -0.653 . . . . 0.0 111.468 178.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -56.27 -43.94 79.27 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 124.548 1.139 . . . . 0.0 109.598 177.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.63 -5.5 35.29 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.427 -179.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.494 HD12 HG23 ' A' ' 12' ' ' VAL . 3.4 tt -78.78 -49.65 12.65 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 124.368 1.067 . . . . 0.0 108.86 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.416 HD21 HG21 ' A' ' 4' ' ' VAL . 54.7 mt -59.54 -35.83 74.96 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.698 -178.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.436 HE22 ' HD2' ' A' ' 45' ' ' LYS . 4.6 pp0? -97.01 11.77 34.92 Favored 'General case' 0 C--N 1.297 -1.699 0 CA-C-N 115.348 -0.842 . . . . 0.0 112.955 -176.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.405 ' CB ' HD22 ' A' ' 64' ' ' LEU . 41.3 mt -54.64 154.96 4.46 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 178.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -157.73 168.91 25.89 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 -178.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.81 -36.96 67.49 Favored Glycine 0 CA--C 1.496 -1.124 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -54.47 -46.57 73.4 Favored 'General case' 0 CA--C 1.5 -0.973 0 C-N-CA 122.965 0.506 . . . . 0.0 111.988 178.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.436 ' HD2' HE22 ' A' ' 40' ' ' GLN . 11.8 mtpp -66.48 -45.78 78.49 Favored 'General case' 0 C--O 1.195 -1.791 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.993 175.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 82.2 mt -59.6 -24.98 64.25 Favored 'General case' 0 C--O 1.254 1.319 0 C-N-CA 123.192 0.597 . . . . 0.0 111.954 -178.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.673 ' HA ' HG22 ' A' ' 52' ' ' THR . 23.4 mtpp -81.19 -31.2 34.1 Favored 'General case' 0 N--CA 1.437 -1.105 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.391 176.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.28 -4.73 57.74 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 123.253 0.621 . . . . 0.0 111.205 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.456 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.5 mm? -85.01 -3.89 58.95 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 173.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.18 -8.13 7.07 Favored Glycine 0 C--N 1.333 0.369 0 CA-C-N 115.708 -0.678 . . . . 0.0 113.842 176.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.427 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 4.9 tpt -77.69 -48.28 17.12 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.673 HG22 ' HA ' ' A' ' 47' ' ' LYS . 67.9 p 52.3 26.31 3.96 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.323 1.449 . . . . 0.0 113.1 174.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.44 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 45.2 t -66.66 117.5 8.91 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 120.909 0.385 . . . . 0.0 110.994 -175.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.1 m -61.6 -39.18 90.28 Favored 'General case' 0 C--O 1.248 1.008 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.262 -176.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -68.37 -45.31 73.1 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.145 179.241 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.567 ' O ' HG12 ' A' ' 60' ' ' VAL . 36.5 m-20 -71.18 -40.46 71.22 Favored 'General case' 0 CA--C 1.487 -1.462 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.488 -177.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.504 ' HA ' HG12 ' A' ' 60' ' ' VAL . 31.0 mtm180 -60.72 -31.44 70.74 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -78.46 -2.56 39.12 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.138 0.494 . . . . 0.0 110.88 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 40.5 tp -115.64 -47.99 2.79 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 120.96 0.409 . . . . 0.0 110.968 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.567 HG12 ' O ' ' A' ' 56' ' ' ASP . 5.2 p -60.4 -27.23 39.4 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.209 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.817 178.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -68.16 -36.45 79.65 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 122.005 0.907 . . . . 0.0 109.269 -175.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.414 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 23.8 ttmm -77.99 -41.81 34.72 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 113.724 -1.58 . . . . 0.0 108.776 -177.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.478 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.5 OUTLIER -69.67 -41.97 74.79 Favored 'General case' 0 C--O 1.186 -2.266 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.61 -177.65 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.405 HD22 ' CB ' ' A' ' 41' ' ' LEU . 3.2 pp -65.63 -30.88 71.65 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 120.828 0.347 . . . . 0.0 111.411 -176.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -81.79 -18.91 42.43 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.162 -0.615 . . . . 0.0 111.307 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 11.6 pt-20 . . . . . 0 C--O 1.212 -0.883 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.356 177.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.601 HG12 ' CH2' ' A' ' 7' ' ' TRP . 9.4 m . . . . . 0 C--O 1.219 -0.523 0 CA-C-O 121.133 0.492 . . . . 0.0 112.316 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.1 p-80 -70.91 -9.59 58.06 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.382 -177.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -102.73 -0.82 31.04 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.487 179.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.601 ' CH2' HG12 ' A' ' 4' ' ' VAL . 54.5 m0 -79.5 149.82 31.37 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.098 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.9 m -102.1 -79.49 0.52 Allowed 'General case' 0 N--CA 1.419 -2.023 0 O-C-N 123.469 0.481 . . . . 0.0 109.779 -177.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.483 ' O ' HG12 ' A' ' 12' ' ' VAL . 57.9 t -139.38 -60.46 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.432 HE21 ' HG3' ' A' ' 11' ' ' GLN . 0.4 OUTLIER -75.3 5.19 5.9 Favored 'General case' 0 C--O 1.215 -0.76 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -176.37 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.527 HE21 ' HA ' ' A' ' 7' ' ' TRP . 25.9 mt-30 -103.62 -13.08 16.66 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.602 175.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.515 HG23 HD12 ' A' ' 38' ' ' LEU . 2.4 p -81.08 -24.46 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 CA-C-O 121.811 0.815 . . . . 0.0 109.406 -179.186 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.472 ' HB3' ' CG1' ' A' ' 25' ' ' VAL . 0.3 OUTLIER -67.61 -36.15 80.3 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.449 -178.557 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 80.9 m-70 -57.77 -32.15 67.21 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.084 0.469 . . . . 0.0 110.486 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.511 ' O ' HD23 ' A' ' 19' ' ' LEU . 30.2 t90 -72.83 -60.97 1.98 Allowed 'General case' 0 N--CA 1.426 -1.658 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.202 174.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.586 HD11 ' CD2' ' A' ' 28' ' ' PHE . 44.2 mt -47.04 -51.96 16.14 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.132 0.973 . . . . 0.0 112.656 -177.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 13' ' ' SER . 77.4 t -61.69 -24.75 34.95 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 C-N-CA 122.896 0.478 . . . . 0.0 111.0 -177.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.11 -34.92 54.49 Favored Glycine 0 N--CA 1.436 -1.31 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 -177.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.511 HD23 ' O ' ' A' ' 15' ' ' TRP . 1.2 pt? -97.83 16.03 22.0 Favored 'General case' 0 C--O 1.214 -0.802 0 C-N-CA 121.071 -0.252 . . . . 0.0 111.107 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.0 m 73.81 14.49 4.09 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.146 0.978 . . . . 0.0 112.156 178.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -93.16 21.97 5.47 Favored 'General case' 0 C--N 1.292 -1.895 0 C-N-CA 124.55 1.14 . . . . 0.0 108.928 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -51.75 -32.82 32.29 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 124.165 0.986 . . . . 0.0 110.554 174.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -63.12 -22.71 67.05 Favored 'General case' 0 CA--C 1.548 0.88 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.757 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -86.84 -22.37 25.84 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.76 -178.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.472 ' CG1' ' HB3' ' A' ' 13' ' ' SER . 35.0 t -57.8 -34.06 47.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 O-C-N 123.101 0.25 . . . . 0.0 110.518 179.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.1 t -51.0 -35.56 34.59 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.995 0.918 . . . . 0.0 111.487 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 19.2 tp10 -108.15 -32.43 7.52 Favored 'General case' 0 N--CA 1.432 -1.346 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.916 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.586 ' CD2' HD11 ' A' ' 16' ' ' LEU . 2.1 m-85 -53.95 -40.34 66.72 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-O 121.214 0.53 . . . . 0.0 110.793 175.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 33.7 t -73.23 -25.56 60.79 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.594 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.56 -34.1 53.87 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 121.965 -0.459 . . . . 0.0 110.909 -175.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 2.5 mt-30 -95.63 -3.29 46.53 Favored 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 120.397 -0.521 . . . . 0.0 109.98 -178.732 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.1 m-80 62.85 45.08 5.82 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 121.799 0.809 . . . . 0.0 109.139 -178.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.4 mm -68.87 110.29 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.195 0 CA-C-N 114.358 -1.292 . . . . 0.0 108.638 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.455 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 89.8 p -102.53 -169.26 1.64 Allowed 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.567 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -63.49 -22.46 65.76 Favored Glycine 0 N--CA 1.439 -1.117 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.955 177.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -59.29 -42.46 91.36 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 177.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.542 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -93.93 -22.29 18.69 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.813 -179.415 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.515 HD12 HG23 ' A' ' 12' ' ' VAL . 3.0 tt -62.51 -50.41 71.49 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 124.587 1.155 . . . . 0.0 109.65 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 67.8 mt -64.14 -38.51 91.31 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.235 -0.438 . . . . 0.0 112.128 -177.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -96.23 11.05 35.9 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -177.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.572 ' HB2' HD22 ' A' ' 64' ' ' LEU . 29.0 mt -50.5 136.61 20.62 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 122.322 1.058 . . . . 0.0 113.444 178.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -137.5 165.56 25.99 Favored 'General case' 0 C--N 1.285 -2.231 0 N-CA-C 107.34 -1.355 . . . . 0.0 107.34 -179.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -53.46 -39.46 59.87 Favored Glycine 0 C--O 1.212 -1.232 0 O-C-N 123.732 0.645 . . . . 0.0 111.774 178.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -53.01 -44.72 67.51 Favored 'General case' 0 CA--C 1.496 -1.111 0 C-N-CA 122.669 0.387 . . . . 0.0 111.23 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.415 ' HE3' ' HB3' ' A' ' 45' ' ' LYS . 11.4 mtpp -67.83 -50.05 58.81 Favored 'General case' 0 C--O 1.201 -1.48 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.664 178.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.8 mt -56.88 -31.12 64.53 Favored 'General case' 0 C--O 1.256 1.441 0 C-N-CA 123.645 0.778 . . . . 0.0 112.072 -177.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.755 ' HA ' HG22 ' A' ' 52' ' ' THR . 57.0 mtpt -80.08 -37.81 33.02 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.981 178.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.85 -15.4 62.64 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 122.99 0.516 . . . . 0.0 111.218 178.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.437 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.3 mm? -72.47 -4.78 32.39 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.245 0.618 . . . . 0.0 110.143 173.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 71.02 20.28 77.75 Favored Glycine 0 CA--C 1.501 -0.815 0 CA-C-N 116.416 -0.356 . . . . 0.0 112.524 177.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 23.2 mmt -105.71 -63.81 1.21 Allowed 'General case' 0 C--N 1.304 -1.389 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.795 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.755 HG22 ' HA ' ' A' ' 47' ' ' LYS . 20.2 p 64.15 13.33 7.75 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.697 1.599 . . . . 0.0 113.301 173.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.6 m -58.92 122.48 13.75 Favored 'General case' 0 N--CA 1.433 -1.314 0 C-N-CA 123.914 0.886 . . . . 0.0 111.143 -176.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.8 m -55.53 -35.13 65.33 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 -174.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -79.87 -33.7 39.85 Favored 'General case' 0 CA--C 1.497 -1.064 0 C-N-CA 119.255 -0.978 . . . . 0.0 111.207 -178.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.694 ' O ' HG12 ' A' ' 60' ' ' VAL . 1.7 m-20 -68.35 -44.9 74.25 Favored 'General case' 0 CA--C 1.477 -1.828 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -50.21 -29.4 9.33 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 124.75 1.22 . . . . 0.0 113.168 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -98.0 -37.5 9.75 Favored 'General case' 0 C--N 1.307 -1.279 0 O-C-N 123.578 0.549 . . . . 0.0 111.134 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 43.0 tp -74.4 -51.54 14.69 Favored 'General case' 0 C--O 1.243 0.715 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -175.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.694 HG12 ' O ' ' A' ' 56' ' ' ASP . 10.7 p -62.51 -24.62 35.78 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.986 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -179.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.426 ' HA ' ' CD2' ' A' ' 64' ' ' LEU . 56.5 tptt -73.57 -27.07 61.13 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.971 -1.468 . . . . 0.0 110.054 -173.394 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -88.41 -37.03 16.2 Favored 'General case' 0 C--N 1.291 -1.937 0 CA-C-N 114.956 -1.02 . . . . 0.0 108.834 178.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.438 ' HG2' HD13 ' A' ' 19' ' ' LEU . 2.6 tppt? -69.33 -41.33 76.8 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.165 -177.314 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.572 HD22 ' HB2' ' A' ' 41' ' ' LEU . 4.1 pp -64.42 -30.93 71.96 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 122.919 0.488 . . . . 0.0 112.263 -177.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -82.44 -27.24 32.06 Favored 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 119.784 -0.766 . . . . 0.0 111.642 -178.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 . . . . . 0 C--N 1.317 -0.838 0 C-N-CA 120.529 -0.468 . . . . 0.0 109.826 178.422 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.465 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 4.2 m . . . . . 0 CA--C 1.509 -0.627 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 9.3 p-80 -71.44 -9.8 58.75 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.527 0.68 . . . . 0.0 110.444 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -93.09 -10.3 36.49 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.94 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 54.8 m0 -80.98 146.94 30.45 Favored 'General case' 0 CA--C 1.498 -1.045 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 70.2 m -104.62 -73.83 0.66 Allowed 'General case' 0 N--CA 1.413 -2.289 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.488 ' O ' HG12 ' A' ' 12' ' ' VAL . 55.6 t -140.79 -50.31 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.096 0 CA-C-O 121.918 0.866 . . . . 0.0 110.497 -174.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -75.61 -21.74 57.5 Favored 'General case' 0 C--N 1.282 -2.336 0 CA-C-N 114.503 -1.226 . . . . 0.0 111.348 -177.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.493 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 27.1 mt-30 -91.94 -11.42 36.27 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -176.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 9' ' ' VAL . 3.8 p -74.36 -25.83 19.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 CA-C-O 122.026 0.917 . . . . 0.0 108.545 178.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.44 ' HA ' HD12 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -69.76 -28.95 66.19 Favored 'General case' 0 N--CA 1.427 -1.583 0 CA-C-N 114.505 -1.225 . . . . 0.0 111.519 -176.139 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . 0.493 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 37.8 m-70 -63.61 -32.51 74.0 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.946 0.403 . . . . 0.0 110.15 -177.403 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.487 ' O ' HD23 ' A' ' 19' ' ' LEU . 27.5 t90 -69.41 -58.49 3.93 Favored 'General case' 0 N--CA 1.436 -1.147 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.46 175.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.461 HD11 ' CD2' ' A' ' 28' ' ' PHE . 48.3 mt -46.84 -50.39 18.57 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.307 1.043 . . . . 0.0 112.539 -177.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.0 t -60.2 -30.19 45.46 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.1 0 CA-C-O 120.822 0.344 . . . . 0.0 111.135 -178.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.01 -27.04 74.27 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 116.027 -0.533 . . . . 0.0 112.148 -176.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.487 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -107.28 15.93 24.52 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 178.845 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.5 m 70.64 25.62 4.09 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-O 121.694 0.759 . . . . 0.0 111.589 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.406 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.2 mm? -102.74 19.46 19.17 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 124.828 1.251 . . . . 0.0 110.516 -179.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -51.92 -30.6 25.03 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.214 0.531 . . . . 0.0 111.243 175.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -58.74 -23.13 59.36 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.87 0.868 . . . . 0.0 111.84 177.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -88.45 -22.98 23.4 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 94.8 t -54.44 -36.39 34.29 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 CA-C-O 120.885 0.374 . . . . 0.0 110.889 -178.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 22.7 t -46.62 -40.98 13.93 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.585 1.554 . . . . 0.0 111.649 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 39.2 tp10 -108.17 -28.93 9.2 Favored 'General case' 0 N--CA 1.438 -1.027 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.676 -179.024 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.461 ' CD2' HD11 ' A' ' 16' ' ' LEU . 1.1 m-85 -54.39 -46.1 73.02 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-O 121.432 0.634 . . . . 0.0 110.775 177.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 41.3 m -83.43 -6.33 59.43 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.038 -178.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.93 -37.14 20.89 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -91.4 0.79 57.46 Favored 'General case' 0 CA--C 1.506 -0.725 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.223 -178.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 66.17 38.64 4.57 Favored 'General case' 0 CA--C 1.512 -0.507 0 O-C-N 124.059 0.849 . . . . 0.0 109.731 -178.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.3 mm -67.75 116.06 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 178.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 90.8 p -105.94 -166.71 1.23 Allowed 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.465 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -63.35 -25.02 68.06 Favored Glycine 0 N--CA 1.439 -1.154 0 N-CA-C 110.956 -0.858 . . . . 0.0 110.956 177.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -56.65 -45.98 81.3 Favored 'General case' 0 CA--C 1.508 -0.635 0 C-N-CA 123.474 0.71 . . . . 0.0 109.786 177.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.573 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -92.61 -14.85 27.62 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.925 -177.485 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.437 HD12 HG23 ' A' ' 12' ' ' VAL . 3.7 tt -69.2 -50.41 47.65 Favored 'General case' 0 C--N 1.311 -1.076 0 O-C-N 123.955 0.784 . . . . 0.0 109.092 179.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 37.8 mt -63.92 -42.71 97.32 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.454 -177.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.434 HE21 ' HA ' ' A' ' 37' ' ' GLN . 5.1 pp0? -91.8 14.97 13.9 Favored 'General case' 0 CA--C 1.564 1.519 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -176.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' A' ' 37' ' ' GLN . 35.4 mt -57.01 158.42 4.98 Favored 'General case' 0 C--O 1.246 0.909 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 176.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.417 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 3.1 p-10 -165.4 -178.67 5.1 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 177.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.81 -41.28 83.09 Favored Glycine 0 C--O 1.214 -1.154 0 CA-C-O 119.256 -0.747 . . . . 0.0 113.464 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -55.63 -46.09 77.47 Favored 'General case' 0 CA--C 1.485 -1.521 0 CA-C-N 117.355 0.578 . . . . 0.0 111.376 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.465 ' HD3' HD23 ' A' ' 41' ' ' LEU . 14.5 mtpp -66.12 -45.67 80.27 Favored 'General case' 0 C--O 1.198 -1.652 0 O-C-N 123.522 0.514 . . . . 0.0 110.724 177.2 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 92.2 mt -60.85 -24.1 65.64 Favored 'General case' 0 C--O 1.258 1.548 0 CA-C-O 121.391 0.615 . . . . 0.0 111.601 -178.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.735 ' HA ' HG22 ' A' ' 52' ' ' THR . 58.1 mtpt -85.16 -39.54 17.75 Favored 'General case' 0 N--CA 1.433 -1.285 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.044 176.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.23 -14.15 61.28 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.744 0.783 . . . . 0.0 110.956 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.553 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 3.6 mm? -75.74 3.27 10.13 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.296 172.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 63.75 19.22 62.71 Favored Glycine 0 C--N 1.342 0.891 0 CA-C-O 121.283 0.38 . . . . 0.0 112.506 177.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 23.1 mmt -103.57 -63.1 1.22 Allowed 'General case' 0 N--CA 1.421 -1.921 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -176.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.735 HG22 ' HA ' ' A' ' 47' ' ' LYS . 29.5 p 57.64 22.25 8.09 Favored 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 124.447 1.099 . . . . 0.0 112.24 176.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 35.6 t -61.08 118.74 7.17 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 124.47 1.108 . . . . 0.0 111.248 -174.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.9 m -53.29 -41.24 65.41 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 124.414 1.086 . . . . 0.0 113.609 -176.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -65.77 -51.91 55.29 Favored 'General case' 0 CA--C 1.5 -0.945 0 CA-C-O 122.295 1.045 . . . . 0.0 109.922 177.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.674 ' O ' HG12 ' A' ' 60' ' ' VAL . 63.7 m-20 -66.66 -35.92 81.32 Favored 'General case' 0 N--CA 1.419 -2.013 0 CA-C-N 113.734 -1.575 . . . . 0.0 111.364 -170.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.7 mmm180 -58.53 -14.68 8.6 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 175.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -107.56 -35.57 6.7 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-O 120.656 0.265 . . . . 0.0 110.965 174.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 48.8 tp -81.14 -57.57 3.45 Favored 'General case' 0 C--O 1.241 0.612 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -176.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.674 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.7 p -61.31 -21.03 23.94 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.801 0 CA-C-O 121.535 0.683 . . . . 0.0 110.31 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.455 ' HD2' HD21 ' A' ' 64' ' ' LEU . 0.9 OUTLIER -70.22 -26.17 63.74 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.579 -179.689 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.492 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 51.5 tttp -86.98 -40.58 14.63 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 114.939 -1.028 . . . . 0.0 108.828 178.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.486 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.6 OUTLIER -69.76 -43.63 71.83 Favored 'General case' 0 C--O 1.19 -2.065 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.801 -175.054 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.455 HD21 ' HD2' ' A' ' 61' ' ' LYS . 3.7 pp -61.58 -30.03 70.41 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.028 0.442 . . . . 0.0 111.805 -175.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 53.7 pttt -84.98 -18.97 32.85 Favored 'General case' 0 C--N 1.315 -0.93 0 C-N-CA 119.675 -0.81 . . . . 0.0 112.504 -178.083 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 12.0 pt-20 . . . . . 0 C--N 1.307 -1.26 0 CA-C-O 121.169 0.509 . . . . 0.0 111.116 178.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.557 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.5 m . . . . . 0 C--O 1.215 -0.745 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -72.89 -4.54 32.57 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-O 121.445 0.64 . . . . 0.0 110.828 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -103.36 -2.47 26.98 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.291 178.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.618 ' HA ' HE21 ' A' ' 11' ' ' GLN . 53.2 m0 -83.19 136.99 34.22 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.327 -177.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.7 m -90.69 -72.88 0.55 Allowed 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.899 -176.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.45 ' O ' HG12 ' A' ' 12' ' ' VAL . 79.4 t -143.56 -65.91 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.199 -1.564 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 -179.476 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 -66.91 -17.92 65.13 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.153 0.501 . . . . 0.0 112.349 -175.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.618 HE21 ' HA ' ' A' ' 7' ' ' TRP . 27.1 mt-30 -81.05 -17.75 49.09 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.98 178.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.495 ' HA ' ' CE3' ' A' ' 7' ' ' TRP . 2.2 p -69.45 -24.95 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-O 121.912 0.863 . . . . 0.0 109.47 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.415 ' HA ' HD12 ' A' ' 16' ' ' LEU . 1.0 OUTLIER -70.58 -23.87 62.67 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-N 114.609 -1.178 . . . . 0.0 111.449 -176.881 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 51.5 m-70 -62.19 -39.19 91.89 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 110.285 -0.265 . . . . 0.0 110.285 -178.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.498 ' O ' HD23 ' A' ' 19' ' ' LEU . 32.6 t90 -67.91 -58.29 4.8 Favored 'General case' 0 N--CA 1.44 -0.94 0 O-C-N 123.816 0.697 . . . . 0.0 109.827 176.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.539 HD11 ' CD2' ' A' ' 28' ' ' PHE . 43.9 mt -47.1 -50.17 20.48 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.141 0.976 . . . . 0.0 112.511 -177.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 86.1 t -61.5 -26.38 39.36 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.076 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.463 -178.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.76 -26.09 68.06 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 116.33 -0.396 . . . . 0.0 112.197 -177.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.498 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -105.6 13.68 29.59 Favored 'General case' 0 C--N 1.321 -0.666 0 O-C-N 122.405 -0.467 . . . . 0.0 111.349 177.89 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.6 m 70.74 21.45 5.24 Favored 'General case' 0 C--O 1.211 -0.94 0 CA-C-O 121.866 0.841 . . . . 0.0 111.611 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.412 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.9 mm? -98.52 19.8 13.91 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.984 178.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -53.04 -25.76 13.51 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.829 0.852 . . . . 0.0 111.163 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -69.63 -18.77 63.62 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 123.504 0.722 . . . . 0.0 110.723 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -85.92 -22.06 27.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.526 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 89.3 t -54.49 -37.98 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 O-C-N 123.633 0.583 . . . . 0.0 111.132 -179.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.3 m -52.31 -33.09 40.76 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.077 0.951 . . . . 0.0 112.296 -177.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 53.3 tp10 -111.63 -27.69 8.44 Favored 'General case' 0 N--CA 1.444 -0.732 0 O-C-N 122.358 -0.214 . . . . 0.0 110.802 179.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.539 ' CD2' HD11 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -56.68 -42.29 78.79 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 121.677 0.751 . . . . 0.0 109.884 175.138 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 31.0 t -73.73 -21.56 60.17 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.709 -1.132 . . . . 0.0 109.605 -179.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.54 -39.79 24.1 Favored 'General case' 0 N--CA 1.436 -1.132 0 O-C-N 121.905 -0.497 . . . . 0.0 110.907 -176.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -87.36 2.51 50.15 Favored 'General case' 0 CA--C 1.501 -0.94 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.182 -177.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 65.07 34.94 8.34 Favored 'General case' 0 CA--C 1.501 -0.922 0 O-C-N 124.322 1.014 . . . . 0.0 109.713 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.8 mm -66.32 112.41 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.529 0 CA-C-N 114.7 -1.136 . . . . 0.0 108.244 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.489 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 97.5 p -103.46 -170.33 1.77 Allowed 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 178.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.557 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.43 -30.04 75.15 Favored Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -51.7 -48.0 63.69 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 123.986 0.914 . . . . 0.0 110.02 175.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.09 -22.51 25.36 Favored 'General case' 0 CA--C 1.502 -0.894 0 C-N-CA 120.49 -0.484 . . . . 0.0 111.786 -177.197 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.4 tt -61.33 -48.63 80.44 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 124.84 1.256 . . . . 0.0 109.272 178.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 35' ' ' GLY . 28.2 mt -65.89 -39.61 90.79 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.604 -178.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -95.55 22.17 7.38 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -177.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.459 HD23 ' HD3' ' A' ' 45' ' ' LYS . 59.7 mt -64.04 158.85 21.5 Favored 'General case' 0 C--O 1.247 0.923 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 176.025 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.478 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 2.8 p30 -164.52 178.28 7.5 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 175.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.51 -38.35 70.27 Favored Glycine 0 C--O 1.218 -0.883 0 O-C-N 123.764 0.665 . . . . 0.0 113.898 -177.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -59.89 -42.56 94.06 Favored 'General case' 0 CA--C 1.483 -1.603 0 CA-C-N 117.39 0.595 . . . . 0.0 111.325 -178.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.459 ' HD3' HD23 ' A' ' 41' ' ' LEU . 11.6 mtpp -66.45 -45.01 81.25 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.929 178.127 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 78.3 mt -61.1 -25.28 66.86 Favored 'General case' 0 C--O 1.256 1.419 0 CA-C-O 121.599 0.714 . . . . 0.0 110.966 -179.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.814 ' HA ' HG22 ' A' ' 52' ' ' THR . 7.3 mtpm? -82.63 -41.39 19.51 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 114.782 -1.099 . . . . 0.0 110.297 176.016 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.73 -13.44 62.29 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.462 0.705 . . . . 0.0 111.396 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.493 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 3.9 mm? -75.33 -2.36 27.98 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.52 172.289 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 70.65 16.06 73.82 Favored Glycine 0 C--N 1.342 0.864 0 CA-C-O 121.774 0.652 . . . . 0.0 111.598 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 97.7 mmm -100.97 -67.58 0.85 Allowed 'General case' 0 N--CA 1.423 -1.821 0 CA-C-N 114.782 -0.709 . . . . 0.0 110.002 -176.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.814 HG22 ' HA ' ' A' ' 47' ' ' LYS . 20.9 p 65.64 -3.41 0.71 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.863 1.665 . . . . 0.0 113.938 175.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.6 m -50.75 121.39 5.82 Favored 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 126.665 1.986 . . . . 0.0 112.427 -173.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.1 p -54.31 -48.77 70.96 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -173.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -56.05 -50.06 72.02 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-O 121.844 0.83 . . . . 0.0 109.832 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.701 ' O ' HG12 ' A' ' 60' ' ' VAL . 4.8 m-20 -63.39 -47.95 79.91 Favored 'General case' 0 CA--C 1.486 -1.485 0 CA-C-N 113.874 -1.512 . . . . 0.0 109.622 -176.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 39.1 mmm-85 -49.05 -38.49 24.09 Favored 'General case' 0 CA--C 1.506 -0.721 0 C-N-CA 124.587 1.155 . . . . 0.0 112.44 -179.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -83.11 -33.74 26.25 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-O 121.197 0.523 . . . . 0.0 111.402 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.422 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 45.9 tp -80.36 -51.08 9.29 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -174.689 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.701 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.4 p -64.25 -21.26 28.61 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.217 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 4.9 tppp? -69.28 -35.95 76.57 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.149 -178.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.422 ' HG2' ' O ' ' A' ' 59' ' ' LEU . 19.1 ptmt -90.2 -18.75 25.15 Favored 'General case' 0 N--CA 1.419 -1.99 0 CA-C-N 115.089 -0.96 . . . . 0.0 109.507 -176.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.438 ' HG2' HD13 ' A' ' 19' ' ' LEU . 1.8 tppt? -84.56 -38.79 19.55 Favored 'General case' 0 C--O 1.199 -1.588 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.035 177.166 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.6 pp -66.42 -14.55 62.33 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.619 0.368 . . . . 0.0 111.731 -176.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 59.4 pttt -90.03 -12.99 36.94 Favored 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.477 176.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 . . . . . 0 CA--C 1.509 -0.629 0 CA-C-O 123.041 1.4 . . . . 0.0 109.985 -176.544 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.472 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 6.8 m . . . . . 0 CA--C 1.506 -0.716 0 N-CA-C 112.311 0.485 . . . . 0.0 112.311 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.5 p-80 -71.67 -12.8 61.51 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-O 120.97 0.414 . . . . 0.0 110.801 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -91.03 -19.43 23.2 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.625 177.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.448 ' CH2' HG12 ' A' ' 4' ' ' VAL . 50.7 m0 -58.36 145.38 38.39 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -174.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.4 m -95.43 -80.36 0.42 Allowed 'General case' 0 N--CA 1.415 -2.184 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.465 -175.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.513 ' O ' HG12 ' A' ' 12' ' ' VAL . 73.8 t -146.03 -61.85 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.554 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 -178.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.5 pm0 -67.34 -17.69 64.85 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.542 -177.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -80.02 -17.68 52.16 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.402 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.513 HG12 ' O ' ' A' ' 9' ' ' VAL . 2.6 p -74.27 -21.86 17.78 Favored 'Isoleucine or valine' 0 C--O 1.245 0.847 0 CA-C-O 121.908 0.861 . . . . 0.0 109.096 -177.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.87 -26.58 64.26 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.957 -177.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 -62.47 -32.59 73.51 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.332 0.587 . . . . 0.0 109.7 -177.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.483 ' CH2' HG23 ' A' ' 60' ' ' VAL . 28.4 t90 -74.24 -58.82 3.04 Favored 'General case' 0 N--CA 1.427 -1.591 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.473 175.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.439 HD11 ' CG ' ' A' ' 28' ' ' PHE . 38.8 mt -48.05 -48.85 32.97 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.261 1.024 . . . . 0.0 112.5 -176.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 77.2 t -60.5 -29.25 44.18 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 CA-C-O 120.769 0.319 . . . . 0.0 110.97 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -71.72 -22.2 78.74 Favored Glycine 0 N--CA 1.442 -0.952 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.406 -176.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.485 HD13 ' HG2' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -113.7 17.8 17.91 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 117.076 0.438 . . . . 0.0 111.716 177.791 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.5 m 68.84 20.82 7.87 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.699 0.8 . . . . 0.0 112.063 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.464 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.8 mm? -98.94 18.34 17.42 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.963 179.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.501 ' HA ' HG23 ' A' ' 25' ' ' VAL . 8.7 p-10 -52.34 -25.2 9.03 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.912 0.885 . . . . 0.0 111.216 175.284 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -64.47 -23.75 67.39 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 124.023 0.929 . . . . 0.0 111.373 178.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.501 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 3.0 m-85 -86.57 -20.79 27.43 Favored 'General case' 0 N--CA 1.437 -1.087 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.87 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.501 HG23 ' HA ' ' A' ' 22' ' ' ASP . 90.7 t -53.08 -40.87 39.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 C-N-CA 123.495 0.718 . . . . 0.0 111.404 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.9 m -53.7 -35.49 61.19 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.237 0.615 . . . . 0.0 112.163 -177.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.612 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 21.2 tp10 -103.7 -28.94 11.37 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.851 -179.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.439 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.9 m-85 -56.22 -32.99 64.94 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-O 121.851 0.834 . . . . 0.0 109.965 176.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.485 ' HA ' HG13 ' A' ' 9' ' ' VAL . 21.6 p -80.76 -31.73 35.79 Favored 'General case' 0 N--CA 1.423 -1.823 0 CA-C-N 114.809 -1.087 . . . . 0.0 111.722 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.36 -45.5 76.15 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-O 121.819 0.819 . . . . 0.0 110.441 -176.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -94.72 14.72 20.29 Favored 'General case' 0 C--N 1.299 -1.617 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.815 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . 0.285 4.3 p30 46.05 60.92 2.93 Favored 'General case' 0 CA--C 1.502 -0.892 0 CA-C-O 122.476 1.132 . . . . 0.0 113.429 177.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 49.5 mm -85.11 117.51 30.43 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.846 0 CA-C-N 113.86 -1.518 . . . . 0.0 107.024 176.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.6 p -106.59 -166.03 1.14 Allowed 'General case' 0 C--N 1.293 -1.861 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 177.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.472 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -64.15 -25.81 69.91 Favored Glycine 0 N--CA 1.441 -1.007 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 178.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -57.38 -45.21 84.7 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 123.693 0.797 . . . . 0.0 109.381 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.57 -3.22 43.42 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.539 -179.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.477 HD12 HG23 ' A' ' 12' ' ' VAL . 3.5 tt -81.85 -51.11 8.44 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 46.6 mt -61.08 -30.85 70.59 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.473 -176.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -103.09 13.63 33.7 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.443 ' HB2' HD22 ' A' ' 64' ' ' LEU . 37.8 mt -47.32 148.39 1.31 Allowed 'General case' 0 C--O 1.246 0.872 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 179.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.456 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 12.8 t70 -143.9 165.44 27.71 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 106.368 -1.716 . . . . 0.0 106.368 -175.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -57.28 -38.23 85.29 Favored Glycine 0 C--O 1.214 -1.143 0 N-CA-C 109.646 -1.382 . . . . 0.0 109.646 175.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -54.28 -47.98 71.75 Favored 'General case' 0 CA--C 1.495 -1.146 0 C-N-CA 123.806 0.843 . . . . 0.0 111.168 177.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.426 ' O ' HD23 ' A' ' 49' ' ' LEU . 14.2 mtpp -63.97 -46.64 83.71 Favored 'General case' 0 C--O 1.199 -1.555 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.531 177.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 83.4 mt -58.73 -25.49 63.02 Favored 'General case' 0 C--O 1.256 1.435 0 CA-C-O 121.604 0.716 . . . . 0.0 111.181 -179.272 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.775 ' HA ' HG22 ' A' ' 52' ' ' THR . 23.8 mtpp -83.43 -36.62 24.08 Favored 'General case' 0 N--CA 1.432 -1.357 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.467 176.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.34 -16.38 61.88 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.541 0.686 . . . . 0.0 111.127 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.612 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.6 mm? -73.68 -6.66 48.19 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.631 0.729 . . . . 0.0 109.094 172.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 69.87 4.52 48.16 Favored Glycine 0 CA--C 1.502 -0.779 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.512 177.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.605 ' HG3' ' OG ' ' A' ' 53' ' ' SER . 30.2 tpp -88.0 -51.16 5.97 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 -176.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.775 HG22 ' HA ' ' A' ' 47' ' ' LYS . 62.0 p 51.66 23.45 1.96 Allowed 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 125.257 1.423 . . . . 0.0 113.826 174.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.605 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 12.9 m -62.27 127.02 29.35 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 124.29 1.036 . . . . 0.0 111.939 -174.264 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.1 m -55.2 -51.25 67.15 Favored 'General case' 0 CA--C 1.553 1.079 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -172.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -58.33 -54.27 48.95 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 122.836 1.303 . . . . 0.0 109.634 178.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.743 ' O ' HG12 ' A' ' 60' ' ' VAL . 6.2 m-20 -59.57 -44.16 93.38 Favored 'General case' 0 C--N 1.282 -2.368 0 CA-C-N 112.279 -2.237 . . . . 0.0 111.026 -172.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.1 mmm180 -54.26 -23.17 13.88 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 177.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -100.18 -34.16 10.14 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.962 0.41 . . . . 0.0 110.78 176.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 48.7 tp -77.22 -57.29 3.92 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -176.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.743 HG12 ' O ' ' A' ' 56' ' ' ASP . 4.8 p -60.15 -21.01 21.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 CA-C-O 121.729 0.776 . . . . 0.0 110.628 -179.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 15.1 tppt? -65.62 -35.03 79.62 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 114.296 -1.32 . . . . 0.0 109.846 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -91.68 -30.25 16.41 Favored 'General case' 0 C--N 1.292 -1.897 0 CA-C-N 114.788 -1.097 . . . . 0.0 109.989 -177.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.485 ' HG2' HD13 ' A' ' 19' ' ' LEU . 2.8 tppt? -72.08 -40.73 68.03 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 115.067 -0.969 . . . . 0.0 111.29 -178.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.443 HD22 ' HB2' ' A' ' 41' ' ' LEU . 3.8 pp -59.2 -30.09 67.97 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.884 0.373 . . . . 0.0 111.677 -176.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -82.63 -22.27 34.78 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 120.37 -0.532 . . . . 0.0 111.901 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 . . . . . 0 C--O 1.24 0.577 0 CA-C-O 121.062 0.458 . . . . 0.0 110.178 179.758 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.572 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 4.4 m . . . . . 0 C--O 1.217 -0.606 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . 0.441 ' CD2' ' HG2' ' A' ' 6' ' ' GLU . 9.3 p-80 -70.62 -13.39 62.07 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 121.478 0.656 . . . . 0.0 110.719 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.441 ' HG2' ' CD2' ' A' ' 5' ' ' HIS . 18.3 mm-40 -96.17 -4.27 42.9 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.138 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.523 ' CD2' ' HA ' ' A' ' 4' ' ' VAL . 52.3 m0 -83.77 142.16 30.88 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.62 -178.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 21.3 m -103.58 -72.14 0.71 Allowed 'General case' 0 N--CA 1.423 -1.813 0 CA-C-O 121.195 0.522 . . . . 0.0 110.918 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.539 ' O ' HG12 ' A' ' 12' ' ' VAL . 69.9 t -139.57 -61.7 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.208 -1.12 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 -176.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.7 pm0 -66.01 -19.86 66.0 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.305 -176.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.401 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 37.2 mt-30 -86.23 -17.74 33.96 Favored 'General case' 0 N--CA 1.435 -1.212 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.477 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.539 HG12 ' O ' ' A' ' 9' ' ' VAL . 3.2 p -72.39 -24.27 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 CA-C-O 121.79 0.805 . . . . 0.0 109.785 -177.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.455 ' O ' HG23 ' A' ' 17' ' ' VAL . 1.1 m -71.22 -27.89 63.81 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.357 -177.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . 0.401 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 33.2 m-70 -59.54 -40.57 87.66 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-O 120.978 0.418 . . . . 0.0 110.095 -178.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.466 ' CH2' HG23 ' A' ' 60' ' ' VAL . 35.6 t90 -64.65 -57.22 9.65 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.51 177.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.447 HD11 ' CG ' ' A' ' 28' ' ' PHE . 41.4 mt -49.02 -46.32 43.91 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.932 0.893 . . . . 0.0 112.138 -177.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 13' ' ' SER . 98.1 t -61.2 -26.21 38.58 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.208 0 CA-C-O 121.208 0.528 . . . . 0.0 111.114 -179.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.95 -24.84 73.04 Favored Glycine 0 N--CA 1.438 -1.198 0 C-N-CA 121.32 -0.467 . . . . 0.0 112.491 -177.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.516 HD13 ' CB ' ' A' ' 63' ' ' LYS . 0.7 OUTLIER -114.49 21.97 14.08 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -179.06 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.1 m 71.49 17.5 5.69 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.756 0.789 . . . . 0.0 111.266 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.468 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.3 mm? -100.54 15.12 29.05 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.311 -177.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.453 ' HA ' HG23 ' A' ' 25' ' ' VAL . 7.2 p-10 -56.02 -19.6 13.34 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 121.253 0.549 . . . . 0.0 111.6 174.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -68.38 -23.72 64.7 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 124.125 0.97 . . . . 0.0 111.112 176.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -86.86 -19.81 28.38 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.592 -179.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.453 HG23 ' HA ' ' A' ' 22' ' ' ASP . 88.7 t -52.21 -39.24 26.76 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 C-N-CA 123.117 0.567 . . . . 0.0 111.654 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.1 m -51.25 -37.63 48.18 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.085 0.954 . . . . 0.0 112.166 -178.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 14.9 tp10 -103.28 -31.73 9.93 Favored 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.112 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.447 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.3 m-85 -54.49 -45.33 73.23 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 121.198 0.523 . . . . 0.0 111.618 178.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 35.2 m -76.32 -16.88 59.67 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.71 -178.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -79.69 -35.04 39.68 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.699 -178.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -90.87 2.56 56.05 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 119.844 -0.742 . . . . 0.0 110.04 -177.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.518 HD22 ' N ' ' A' ' 32' ' ' ASN . 0.6 OUTLIER 67.0 32.84 6.08 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.105 178.896 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.3 mm -64.39 118.73 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.051 -178.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.505 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 93.3 p -107.07 -172.35 2.06 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 176.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.572 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -64.43 -22.77 67.9 Favored Glycine 0 N--CA 1.439 -1.164 0 N-CA-C 111.184 -0.767 . . . . 0.0 111.184 179.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -59.5 -45.78 90.7 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 123.219 0.608 . . . . 0.0 109.366 176.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.435 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -88.48 -17.05 31.17 Favored 'General case' 0 CA--C 1.494 -1.21 0 C-N-CA 120.413 -0.515 . . . . 0.0 111.47 -178.447 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.453 HD12 HG23 ' A' ' 12' ' ' VAL . 2.1 tt -69.51 -49.59 53.17 Favored 'General case' 0 C--N 1.308 -1.198 0 O-C-N 124.367 1.042 . . . . 0.0 108.802 -179.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.9 mt -59.6 -42.54 92.8 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.551 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -94.57 25.84 3.77 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -178.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.499 ' CB ' HD22 ' A' ' 64' ' ' LEU . 28.2 mt -65.74 161.4 20.85 Favored 'General case' 0 C--O 1.247 0.924 0 CA-C-O 121.173 0.511 . . . . 0.0 111.869 175.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -167.94 176.73 6.03 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.79 -39.09 93.32 Favored Glycine 0 CA--C 1.497 -1.07 0 CA-C-O 119.608 -0.551 . . . . 0.0 112.193 -178.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -51.12 -48.18 61.81 Favored 'General case' 0 CA--C 1.506 -0.731 0 C-N-CA 123.331 0.652 . . . . 0.0 110.667 178.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.423 ' HD3' HD23 ' A' ' 41' ' ' LEU . 11.2 mtpp -67.65 -44.88 76.85 Favored 'General case' 0 C--O 1.197 -1.67 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.297 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 91.3 mt -59.46 -28.84 67.35 Favored 'General case' 0 C--O 1.255 1.343 0 CA-C-O 121.488 0.661 . . . . 0.0 111.734 -179.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.685 ' HA ' HG22 ' A' ' 52' ' ' THR . 22.2 mtpp -76.77 -33.07 58.08 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.906 176.593 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.03 -12.78 60.02 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.685 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.523 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.5 mm? -78.56 -2.16 37.46 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.347 0.594 . . . . 0.0 109.421 173.11 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.07 -0.72 37.03 Favored Glycine 0 C--O 1.216 -1.017 0 CA-C-N 115.832 -0.622 . . . . 0.0 113.185 176.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 24.6 mmt -85.33 -53.72 5.04 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 120.721 0.296 . . . . 0.0 111.365 -177.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.685 HG22 ' HA ' ' A' ' 47' ' ' LYS . 20.0 p 56.11 25.22 8.75 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.584 1.154 . . . . 0.0 112.547 174.1 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 47.4 t -68.28 127.66 33.74 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 123.289 0.636 . . . . 0.0 111.158 -174.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.6 m -58.01 -44.33 87.21 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -175.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -58.94 -55.34 36.44 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.969 0.89 . . . . 0.0 109.658 178.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.733 ' O ' HG12 ' A' ' 60' ' ' VAL . 48.5 m-20 -62.33 -38.58 90.03 Favored 'General case' 0 N--CA 1.42 -1.967 0 CA-C-N 113.838 -1.528 . . . . 0.0 111.245 -173.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 46.9 mmm-85 -56.53 -15.7 4.74 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 176.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -108.57 -39.29 5.44 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-O 121.042 0.449 . . . . 0.0 110.169 175.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 47.6 tp -73.68 -54.93 6.97 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -173.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.733 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.0 p -64.64 -25.13 37.12 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.02 0 CA-C-O 121.352 0.596 . . . . 0.0 110.195 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.489 ' HD2' HD21 ' A' ' 64' ' ' LEU . 19.1 mmmt -70.91 -23.75 62.33 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.662 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.503 ' O ' ' HG2' ' A' ' 65' ' ' LYS . 22.5 ttmm -87.39 -40.88 14.02 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 114.656 -1.156 . . . . 0.0 108.964 178.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.516 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -72.6 -34.11 67.16 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-N 115.344 -0.844 . . . . 0.0 112.699 -178.344 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.499 HD22 ' CB ' ' A' ' 41' ' ' LEU . 3.2 pp -72.34 -24.56 61.31 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.003 0.43 . . . . 0.0 111.352 -177.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 21.5 ptmt -83.98 -9.33 58.76 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 120.465 -0.494 . . . . 0.0 111.339 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 . . . . . 0 C--N 1.321 -0.668 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 178.611 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.52 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.5 m . . . . . 0 N--CA 1.479 0.991 0 N-CA-C 113.842 1.052 . . . . 0.0 113.842 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 15.6 p-80 -70.77 -8.47 52.55 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-O 121.175 0.512 . . . . 0.0 111.223 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -99.75 -8.02 24.78 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.631 0.772 . . . . 0.0 109.862 177.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.521 ' O ' ' HB2' ' A' ' 34' ' ' SER . 50.1 m0 -74.53 133.01 42.32 Favored 'General case' 0 CA--C 1.489 -1.373 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -178.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.41 ' O ' ' HB3' ' A' ' 34' ' ' SER . 3.3 m -91.3 -75.51 0.47 Allowed 'General case' 0 N--CA 1.428 -1.56 0 CA-C-O 121.317 0.579 . . . . 0.0 110.156 -175.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.474 ' O ' HG12 ' A' ' 12' ' ' VAL . 97.9 t -140.83 -63.83 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.2 -1.535 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 179.129 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -62.88 -18.79 63.46 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.98 -177.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.459 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 47.0 mt-30 -82.13 -20.97 36.92 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.142 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.509 HG23 HD12 ' A' ' 38' ' ' LEU . 1.3 p -76.49 -26.42 16.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 CA-C-O 122.114 0.959 . . . . 0.0 108.652 -178.119 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.426 ' HA ' HD12 ' A' ' 16' ' ' LEU . 2.5 m -66.05 -33.41 75.73 Favored 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 114.479 -1.237 . . . . 0.0 112.342 -176.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . 0.459 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 44.6 m-70 -59.35 -37.67 78.45 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.666 0.746 . . . . 0.0 109.028 -178.013 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.543 ' O ' HD23 ' A' ' 19' ' ' LEU . 42.3 t90 -67.67 -58.89 3.87 Favored 'General case' 0 N--CA 1.424 -1.766 0 CA-C-N 114.374 -1.285 . . . . 0.0 109.983 176.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.448 HD11 ' CD2' ' A' ' 28' ' ' PHE . 46.8 mt -47.99 -49.83 29.49 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 124.181 0.992 . . . . 0.0 111.945 -178.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 94.5 t -67.21 -18.09 23.59 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.225 -178.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -86.79 -33.13 13.25 Favored Glycine 0 N--CA 1.438 -1.213 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 -176.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.543 HD23 ' O ' ' A' ' 15' ' ' TRP . 1.8 pt? -95.09 12.19 29.48 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.207 178.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.7 m 66.06 40.58 3.93 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 122.295 1.045 . . . . 0.0 110.29 -178.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.434 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.7 mm? -119.63 20.04 12.44 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 113.947 -1.479 . . . . 0.0 109.36 177.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.466 ' HA ' HG12 ' A' ' 25' ' ' VAL . 4.6 p-10 -55.57 -14.74 2.26 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-O 121.57 0.7 . . . . 0.0 112.139 174.189 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -65.97 -26.13 67.42 Favored 'General case' 0 C--N 1.293 -1.879 0 C-N-CA 123.978 0.911 . . . . 0.0 110.343 174.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.589 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 6.8 m-85 -89.77 -25.13 21.28 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -177.534 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.556 ' HA ' ' HB2' ' A' ' 28' ' ' PHE 0.325 1.4 p -59.64 -26.6 35.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 178.81 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.2 m -59.15 -27.88 66.06 Favored 'General case' 0 CA--C 1.562 1.439 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.887 177.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 16.0 tp10 -112.02 -33.31 6.31 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 179.305 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.556 ' HB2' ' HA ' ' A' ' 25' ' ' VAL . 3.5 m-85 -54.39 -40.96 68.7 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 121.011 0.434 . . . . 0.0 110.407 175.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.1 t -72.37 -22.91 61.07 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.252 -178.441 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -80.03 -37.56 33.79 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.611 -177.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -94.88 4.83 53.36 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 119.844 -0.743 . . . . 0.0 111.291 -178.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 61.1 39.13 16.49 Favored 'General case' 0 C--N 1.351 0.65 0 C-N-CA 123.148 0.579 . . . . 0.0 109.586 179.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.2 mm -66.37 110.02 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.049 0 CA-C-N 115.304 -0.862 . . . . 0.0 108.698 -179.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.521 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 78.5 p -105.76 -169.68 1.62 Allowed 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.52 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -58.73 -31.83 68.41 Favored Glycine 0 N--CA 1.445 -0.716 0 O-C-N 123.575 0.547 . . . . 0.0 112.102 -179.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -53.49 -50.12 66.05 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 123.678 0.791 . . . . 0.0 110.075 176.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.533 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -86.79 -17.3 33.85 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.229 -177.799 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.509 HD12 HG23 ' A' ' 12' ' ' VAL . 2.1 tt -70.51 -51.38 29.29 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.924 0.89 . . . . 0.0 109.171 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 47.1 mt -61.01 -36.05 78.47 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-O 121.341 0.591 . . . . 0.0 112.419 -176.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.42 HE21 ' HA ' ' A' ' 37' ' ' GLN . 5.0 pp0? -102.76 17.63 23.38 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.05 -177.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 37' ' ' GLN . 21.4 mt -54.6 154.94 4.42 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 121.789 0.804 . . . . 0.0 112.203 176.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -161.89 168.24 23.32 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 -175.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.15 -38.05 65.88 Favored Glycine 0 C--O 1.209 -1.41 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 177.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -51.48 -48.48 62.85 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 122.674 0.389 . . . . 0.0 111.093 176.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.3 mtpp -70.06 -45.31 67.35 Favored 'General case' 0 C--O 1.193 -1.915 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.89 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 94.3 mt -56.61 -38.04 71.5 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-O 121.825 0.821 . . . . 0.0 110.751 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.785 ' HA ' HG22 ' A' ' 52' ' ' THR . 24.5 mtpp -69.73 -36.58 75.98 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.161 177.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.85 -10.68 59.73 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 123.223 0.609 . . . . 0.0 111.378 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.521 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.2 mm? -84.55 -1.94 56.61 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.522 0.677 . . . . 0.0 109.286 173.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 70.62 7.11 60.59 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.761 -0.654 . . . . 0.0 114.284 174.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.589 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 40.3 tpp -90.29 -53.93 4.24 Favored 'General case' 0 C--N 1.311 -1.078 0 C-N-CA 119.07 -1.052 . . . . 0.0 109.3 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.785 HG22 ' HA ' ' A' ' 47' ' ' LYS . 63.7 p 54.9 33.25 19.57 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 124.586 1.154 . . . . 0.0 112.714 172.118 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.524 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 60.5 m -70.66 -174.68 0.93 Allowed 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 123.473 0.709 . . . . 0.0 112.909 -178.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.1 p -102.01 -41.18 6.54 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -60.8 -45.36 94.72 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.498 0.666 . . . . 0.0 111.036 -177.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.637 ' O ' HG12 ' A' ' 60' ' ' VAL . 11.5 p-10 -66.01 -45.21 82.37 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.89 -172.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 56.6 mmm-85 -56.33 -18.59 11.28 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 123.332 0.653 . . . . 0.0 111.954 -176.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -104.15 -44.26 5.03 Favored 'General case' 0 N--CA 1.419 -1.994 0 CA-C-O 121.048 0.451 . . . . 0.0 110.213 174.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 23.4 tp -76.84 -55.99 5.0 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -172.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.637 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.6 p -65.51 -22.04 30.24 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.779 0 CA-C-O 121.419 0.628 . . . . 0.0 109.37 -178.483 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -68.92 -31.21 69.94 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 114.254 -1.339 . . . . 0.0 108.8 -177.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -86.41 -42.14 13.88 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.425 -1.261 . . . . 0.0 109.39 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.505 ' HE3' ' HB2' ' A' ' 19' ' ' LEU . 0.9 OUTLIER -65.29 -40.84 94.37 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.213 -176.785 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.464 HD22 ' CB ' ' A' ' 41' ' ' LEU . 3.6 pp -64.1 -32.36 73.89 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.163 -177.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -80.81 -18.88 46.04 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.287 -0.565 . . . . 0.0 111.999 -178.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 . . . . . 0 C--N 1.318 -0.775 0 O-C-N 122.474 -0.141 . . . . 0.0 111.082 -179.252 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.526 HG12 ' CH2' ' A' ' 7' ' ' TRP . 3.6 m . . . . . 0 N--CA 1.468 0.43 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.2 p-80 -70.54 -7.27 42.52 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-O 121.498 0.666 . . . . 0.0 110.783 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -99.61 -9.41 23.23 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 124.268 1.027 . . . . 0.0 110.298 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.551 ' HA ' ' NE2' ' A' ' 11' ' ' GLN . 54.4 m0 -76.03 142.35 41.85 Favored 'General case' 0 CA--C 1.504 -0.794 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.307 -175.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.9 m -94.81 -79.42 0.43 Allowed 'General case' 0 N--CA 1.418 -2.039 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.862 -178.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.506 ' O ' HG12 ' A' ' 12' ' ' VAL . 94.9 t -141.77 -59.66 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -179.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.6 pm0 -60.46 -26.45 66.78 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.03 -0.987 . . . . 0.0 111.437 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.559 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 23.8 mt-30 -81.31 -16.99 50.8 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 115.01 -0.995 . . . . 0.0 112.356 -175.425 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.506 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.7 p -79.91 -20.17 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 121.894 0.854 . . . . 0.0 109.073 -179.379 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.44 ' HA ' HD12 ' A' ' 16' ' ' LEU . 2.5 m -77.15 -23.51 51.64 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.461 -174.306 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . 0.559 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 97.6 m-70 -60.63 -41.01 94.01 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.497 ' O ' HD23 ' A' ' 19' ' ' LEU . 31.3 t90 -61.99 -60.03 4.22 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 114.649 -1.16 . . . . 0.0 110.163 177.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.459 HD11 ' CG ' ' A' ' 28' ' ' PHE . 43.3 mt -47.97 -47.61 32.72 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.262 1.025 . . . . 0.0 112.441 -177.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 89.4 t -64.43 -22.55 31.46 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.168 0 CA-C-O 121.257 0.551 . . . . 0.0 111.018 -179.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.11 -29.84 61.95 Favored Glycine 0 N--CA 1.442 -0.913 0 CA-C-N 116.23 -0.441 . . . . 0.0 112.105 -179.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.523 HD13 ' CB ' ' A' ' 63' ' ' LYS . 0.6 OUTLIER -108.69 17.67 21.66 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -178.821 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.2 m 68.17 25.28 7.36 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 121.845 0.831 . . . . 0.0 111.169 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.473 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.1 mm? -103.62 16.29 26.79 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 124.247 1.019 . . . . 0.0 109.383 178.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -51.5 -26.51 8.52 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.078 0.951 . . . . 0.0 111.606 175.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -64.38 -23.52 67.32 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 124.066 0.946 . . . . 0.0 111.129 178.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.447 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 2.0 m-85 -85.89 -19.01 31.19 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.34 -178.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 95.7 t -53.64 -38.56 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.863 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.9 t -50.01 -39.23 40.69 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.774 0.829 . . . . 0.0 111.734 -179.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 12.3 tp10 -104.22 -30.53 10.12 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 120.978 -0.289 . . . . 0.0 110.829 -178.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.459 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.7 m-85 -56.18 -39.22 72.05 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 121.48 0.657 . . . . 0.0 110.238 176.656 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.8 t -76.05 -30.16 58.31 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.403 179.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.76 -45.18 72.06 Favored 'General case' 0 CA--C 1.504 -0.817 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.01 -176.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.439 ' HG3' HG12 ' A' ' 33' ' ' ILE . 4.3 pt20 -94.7 13.94 22.78 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 -178.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 57.57 39.91 27.32 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.857 0.863 . . . . 0.0 111.837 174.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.439 HG12 ' HG3' ' A' ' 31' ' ' GLN . 49.9 mm -68.84 115.47 7.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -179.526 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.475 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 89.6 p -108.7 -170.21 1.63 Allowed 'General case' 0 N--CA 1.423 -1.789 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 178.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.481 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -60.04 -32.72 76.51 Favored Glycine 0 CA--C 1.507 -0.406 0 N-CA-C 111.379 -0.688 . . . . 0.0 111.379 -179.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -50.28 -45.27 54.32 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 125.146 1.378 . . . . 0.0 110.387 176.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.471 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -96.79 -14.8 21.69 Favored 'General case' 0 C--O 1.214 -0.765 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 179.778 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.457 HD12 HG23 ' A' ' 12' ' ' VAL . 2.6 tt -69.03 -53.06 22.47 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 -179.226 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 36.3 mt -60.3 -36.23 77.4 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.949 -176.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -97.36 10.51 39.45 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 113.755 1.021 . . . . 0.0 113.755 -175.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.721 ' HB2' HD22 ' A' ' 64' ' ' LEU . 41.0 mt -54.51 136.14 45.01 Favored 'General case' 0 C--O 1.243 0.745 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 179.28 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.408 ' OD1' ' HG3' ' A' ' 45' ' ' LYS . 4.0 p-10 -134.78 -177.77 4.77 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 177.148 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.18 -41.99 95.05 Favored Glycine 0 C--O 1.211 -1.338 0 CA-C-O 119.169 -0.795 . . . . 0.0 113.412 -178.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -62.52 -37.43 86.0 Favored 'General case' 0 CA--C 1.475 -1.932 0 CA-C-N 117.654 0.727 . . . . 0.0 112.442 -177.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HG3' ' OD1' ' A' ' 42' ' ' ASP . 8.5 mtpp -63.48 -49.6 72.97 Favored 'General case' 0 C--N 1.299 -1.6 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.791 175.232 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.6 mt -60.99 -22.58 64.64 Favored 'General case' 0 C--O 1.261 1.694 0 CA-C-O 121.328 0.585 . . . . 0.0 111.725 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.734 ' HA ' HG22 ' A' ' 52' ' ' THR . 62.2 mtpt -82.98 -41.67 18.48 Favored 'General case' 0 N--CA 1.433 -1.304 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.966 176.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.37 -11.23 60.79 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.554 0.693 . . . . 0.0 110.795 177.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.47 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 3.7 mm? -77.01 -3.28 38.24 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 172.37 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.14 1.85 51.0 Favored Glycine 0 CA--C 1.506 -0.506 0 CA-C-N 116.226 -0.443 . . . . 0.0 113.591 175.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.447 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 15.7 tpt -91.89 -50.89 5.48 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.367 -177.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.734 HG22 ' HA ' ' A' ' 47' ' ' LYS . 68.6 p 53.51 20.17 1.98 Allowed 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 124.959 1.304 . . . . 0.0 113.736 176.161 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 42.4 t -68.78 130.19 42.09 Favored 'General case' 0 C--N 1.31 -1.122 0 C-N-CA 123.057 0.543 . . . . 0.0 111.472 -172.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 31.7 t -56.38 -47.57 78.65 Favored 'General case' 0 C--O 1.247 0.931 0 C-N-CA 124.633 1.173 . . . . 0.0 111.631 -175.497 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 -53.88 -58.2 8.12 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-O 122.165 0.984 . . . . 0.0 110.471 177.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.72 ' O ' HG12 ' A' ' 60' ' ' VAL . 7.7 m-20 -63.15 -40.85 98.76 Favored 'General case' 0 N--CA 1.422 -1.869 0 CA-C-N 113.451 -1.704 . . . . 0.0 110.592 -171.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -54.06 -26.3 26.08 Favored 'General case' 0 C--O 1.218 -0.571 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 178.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -104.79 -14.92 15.37 Favored 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 121.134 -0.226 . . . . 0.0 111.504 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.405 HD13 ' C ' ' A' ' 59' ' ' LEU . 3.4 tm? -96.57 -59.01 1.91 Allowed 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 -175.12 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.72 HG12 ' O ' ' A' ' 56' ' ' ASP . 4.8 p -57.41 -26.77 27.17 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.553 0 CA-C-O 120.805 0.336 . . . . 0.0 110.865 -177.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.689 ' HD2' HD21 ' A' ' 64' ' ' LEU . 24.7 mmmt -62.12 -30.53 71.09 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.84 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.459 ' HA ' ' HE2' ' A' ' 65' ' ' LYS . 37.9 ttmt -79.25 -44.69 21.25 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 121.952 0.882 . . . . 0.0 109.114 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.523 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -70.54 -31.74 68.92 Favored 'General case' 0 C--N 1.295 -1.795 0 CA-C-N 114.01 -1.45 . . . . 0.0 112.404 -174.356 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.721 HD22 ' HB2' ' A' ' 41' ' ' LEU . 3.9 pp -75.05 -32.15 61.47 Favored 'General case' 0 N--CA 1.437 -1.107 0 N-CA-C 112.0 0.371 . . . . 0.0 112.0 179.507 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.459 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 64.2 pttt -80.07 -29.2 39.13 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 119.491 -0.884 . . . . 0.0 111.022 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.488 ' HG2' ' HA ' ' A' ' 63' ' ' LYS . 12.1 pt-20 . . . . . 0 C--O 1.242 0.677 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 178.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.561 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.4 m . . . . . 0 CA--C 1.511 -0.532 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 22.8 p-80 -73.38 -6.77 48.36 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 121.044 0.45 . . . . 0.0 110.606 178.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -105.25 -2.22 24.33 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.611 178.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.5 ' HA ' ' NE2' ' A' ' 11' ' ' GLN . 53.5 m0 -78.74 142.12 37.29 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.337 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.9 m -96.41 -81.92 0.41 Allowed 'General case' 0 N--CA 1.415 -2.222 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.98 -177.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.556 ' O ' HG12 ' A' ' 12' ' ' VAL . 87.2 t -139.71 -58.62 0.31 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.951 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 -178.426 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.4 pm0 -63.07 -29.47 70.84 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.523 0.678 . . . . 0.0 111.356 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.5 ' NE2' ' HA ' ' A' ' 7' ' ' TRP . 20.4 mt-30 -75.66 -15.63 60.29 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.802 -176.712 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.556 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.9 p -80.73 -18.32 12.06 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-O 121.285 0.564 . . . . 0.0 109.789 -179.423 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.437 ' O ' HG23 ' A' ' 17' ' ' VAL . 86.1 p -73.6 -39.27 64.72 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.448 -174.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -50.69 -41.07 55.49 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 114.831 -1.077 . . . . 0.0 110.842 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.477 ' O ' HD23 ' A' ' 19' ' ' LEU . 28.6 t90 -65.52 -58.81 4.9 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.988 176.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 40.4 mt -48.66 -48.28 39.99 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.963 0.905 . . . . 0.0 112.189 -178.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 13' ' ' SER . 60.6 t -65.68 -16.34 20.26 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.393 0 CA-C-O 121.069 0.462 . . . . 0.0 111.162 -178.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -85.81 -21.26 53.86 Favored Glycine 0 N--CA 1.444 -0.807 0 N-CA-C 112.336 -0.306 . . . . 0.0 112.336 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.485 ' HB2' ' HE3' ' A' ' 63' ' ' LYS . 1.3 pt? -112.45 21.66 15.46 Favored 'General case' 0 C--O 1.213 -0.839 0 O-C-N 122.154 -0.615 . . . . 0.0 111.572 177.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.4 m 68.82 22.26 7.33 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.613 0.765 . . . . 0.0 111.747 -179.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -103.11 17.74 23.36 Favored 'General case' 0 C--N 1.3 -1.564 0 C-N-CA 123.905 0.882 . . . . 0.0 110.55 -178.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -54.68 -26.82 35.92 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.468 0.707 . . . . 0.0 111.312 176.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -64.88 -21.66 66.85 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 124.599 1.16 . . . . 0.0 111.327 177.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.476 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 3.2 m-85 -89.65 -20.63 23.44 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.784 -179.097 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.1 t -55.73 -38.15 49.78 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 O-C-N 123.321 0.388 . . . . 0.0 111.532 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.4 m -51.12 -41.09 59.83 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.812 0.845 . . . . 0.0 111.282 -178.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.581 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 16.1 tp10 -99.31 -34.58 10.26 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.267 -177.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -54.21 -48.19 71.31 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-O 121.297 0.57 . . . . 0.0 110.919 178.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 45.8 m -77.81 -11.23 59.86 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.516 -178.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.22 -29.63 26.38 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.878 0.371 . . . . 0.0 110.401 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.74 2.45 47.02 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 120.132 -0.627 . . . . 0.0 109.871 178.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 65.53 32.44 9.38 Favored 'General case' 0 CA--C 1.514 -0.439 0 C-N-CA 123.981 0.912 . . . . 0.0 110.826 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.401 ' HA ' ' HG3' ' A' ' 37' ' ' GLN . 47.9 mm -62.63 113.13 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 O-C-N 123.643 0.589 . . . . 0.0 109.628 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 71.1 p -100.09 -172.09 2.16 Favored 'General case' 0 N--CA 1.423 -1.822 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.561 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -65.17 -23.05 69.54 Favored Glycine 0 N--CA 1.439 -1.159 0 N-CA-C 111.513 -0.635 . . . . 0.0 111.513 178.331 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -62.45 -40.44 96.62 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 123.641 0.776 . . . . 0.0 109.917 179.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.475 ' HA ' HE21 ' A' ' 40' ' ' GLN . 0.0 OUTLIER -93.04 -17.37 23.94 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.909 179.743 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.523 HD12 HG23 ' A' ' 12' ' ' VAL . 3.2 tt -69.0 -51.48 38.84 Favored 'General case' 0 C--N 1.314 -0.96 0 C-N-CA 124.593 1.157 . . . . 0.0 109.217 179.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 63.5 mt -58.63 -38.91 79.07 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.369 0.604 . . . . 0.0 111.776 -178.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.475 HE21 ' HA ' ' A' ' 37' ' ' GLN . 4.9 pp0? -97.77 13.73 29.4 Favored 'General case' 0 C--N 1.299 -1.611 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.715 -176.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.546 ' HB2' HD22 ' A' ' 64' ' ' LEU . 31.4 mt -54.22 139.22 36.56 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.801 0.81 . . . . 0.0 112.271 177.443 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -139.39 170.62 15.59 Favored 'General case' 0 C--N 1.284 -2.264 0 N-CA-C 106.296 -1.742 . . . . 0.0 106.296 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -53.3 -37.56 55.41 Favored Glycine 0 C--O 1.211 -1.324 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 177.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -49.56 -49.87 44.59 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.834 0.853 . . . . 0.0 110.352 178.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.433 ' HE3' ' HB3' ' A' ' 45' ' ' LYS . 13.3 mtpp -71.31 -44.04 65.92 Favored 'General case' 0 N--CA 1.421 -1.879 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.624 -177.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 88.2 mt -60.17 -28.38 67.89 Favored 'General case' 0 C--O 1.255 1.387 0 CA-C-O 121.49 0.662 . . . . 0.0 111.121 -179.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.784 ' HA ' HG22 ' A' ' 52' ' ' THR . 54.3 mtpt -78.92 -33.13 45.72 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 115.151 -0.932 . . . . 0.0 109.952 176.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.98 -4.89 46.35 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 123.127 0.571 . . . . 0.0 111.574 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.581 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.4 mm? -87.53 -2.15 58.42 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 173.17 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.06 -9.76 6.46 Favored Glycine 0 C--O 1.222 -0.602 0 CA-C-N 115.713 -0.676 . . . . 0.0 114.128 175.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.782 ' SD ' ' HB2' ' A' ' 53' ' ' SER . 0.0 OUTLIER -79.49 -50.36 10.88 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -176.336 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.784 HG22 ' HA ' ' A' ' 47' ' ' LYS . 70.1 p 53.21 27.44 6.0 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.833 1.253 . . . . 0.0 113.103 175.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.782 ' HB2' ' SD ' ' A' ' 51' ' ' MET . 40.0 t -65.7 123.55 20.02 Favored 'General case' 0 C--N 1.313 -1.015 0 C-N-CA 123.532 0.733 . . . . 0.0 111.944 -174.6 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.1 m -54.6 -41.72 70.27 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.958 0.903 . . . . 0.0 113.198 -177.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -61.07 -55.83 28.09 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.982 0.896 . . . . 0.0 109.557 176.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.727 ' O ' HG12 ' A' ' 60' ' ' VAL . 67.0 m-20 -62.61 -40.55 97.31 Favored 'General case' 0 N--CA 1.427 -1.577 0 CA-C-N 113.593 -1.64 . . . . 0.0 111.135 -171.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.1 mmm180 -53.79 -22.39 9.38 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 124.058 0.943 . . . . 0.0 113.045 177.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -106.8 -26.2 11.37 Favored 'General case' 0 N--CA 1.444 -0.752 0 O-C-N 123.138 0.274 . . . . 0.0 111.425 177.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 47.8 tp -86.42 -52.57 5.52 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -176.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.727 HG12 ' O ' ' A' ' 56' ' ' ASP . 6.5 p -62.77 -22.88 31.36 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.244 0 CA-C-O 121.414 0.625 . . . . 0.0 109.485 178.063 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.433 ' HA ' ' CD2' ' A' ' 64' ' ' LEU . 26.7 tptp -71.22 -27.53 63.56 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 114.422 -1.263 . . . . 0.0 108.797 -176.594 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -83.44 -46.78 12.11 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.909 -1.496 . . . . 0.0 108.995 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.485 ' HE3' ' HB2' ' A' ' 19' ' ' LEU . 0.9 OUTLIER -67.58 -40.01 84.84 Favored 'General case' 0 N--CA 1.426 -1.657 0 CA-C-N 114.143 -1.39 . . . . 0.0 110.933 -174.885 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.546 HD22 ' HB2' ' A' ' 41' ' ' LEU . 3.9 pp -64.05 -30.72 71.77 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.012 -176.279 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -87.29 -10.17 53.03 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 118.078 -1.449 . . . . 0.0 111.639 -178.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 . . . . . 0 C--N 1.309 -1.156 0 C-N-CA 120.364 -0.534 . . . . 0.0 109.605 178.692 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.521 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.4 m . . . . . 0 N--CA 1.468 0.443 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 18.0 p-80 -71.55 -12.85 61.58 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-O 121.292 0.568 . . . . 0.0 110.969 178.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -96.73 -12.6 23.53 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.994 178.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.407 ' CD2' ' HA ' ' A' ' 4' ' ' VAL . 51.0 m0 -66.45 141.03 58.06 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.171 -178.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.1 m -94.54 -80.06 0.41 Allowed 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.647 -178.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.546 ' O ' HG12 ' A' ' 12' ' ' VAL . 91.9 t -141.12 -60.43 0.22 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.143 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 -176.351 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.424 ' H ' ' CD ' ' A' ' 10' ' ' GLN . 4.1 pm0 -64.01 -23.29 67.28 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 115.186 -0.916 . . . . 0.0 112.265 -179.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.531 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 34.6 mt-30 -81.16 -18.26 46.94 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 179.375 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.546 HG12 ' O ' ' A' ' 9' ' ' VAL . 2.0 p -73.77 -24.34 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-O 121.63 0.728 . . . . 0.0 109.699 -179.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.453 ' O ' HG23 ' A' ' 17' ' ' VAL . 0.7 OUTLIER -70.8 -30.1 66.46 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.195 -176.214 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . 0.531 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 94.8 m-70 -58.09 -39.33 78.33 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-O 121.037 0.446 . . . . 0.0 110.039 -178.258 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.564 ' O ' HD23 ' A' ' 19' ' ' LEU . 35.4 t90 -65.17 -60.47 2.98 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.936 176.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.499 HD11 ' CG ' ' A' ' 28' ' ' PHE . 50.3 mt -48.59 -51.08 29.7 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.103 0.961 . . . . 0.0 112.441 -177.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 13' ' ' SER . 59.2 t -66.22 -20.78 27.78 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 CA-C-O 121.044 0.449 . . . . 0.0 110.572 -177.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -76.6 -30.33 56.53 Favored Glycine 0 N--CA 1.439 -1.158 0 N-CA-C 111.174 -0.77 . . . . 0.0 111.174 -177.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.564 HD23 ' O ' ' A' ' 15' ' ' TRP . 1.0 OUTLIER -102.11 14.11 32.87 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.995 -0.282 . . . . 0.0 110.579 177.197 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.9 m 65.03 37.82 6.57 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-O 121.591 0.71 . . . . 0.0 112.255 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.699 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -109.82 22.31 15.82 Favored 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 127.082 2.153 . . . . 0.0 107.889 176.61 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -53.24 -27.77 23.93 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.321 0.648 . . . . 0.0 112.621 177.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.699 ' NE2' ' HA ' ' A' ' 21' ' ' LEU . 3.5 pm0 -66.39 -18.38 65.32 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 175.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.42 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 2.5 m-85 -87.45 -21.53 25.49 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.225 178.381 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 90.8 t -57.48 -37.96 60.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 122.508 0.323 . . . . 0.0 110.705 179.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 7.2 m -49.66 -36.76 25.87 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 124.81 1.244 . . . . 0.0 111.929 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 19.8 tp10 -106.62 -34.06 7.45 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.507 -178.531 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.499 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.2 m-85 -53.02 -48.14 67.81 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 121.37 0.605 . . . . 0.0 110.811 177.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.4 m -76.83 -21.17 55.45 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.385 -177.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.69 -31.82 63.62 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.818 0.342 . . . . 0.0 111.273 -178.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.74 7.58 44.96 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 119.78 -0.768 . . . . 0.0 111.94 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 65.24 36.98 6.72 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.68 0.792 . . . . 0.0 110.695 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.49 HG23 ' HB2' ' A' ' 37' ' ' GLN . 45.0 mm -69.04 119.2 14.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 178.467 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 63.1 p -106.33 -172.31 2.06 Favored 'General case' 0 N--CA 1.419 -2.003 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 179.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.521 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -64.48 -22.96 68.17 Favored Glycine 0 N--CA 1.447 -0.592 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 177.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -60.08 -44.29 94.88 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 123.673 0.789 . . . . 0.0 109.791 177.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.49 ' HB2' HG23 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -83.96 -26.25 29.41 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 -177.703 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.434 ' HA ' ' HG ' ' A' ' 41' ' ' LEU . 3.1 tt -62.79 -50.64 70.2 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.007 1.323 . . . . 0.0 110.724 -174.428 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 38.6 mt -62.96 -31.47 72.58 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.161 -177.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -103.41 13.08 34.41 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-N 115.575 -0.738 . . . . 0.0 112.553 -177.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.434 ' HG ' ' HA ' ' A' ' 38' ' ' LEU . 48.7 mt -53.49 145.67 14.3 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 177.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.418 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 24.5 t70 -142.39 169.04 18.33 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 105.827 -1.916 . . . . 0.0 105.827 179.016 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.495 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -54.03 -36.32 55.97 Favored Glycine 0 CA--C 1.487 -1.705 0 N-CA-C 110.502 -1.039 . . . . 0.0 110.502 176.286 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.467 ' HA ' ' HD3' ' A' ' 47' ' ' LYS . 66.1 t30 -50.67 -51.25 50.99 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-O 121.748 0.785 . . . . 0.0 110.238 178.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.466 ' HE3' ' HB3' ' A' ' 45' ' ' LYS . 13.5 mtpp -68.27 -39.8 82.06 Favored 'General case' 0 C--O 1.198 -1.64 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.3 -177.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 81.6 mt -62.89 -24.7 67.95 Favored 'General case' 0 C--O 1.254 1.299 0 CA-C-O 121.452 0.644 . . . . 0.0 110.767 179.211 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.858 ' HA ' HG22 ' A' ' 52' ' ' THR . 6.8 mtpm? -80.11 -35.78 36.31 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.067 -0.97 . . . . 0.0 108.931 175.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.45 -9.24 58.29 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 123.63 0.772 . . . . 0.0 111.581 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.481 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 2.9 mm? -86.06 -4.49 59.18 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 172.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 69.71 -0.07 22.34 Favored Glycine 0 C--N 1.328 0.135 0 CA-C-N 116.088 -0.506 . . . . 0.0 114.11 176.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 0.6 OUTLIER -84.37 -43.6 14.57 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 179.212 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.858 HG22 ' HA ' ' A' ' 47' ' ' LYS . 72.0 p 50.39 21.09 0.77 Allowed 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 125.721 1.608 . . . . 0.0 114.406 172.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.405 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 30.1 t -73.04 121.92 20.94 Favored 'General case' 0 C--N 1.3 -1.565 0 C-N-CA 122.428 0.291 . . . . 0.0 111.331 -174.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.2 m -63.59 -28.74 70.14 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -178.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.93 -54.59 24.36 Favored 'General case' 0 CA--C 1.503 -0.839 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 176.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.605 ' O ' HG12 ' A' ' 60' ' ' VAL . 4.6 m-20 -61.13 -45.71 93.55 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.182 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.521 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 12.0 mtm180 -63.51 -17.4 62.73 Favored 'General case' 0 C--O 1.207 -1.152 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.7 -15.5 30.21 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 121.373 0.606 . . . . 0.0 110.332 177.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.531 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 39.3 tp -100.81 -49.06 4.27 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.181 -178.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.605 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.5 p -60.62 -25.81 35.98 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.767 0 CA-C-O 121.727 0.775 . . . . 0.0 109.998 179.16 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.521 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 56.8 tptt -71.85 -34.03 68.92 Favored 'General case' 0 C--N 1.295 -1.776 0 CA-C-N 114.246 -1.343 . . . . 0.0 109.701 -172.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 59' ' ' LEU . 21.0 ptmt -87.9 -31.86 19.24 Favored 'General case' 0 N--CA 1.418 -2.061 0 CA-C-N 114.78 -1.1 . . . . 0.0 108.306 -177.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.41 ' HG2' HD13 ' A' ' 19' ' ' LEU . 2.6 tppt? -70.98 -44.87 65.06 Favored 'General case' 0 N--CA 1.417 -2.09 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.854 -178.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.411 HD22 ' HB2' ' A' ' 41' ' ' LEU . 3.7 pp -59.15 -31.42 68.95 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.959 0.409 . . . . 0.0 111.858 -176.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -87.86 -5.04 58.79 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -177.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 . . . . . 0 C--N 1.312 -1.05 0 C-N-CA 120.268 -0.573 . . . . 0.0 109.685 174.324 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.525 HG12 ' CH2' ' A' ' 7' ' ' TRP . 10.9 m . . . . . 0 N--CA 1.469 0.52 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -69.37 -13.08 62.18 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-O 121.603 0.716 . . . . 0.0 110.75 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -88.95 -12.45 41.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.671 178.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.525 ' CH2' HG12 ' A' ' 4' ' ' VAL . 50.2 m0 -79.12 142.84 36.07 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 -179.525 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 13.1 m -99.83 -72.16 0.67 Allowed 'General case' 0 C--N 1.294 -1.819 0 O-C-N 123.657 0.598 . . . . 0.0 110.374 -178.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.534 ' O ' HG12 ' A' ' 12' ' ' VAL . 54.6 t -141.48 -65.76 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.209 -1.076 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 -179.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -62.4 -22.86 66.49 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -176.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.456 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 18.3 mt-30 -80.32 -18.47 49.09 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 176.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.534 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.4 p -75.25 -23.0 16.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 179.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.442 ' HA ' HD12 ' A' ' 16' ' ' LEU . 1.4 m -76.04 -27.56 57.36 Favored 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.246 -176.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . 0.456 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 84.4 m-70 -63.16 -34.82 78.45 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.475 ' O ' HD23 ' A' ' 19' ' ' LEU . 30.4 t90 -66.38 -62.21 1.59 Allowed 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.483 175.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.505 HD11 ' CG ' ' A' ' 28' ' ' PHE . 56.8 mt -44.83 -50.18 10.4 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.354 1.061 . . . . 0.0 112.946 -177.527 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 99.0 t -62.01 -27.73 42.99 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.277 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.688 -178.052 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.63 -35.44 74.39 Favored Glycine 0 N--CA 1.444 -0.831 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 -177.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.475 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -98.55 10.0 41.96 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 -179.305 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.3 m 75.59 19.47 2.06 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 124.206 1.002 . . . . 0.0 112.301 179.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.413 ' HG ' ' CD1' ' A' ' 19' ' ' LEU . 1.4 mm? -95.99 19.32 11.75 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.103 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -48.21 -33.56 8.73 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.231 1.412 . . . . 0.0 111.187 173.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -62.56 -22.05 66.05 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.77 -1.105 . . . . 0.0 111.124 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.51 ' HD2' HD13 ' A' ' 49' ' ' LEU . 13.4 m-85 -90.77 -20.24 22.59 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.877 -178.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 99.0 t -52.84 -37.62 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 C-N-CA 123.055 0.542 . . . . 0.0 111.855 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 29.7 t -57.58 -33.27 67.99 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 122.902 0.481 . . . . 0.0 111.923 -177.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.442 ' HG2' ' HA ' ' A' ' 49' ' ' LEU . 19.7 tp10 -106.91 -28.21 10.22 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 121.176 -0.21 . . . . 0.0 110.898 -179.376 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.505 ' CG ' HD11 ' A' ' 16' ' ' LEU . 2.1 m-85 -54.79 -38.76 67.68 Favored 'General case' 0 C--N 1.347 0.476 0 CA-C-O 121.829 0.823 . . . . 0.0 109.462 174.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 31.1 p -74.17 -27.56 60.89 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 114.841 -1.072 . . . . 0.0 111.887 -179.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.09 -31.95 64.68 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-O 121.166 0.508 . . . . 0.0 110.387 -175.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.481 HE21 HD23 ' A' ' 49' ' ' LEU . 5.6 mt-30 -95.16 -1.39 51.95 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 119.815 -0.754 . . . . 0.0 110.41 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 63.58 38.69 9.45 Favored 'General case' 0 CA--C 1.512 -0.486 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -179.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.517 HG23 ' HB2' ' A' ' 37' ' ' GLN . 44.7 mm -65.01 114.75 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.603 -179.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.4 p -97.34 -175.53 3.24 Favored 'General case' 0 N--CA 1.407 -2.584 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 176.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.49 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -65.25 -21.46 68.31 Favored Glycine 0 N--CA 1.433 -1.533 0 N-CA-C 111.563 -0.615 . . . . 0.0 111.563 178.126 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -65.49 -38.7 90.54 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.517 ' HB2' HG23 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -84.85 -28.39 26.07 Favored 'General case' 0 CA--C 1.507 -0.685 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 -179.227 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.526 HD12 HG23 ' A' ' 12' ' ' VAL . 2.6 tt -58.56 -51.05 71.54 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 125.196 1.398 . . . . 0.0 109.654 -178.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 21.7 mt -57.37 -37.94 73.43 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.366 -178.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -100.48 21.49 13.16 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -177.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.485 ' HB2' HD22 ' A' ' 64' ' ' LEU . 27.9 mt -62.37 139.02 58.55 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.116 0.484 . . . . 0.0 111.786 175.253 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.476 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 0.6 OUTLIER -138.95 178.05 7.44 Favored 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 177.656 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.59 -37.93 69.45 Favored Glycine 0 C--O 1.203 -1.815 0 CA-C-O 119.322 -0.71 . . . . 0.0 113.209 178.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -62.35 -41.67 98.77 Favored 'General case' 0 CA--C 1.482 -1.636 0 CA-C-N 117.747 0.774 . . . . 0.0 112.666 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.541 ' O ' ' HG ' ' A' ' 49' ' ' LEU . 16.5 mtpp -66.02 -40.6 91.2 Favored 'General case' 0 C--N 1.31 -1.141 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.087 175.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.766 ' HA ' HD12 ' A' ' 49' ' ' LEU . 87.5 mt -63.96 -34.16 77.35 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-O 121.773 0.797 . . . . 0.0 110.548 178.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.676 ' HA ' HG22 ' A' ' 52' ' ' THR . 43.1 mtpt -71.39 -37.1 71.58 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.242 176.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.11 3.74 16.65 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.455 0.645 . . . . 0.0 110.87 -179.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.766 HD12 ' HA ' ' A' ' 46' ' ' LEU . 72.4 mt -95.94 -0.84 50.26 Favored 'General case' 0 N--CA 1.428 -1.535 0 CA-C-O 121.663 0.744 . . . . 0.0 109.215 176.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 81.14 -23.26 4.63 Favored Glycine 0 CA--C 1.501 -0.79 0 CA-C-N 115.271 -0.877 . . . . 0.0 113.58 173.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 16.4 mmt -74.97 -55.4 5.8 Favored 'General case' 0 C--N 1.296 -1.742 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 -176.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.676 HG22 ' HA ' ' A' ' 47' ' ' LYS . 14.7 p 60.49 23.37 13.01 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.312 1.045 . . . . 0.0 110.922 174.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.8 m -68.38 126.11 28.58 Favored 'General case' 0 N--CA 1.421 -1.877 0 C-N-CA 124.531 1.133 . . . . 0.0 112.426 -173.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.9 m -58.98 -40.85 86.09 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.391 1.077 . . . . 0.0 113.398 -175.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -55.23 -57.87 10.01 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 122.817 1.294 . . . . 0.0 109.072 177.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.765 ' O ' HG12 ' A' ' 60' ' ' VAL . 9.8 m-20 -60.42 -42.53 96.18 Favored 'General case' 0 N--CA 1.415 -2.219 0 CA-C-N 112.462 -2.154 . . . . 0.0 110.961 -174.198 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.5 mmm-85 -52.35 -24.48 7.68 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 177.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -104.08 -36.56 7.67 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-O 120.97 0.414 . . . . 0.0 111.081 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.45 HD12 HD12 ' A' ' 19' ' ' LEU . 2.1 tm? -72.59 -60.67 2.12 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.301 -176.249 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.765 HG12 ' O ' ' A' ' 56' ' ' ASP . 8.2 p -60.63 -25.28 34.42 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.72 0 CA-C-O 121.837 0.827 . . . . 0.0 109.417 -176.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -71.02 -25.92 62.88 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.059 -175.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.435 ' HA ' ' HE3' ' A' ' 65' ' ' LYS . 58.3 tttm -85.14 -39.56 17.75 Favored 'General case' 0 N--CA 1.424 -1.769 0 CA-C-N 115.428 -0.806 . . . . 0.0 109.057 176.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.429 ' HG2' HD13 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -67.06 -40.76 87.13 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.408 -176.086 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.485 HD22 ' HB2' ' A' ' 41' ' ' LEU . 4.1 pp -66.36 -29.02 69.12 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.934 -177.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.435 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 22.4 pttp -88.24 -1.87 58.27 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 120.099 -0.64 . . . . 0.0 111.773 -179.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 . . . . . 0 C--N 1.313 -1.002 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 176.664 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.504 HG12 ' CH2' ' A' ' 7' ' ' TRP . 4.5 m . . . . . 0 C--O 1.221 -0.406 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 11.1 p-80 -68.34 -15.91 63.74 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.338 0.589 . . . . 0.0 110.895 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -86.48 -11.85 50.61 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.555 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.504 ' CH2' HG12 ' A' ' 4' ' ' VAL . 51.2 m0 -78.8 142.32 37.04 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-O 121.436 0.636 . . . . 0.0 111.132 -176.517 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.98 -80.66 0.33 Allowed 'General case' 0 N--CA 1.417 -2.1 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.104 -178.567 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.48 ' O ' HG12 ' A' ' 12' ' ' VAL . 59.5 t -143.27 -60.76 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.839 0 CA-C-N 113.82 -1.537 . . . . 0.0 108.882 -177.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.0 pm0 -74.12 -10.94 60.12 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.296 0.57 . . . . 0.0 112.091 -175.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -86.32 -17.46 34.5 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.72 176.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.48 HG12 ' O ' ' A' ' 9' ' ' VAL . 2.5 p -70.66 -24.12 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-O 122.125 0.964 . . . . 0.0 108.979 -178.565 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.489 ' HA ' HD12 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -70.06 -26.24 63.93 Favored 'General case' 0 N--CA 1.418 -2.064 0 CA-C-N 114.425 -1.261 . . . . 0.0 111.31 -176.733 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 29.3 m-70 -63.67 -39.36 94.14 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -177.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.495 ' O ' HD23 ' A' ' 19' ' ' LEU . 28.0 t90 -63.93 -55.83 19.67 Favored 'General case' 0 CA--C 1.511 -0.544 0 O-C-N 123.814 0.696 . . . . 0.0 109.743 176.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.489 HD12 ' HA ' ' A' ' 13' ' ' SER . 46.4 mt -48.11 -48.71 33.64 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.269 1.028 . . . . 0.0 112.458 -178.213 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 13' ' ' SER . 86.7 t -61.16 -27.08 41.01 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 C-N-CA 122.471 0.308 . . . . 0.0 111.381 -178.797 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.24 -28.73 65.56 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.735 -0.546 . . . . 0.0 111.735 -176.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.495 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.9 OUTLIER -106.34 17.95 22.68 Favored 'General case' 0 C--O 1.212 -0.87 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.336 179.114 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.5 t 65.91 29.88 10.12 Favored 'General case' 0 C--O 1.208 -1.111 0 CA-C-O 121.575 0.702 . . . . 0.0 110.55 179.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.41 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.7 mm? -107.71 18.79 20.97 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 123.552 0.741 . . . . 0.0 109.989 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -48.91 -32.09 8.39 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.921 0.889 . . . . 0.0 111.444 174.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -59.51 -20.67 57.13 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 124.686 1.195 . . . . 0.0 112.014 178.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -90.45 -19.9 23.35 Favored 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 179.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 92.6 t -53.13 -38.01 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 C-N-CA 122.798 0.439 . . . . 0.0 110.722 179.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.1 m -50.63 -29.38 10.86 Favored 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 125.706 1.602 . . . . 0.0 112.881 -179.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.581 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 18.3 tp10 -117.49 -30.47 5.52 Favored 'General case' 0 N--CA 1.432 -1.359 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.289 178.347 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.423 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.6 m-85 -54.61 -42.83 71.63 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-O 121.508 0.671 . . . . 0.0 110.938 177.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 45.8 m -84.36 -9.44 58.44 Favored 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.87 -178.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -83.07 -41.24 18.86 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.674 0.75 . . . . 0.0 110.059 179.606 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.478 ' HG3' HG12 ' A' ' 33' ' ' ILE . 3.7 pt20 -93.21 17.0 11.78 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 59.84 36.57 21.99 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.668 174.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.478 HG12 ' HG3' ' A' ' 31' ' ' GLN . 49.6 mm -70.35 118.19 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.087 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 -179.789 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 91.5 p -107.04 -167.74 1.31 Allowed 'General case' 0 N--CA 1.423 -1.797 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 176.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.486 ' O ' ' HG ' ' A' ' 39' ' ' LEU . . . -63.07 -28.43 72.1 Favored Glycine 0 N--CA 1.43 -1.737 0 N-CA-C 110.647 -0.981 . . . . 0.0 110.647 177.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -54.64 -46.34 73.93 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.538 0.735 . . . . 0.0 110.112 178.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.84 -19.98 23.99 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 120.27 -0.572 . . . . 0.0 112.271 -177.727 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.8 tt -63.94 -48.37 76.79 Favored 'General case' 0 C--N 1.316 -0.882 0 O-C-N 124.536 1.147 . . . . 0.0 108.53 177.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 35' ' ' GLY . 21.7 mt -63.68 -37.29 86.78 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.827 -178.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -100.9 20.88 14.59 Favored 'General case' 0 C--N 1.309 -1.161 0 N-CA-C 114.141 1.163 . . . . 0.0 114.141 -177.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.1 mt -54.79 153.53 5.98 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 176.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.501 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 14.3 t70 -159.8 161.93 34.68 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 -176.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.91 -34.32 61.42 Favored Glycine 0 CA--C 1.49 -1.504 0 O-C-N 123.569 0.543 . . . . 0.0 112.032 178.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -56.72 -43.94 81.13 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-O 121.031 0.443 . . . . 0.0 110.456 176.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.417 ' HE3' ' HB3' ' A' ' 45' ' ' LYS . 12.2 mtpp -68.79 -48.46 63.58 Favored 'General case' 0 C--O 1.193 -1.893 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.82 176.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 80.3 mt -54.99 -35.15 64.05 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-O 121.59 0.71 . . . . 0.0 111.451 -178.129 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.742 ' HA ' HG22 ' A' ' 52' ' ' THR . 22.6 mttm -75.57 -35.72 60.55 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.167 176.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.32 -12.72 60.93 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.144 0.578 . . . . 0.0 111.35 -179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.581 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.4 mm? -74.88 -8.71 57.28 Favored 'General case' 0 C--O 1.22 -0.5 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 172.003 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 71.35 1.29 42.35 Favored Glycine 0 C--O 1.225 -0.418 0 CA-C-N 115.935 -0.575 . . . . 0.0 112.543 178.05 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.586 ' HG3' ' OG ' ' A' ' 53' ' ' SER . 12.0 tpt -87.67 -49.36 7.2 Favored 'General case' 0 N--CA 1.433 -1.314 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -177.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.742 HG22 ' HA ' ' A' ' 47' ' ' LYS . 70.7 p 57.93 10.23 1.1 Allowed 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.783 1.633 . . . . 0.0 114.393 172.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.586 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 16.2 m -57.29 118.41 5.07 Favored 'General case' 0 C--N 1.31 -1.135 0 C-N-CA 124.807 1.243 . . . . 0.0 112.22 -175.107 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 p -63.69 -39.93 95.53 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 -172.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.444 HE21 ' CG ' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -71.25 -32.17 68.41 Favored 'General case' 0 CA--C 1.49 -1.336 0 CA-C-O 122.338 1.066 . . . . 0.0 108.904 -179.11 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.651 ' O ' HG12 ' A' ' 60' ' ' VAL . 17.7 m-20 -74.65 -40.85 61.22 Favored 'General case' 0 N--CA 1.413 -2.282 0 CA-C-N 113.137 -1.847 . . . . 0.0 109.369 -178.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.593 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 24.7 mmm-85 -51.43 -36.35 43.42 Favored 'General case' 0 C--O 1.2 -1.519 0 C-N-CA 124.3 1.04 . . . . 0.0 111.132 175.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.44 -35.67 27.33 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.035 0.445 . . . . 0.0 111.894 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 30.7 tp -80.23 -43.79 20.83 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 120.306 -0.558 . . . . 0.0 112.216 -174.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.651 HG12 ' O ' ' A' ' 56' ' ' ASP . 9.7 p -65.26 -26.1 38.82 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.737 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.593 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 55.0 tptt -70.36 -31.98 69.47 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 122.734 1.254 . . . . 0.0 108.896 -175.502 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -80.62 -44.75 18.38 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-N 113.118 -1.856 . . . . 0.0 109.026 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.46 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.3 OUTLIER -72.31 -35.68 68.71 Favored 'General case' 0 N--CA 1.423 -1.824 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.191 -176.776 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.7 pp -70.0 -13.74 62.37 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 -176.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -98.84 -5.12 31.65 Favored 'General case' 0 C--N 1.309 -1.167 0 C-N-CA 119.026 -1.069 . . . . 0.0 112.275 175.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 . . . . . 0 N--CA 1.478 0.933 0 CA-C-O 122.159 0.98 . . . . 0.0 109.381 -179.754 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.532 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.9 m . . . . . 0 C--O 1.215 -0.728 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.5 p-80 -72.41 -6.39 43.17 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 121.467 0.651 . . . . 0.0 110.941 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -103.08 -7.01 21.69 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.822 178.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.519 ' CH2' HG12 ' A' ' 4' ' ' VAL . 54.2 m0 -79.69 156.59 27.49 Favored 'General case' 0 CA--C 1.473 -1.996 0 CA-C-O 121.821 0.82 . . . . 0.0 111.607 -178.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.453 ' H ' ' HB2' ' A' ' 11' ' ' GLN . 7.8 m -111.91 -131.22 0.32 Allowed 'General case' 1 N--CA 1.37 -4.446 0 CA-C-N 113.578 -1.647 . . . . 0.0 106.866 177.037 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.569 ' O ' HG12 ' A' ' 12' ' ' VAL . 59.8 t -95.41 -52.4 9.52 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.991 0 C-N-CA 123.524 0.729 . . . . 0.0 110.628 -170.231 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.406 ' CD ' ' H ' ' A' ' 10' ' ' GLN . 4.7 pm0 -71.18 -19.77 62.37 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 122.36 1.076 . . . . 0.0 109.83 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.556 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 29.3 mt-30 -86.03 -19.4 30.36 Favored 'General case' 0 N--CA 1.413 -2.297 0 CA-C-N 114.158 -1.383 . . . . 0.0 111.787 -176.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.569 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.3 p -78.54 -20.98 13.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.778 0.799 . . . . 0.0 109.007 -179.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.5 ' HA ' HD12 ' A' ' 16' ' ' LEU . 1.8 m -74.94 -23.85 58.39 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.814 -176.125 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . 0.556 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 87.2 m-70 -61.34 -36.16 79.41 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-O 120.998 0.428 . . . . 0.0 110.44 -179.03 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.438 ' O ' HD23 ' A' ' 19' ' ' LEU . 31.3 t90 -68.09 -59.3 3.35 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.698 176.226 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.515 HD11 ' CD2' ' A' ' 28' ' ' PHE . 44.9 mt -46.49 -50.61 16.77 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.283 1.033 . . . . 0.0 112.326 -177.505 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 13' ' ' SER . 94.0 t -60.55 -26.09 36.6 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.174 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.308 -178.054 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -70.91 -34.35 65.55 Favored Glycine 0 N--CA 1.449 -0.492 0 CA-C-N 116.413 -0.358 . . . . 0.0 112.332 -178.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.466 ' HG ' ' HB2' ' A' ' 21' ' ' LEU . 0.5 OUTLIER -100.52 15.71 27.09 Favored 'General case' 0 C--N 1.317 -0.841 0 O-C-N 122.731 -0.276 . . . . 0.0 111.357 -179.565 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 43.4 m 70.21 18.34 6.94 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.413 1.085 . . . . 0.0 111.415 -179.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.466 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.6 mm? -94.25 18.81 10.31 Favored 'General case' 0 C--N 1.301 -1.537 0 C-N-CA 124.17 0.988 . . . . 0.0 109.422 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.446 ' HB3' HG22 ' A' ' 17' ' ' VAL . 1.1 p30 -51.64 -26.63 9.38 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.341 1.056 . . . . 0.0 111.212 172.513 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -62.51 -26.97 68.82 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 124.098 0.959 . . . . 0.0 111.344 177.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.422 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 1.8 m-85 -85.1 -19.85 31.25 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.627 -178.004 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 91.0 t -54.53 -33.35 26.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 122.842 0.457 . . . . 0.0 110.91 178.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 4.4 m -48.61 -39.62 24.58 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.201 1.4 . . . . 0.0 112.266 178.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.628 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 15.5 tp10 -108.59 -30.09 8.41 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.33 -177.328 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.515 ' CD2' HD11 ' A' ' 16' ' ' LEU . 2.7 m-85 -54.09 -36.89 63.67 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.356 0.598 . . . . 0.0 110.795 176.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.2 p -73.04 -32.28 64.98 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.359 178.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.08 -31.16 61.15 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.864 -174.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -96.82 0.93 50.09 Favored 'General case' 0 CA--C 1.509 -0.604 0 C-N-CA 119.931 -0.708 . . . . 0.0 110.246 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 62.66 40.1 10.61 Favored 'General case' 0 CA--C 1.509 -0.617 0 O-C-N 123.939 0.774 . . . . 0.0 109.988 179.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 43.7 mm -65.61 128.17 27.99 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.131 0 CA-C-N 115.12 -0.945 . . . . 0.0 108.57 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.437 ' H ' ' HG2' ' A' ' 37' ' ' GLN . 74.9 p -120.14 -168.85 1.69 Allowed 'General case' 0 N--CA 1.428 -1.528 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 174.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.532 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.09 -29.62 73.28 Favored Glycine 0 CA--C 1.502 -0.781 0 N-CA-C 111.881 -0.487 . . . . 0.0 111.881 -177.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -54.47 -47.74 72.6 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 123.252 0.621 . . . . 0.0 109.657 176.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.437 ' HG2' ' H ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -87.03 -19.89 27.99 Favored 'General case' 0 C--N 1.312 -1.062 0 C-N-CA 119.535 -0.866 . . . . 0.0 111.52 -177.752 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.405 ' HA ' ' HG ' ' A' ' 41' ' ' LEU . 2.7 tt -67.66 -51.16 53.14 Favored 'General case' 0 CA--C 1.548 0.884 0 O-C-N 124.192 0.932 . . . . 0.0 109.745 -178.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 50.8 mt -62.46 -34.57 77.08 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.473 0.654 . . . . 0.0 111.592 -177.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -101.9 24.92 9.27 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.589 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.478 ' HA ' ' HD3' ' A' ' 45' ' ' LYS . 32.6 mt -63.35 153.1 36.1 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.063 173.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -157.06 172.81 18.01 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 -177.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.426 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -58.8 -40.68 95.38 Favored Glycine 0 C--O 1.204 -1.73 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -51.35 -46.95 62.86 Favored 'General case' 0 CA--C 1.507 -0.705 0 C-N-CA 123.58 0.752 . . . . 0.0 111.539 176.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.48 ' O ' HD23 ' A' ' 49' ' ' LEU . 15.0 mtpp -67.02 -44.05 81.29 Favored 'General case' 0 C--O 1.193 -1.894 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.8 176.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 98.1 mt -59.55 -27.19 65.99 Favored 'General case' 0 C--O 1.256 1.423 0 CA-C-O 121.704 0.764 . . . . 0.0 111.646 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.654 ' HA ' HG22 ' A' ' 52' ' ' THR . 56.3 mtpt -83.98 -34.37 24.4 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.157 178.079 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.67 -12.67 60.24 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 121.79 0.805 . . . . 0.0 110.263 176.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.628 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 3.7 mm? -82.14 2.17 32.72 Favored 'General case' 0 C--O 1.211 -0.949 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.009 173.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 63.06 6.04 11.77 Favored Glycine 0 C--N 1.333 0.397 0 CA-C-N 115.7 -0.682 . . . . 0.0 114.446 175.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.422 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 6.5 tpt -88.15 -48.73 7.5 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 -177.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.654 HG22 ' HA ' ' A' ' 47' ' ' LYS . 81.7 p 53.99 21.26 2.8 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 125.471 1.509 . . . . 0.0 114.618 174.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.9 t -66.41 117.65 8.94 Favored 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 123.536 0.734 . . . . 0.0 110.032 -179.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.2 m -67.51 -26.78 66.51 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-O 121.005 0.431 . . . . 0.0 110.449 -177.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -58.14 -53.64 55.96 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 122.11 0.957 . . . . 0.0 108.522 173.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.621 ' O ' HG12 ' A' ' 60' ' ' VAL . 67.5 m-20 -71.23 -37.17 72.03 Favored 'General case' 0 N--CA 1.427 -1.596 0 CA-C-N 114.15 -1.386 . . . . 0.0 110.78 -176.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -52.76 -27.15 16.58 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.674 0.79 . . . . 0.0 112.768 177.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.34 -37.79 13.79 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.973 176.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -81.21 -64.4 1.2 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.434 -172.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.621 HG12 ' O ' ' A' ' 56' ' ' ASP . 3.4 p -58.9 -23.01 22.77 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.839 0 CA-C-O 121.431 0.634 . . . . 0.0 111.249 -175.268 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -68.05 -33.25 74.22 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.809 -178.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt -84.22 -30.87 25.38 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-N 114.882 -1.054 . . . . 0.0 109.727 -178.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.428 ' HG2' HD13 ' A' ' 19' ' ' LEU . 1.4 tppt? -77.43 -41.46 39.73 Favored 'General case' 0 C--N 1.298 -1.647 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.041 -177.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.41 HD22 ' CB ' ' A' ' 41' ' ' LEU . 3.9 pp -61.89 -32.67 73.06 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.02 0.438 . . . . 0.0 112.049 -175.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -76.77 -28.14 55.58 Favored 'General case' 0 C--N 1.31 -1.113 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.098 -178.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 . . . . . 0 C--N 1.322 -0.614 0 CA-C-O 121.34 0.59 . . . . 0.0 110.195 -178.373 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.578 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.1 m . . . . . 0 N--CA 1.444 -0.758 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.0 p-80 -68.65 -12.05 60.88 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-O 121.272 0.558 . . . . 0.0 111.154 176.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -97.88 -0.3 45.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.127 178.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.523 ' O ' ' HB2' ' A' ' 34' ' ' SER . 52.2 m0 -82.31 143.77 31.06 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.983 -179.114 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.5 m -99.63 -73.74 0.62 Allowed 'General case' 0 N--CA 1.428 -1.538 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.355 -175.012 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.431 ' O ' HG12 ' A' ' 12' ' ' VAL . 98.4 t -143.44 -65.48 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.198 -1.615 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 -59.74 -27.24 66.33 Favored 'General case' 0 C--N 1.312 -1.024 0 C-N-CA 124.076 0.951 . . . . 0.0 112.465 -177.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.568 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 43.3 mt-30 -72.6 -18.88 61.56 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.881 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.466 HG23 HD12 ' A' ' 38' ' ' LEU . 0.8 OUTLIER -78.83 -28.14 13.93 Favored 'Isoleucine or valine' 0 C--O 1.243 0.731 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -178.179 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.521 ' O ' HG23 ' A' ' 17' ' ' VAL . 1.2 m -67.88 -34.5 76.77 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.359 -176.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . 0.568 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 30.6 m-70 -59.13 -36.41 75.15 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.737 0.648 . . . . 0.0 109.631 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.443 ' CH2' HG23 ' A' ' 60' ' ' VAL . 25.0 t90 -67.18 -59.04 3.78 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.74 176.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.445 HD12 ' HA ' ' A' ' 13' ' ' SER . 31.4 mt -47.3 -48.82 24.88 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 124.441 1.088 . . . . 0.0 112.218 -177.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 13' ' ' SER . 64.9 t -61.2 -25.82 37.44 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.014 0 CA-C-O 120.882 0.373 . . . . 0.0 111.198 -178.062 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.76 -28.63 64.7 Favored Glycine 0 CA--C 1.505 -0.567 0 N-CA-C 111.754 -0.539 . . . . 0.0 111.754 -176.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.453 ' H ' HD23 ' A' ' 19' ' ' LEU . 1.2 pt? -105.78 16.02 25.87 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.223 178.603 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.8 m 66.59 21.69 10.65 Favored 'General case' 0 C--O 1.206 -1.197 0 C-N-CA 123.825 0.85 . . . . 0.0 112.318 -179.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.406 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 2.1 mm? -95.98 19.98 10.74 Favored 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 123.795 0.838 . . . . 0.0 109.129 178.384 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.45 ' HA ' HG23 ' A' ' 25' ' ' VAL . 7.6 p-10 -55.22 -20.66 11.42 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.091 0.956 . . . . 0.0 111.399 175.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -69.14 -22.17 63.96 Favored 'General case' 0 C--N 1.305 -1.353 0 C-N-CA 124.065 0.946 . . . . 0.0 111.033 177.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.534 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 2.6 m-85 -87.5 -20.65 26.23 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.384 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.45 HG23 ' HA ' ' A' ' 22' ' ' ASP . 93.6 t -52.14 -38.18 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -179.365 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 36.7 t -54.01 -41.19 67.71 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 123.455 0.472 . . . . 0.0 111.168 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.533 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 13.1 tp10 -96.56 -31.31 12.83 Favored 'General case' 0 N--CA 1.44 -0.961 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.264 -177.279 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.43 ' CG ' HD11 ' A' ' 16' ' ' LEU . 2.7 m-85 -55.91 -39.86 72.23 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.197 0.522 . . . . 0.0 110.438 175.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.4 m -71.83 -30.78 65.84 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.336 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.11 -35.75 71.91 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.681 -175.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -98.27 2.72 48.49 Favored 'General case' 0 C--N 1.313 -1.012 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.91 -178.799 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 62.66 37.56 12.74 Favored 'General case' 0 CA--C 1.504 -0.792 0 C-N-CA 123.383 0.673 . . . . 0.0 109.553 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.7 mm -67.45 110.69 1.85 Allowed 'Isoleucine or valine' 0 N--CA 1.434 -1.246 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.523 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 84.7 p -99.3 -169.79 1.81 Allowed 'General case' 0 N--CA 1.421 -1.886 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.584 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.578 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -66.69 -23.19 72.23 Favored Glycine 0 N--CA 1.436 -1.346 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 179.216 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.53 -46.34 89.16 Favored 'General case' 0 N--CA 1.442 -0.828 0 C-N-CA 124.09 0.956 . . . . 0.0 109.546 178.243 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.421 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -88.76 -19.97 25.36 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.6 -179.802 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.466 HD12 HG23 ' A' ' 12' ' ' VAL . 2.8 tt -62.78 -50.39 71.23 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 124.492 1.117 . . . . 0.0 108.927 178.151 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.0 mt -58.71 -41.53 86.58 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.13 -177.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -97.07 16.17 20.39 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.443 -175.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.478 ' HB2' HD22 ' A' ' 64' ' ' LEU . 34.1 mt -57.42 154.59 10.59 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.69 0.757 . . . . 0.0 112.556 176.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -159.9 168.17 26.38 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -50.78 -40.09 40.69 Favored Glycine 0 C--O 1.204 -1.75 0 O-C-N 123.95 0.781 . . . . 0.0 111.739 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -51.99 -49.02 64.11 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 178.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.439 ' O ' HD23 ' A' ' 49' ' ' LEU . 12.8 mtpp -67.99 -46.86 70.12 Favored 'General case' 0 C--O 1.196 -1.724 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.259 177.577 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 74.1 mt -59.27 -26.49 64.98 Favored 'General case' 0 C--O 1.255 1.381 0 C-N-CA 123.554 0.742 . . . . 0.0 112.271 -177.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.74 ' HA ' HG22 ' A' ' 52' ' ' THR . 57.0 mtpt -79.5 -37.23 37.21 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.735 175.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.98 -9.88 59.2 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.532 0.682 . . . . 0.0 110.682 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.533 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.2 mm? -82.24 0.6 40.53 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.423 -0.808 . . . . 0.0 108.987 173.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 67.78 4.12 31.71 Favored Glycine 0 C--O 1.224 -0.484 0 N-CA-C 114.607 0.603 . . . . 0.0 114.607 174.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.534 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 14.5 tpt -94.76 -48.86 5.86 Favored 'General case' 0 C--N 1.311 -1.108 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.343 -178.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.74 HG22 ' HA ' ' A' ' 47' ' ' LYS . 62.3 p 59.38 2.9 0.34 Allowed 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 126.489 1.916 . . . . 0.0 115.471 174.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.503 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 20.3 m -55.35 123.52 14.11 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 125.191 1.397 . . . . 0.0 113.705 -174.073 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.8 t -61.76 -48.02 82.57 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 -173.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.0 pp0? -64.81 -38.35 90.69 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 122.135 0.969 . . . . 0.0 108.576 -176.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.63 ' O ' HG12 ' A' ' 60' ' ' VAL . 7.5 m-20 -70.24 -47.24 62.21 Favored 'General case' 0 N--CA 1.42 -1.934 0 CA-C-N 113.458 -1.701 . . . . 0.0 109.553 -174.086 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.527 ' HA ' HG12 ' A' ' 60' ' ' VAL . 44.2 mtm180 -68.28 -11.98 60.31 Favored 'General case' 0 C--O 1.213 -0.829 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 179.26 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.69 -30.04 19.42 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 174.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 36.9 tp -86.38 -44.99 11.61 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.478 -176.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.63 HG12 ' O ' ' A' ' 56' ' ' ASP . 5.0 p -61.62 -26.59 40.07 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.134 0 CA-C-O 121.405 0.622 . . . . 0.0 109.538 177.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 54.1 tptt -74.4 -27.0 60.44 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.135 -174.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -82.22 -45.87 14.48 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 113.827 -1.533 . . . . 0.0 108.478 177.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.407 ' HE3' ' CB ' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -67.01 -42.16 85.43 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.513 -175.613 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.478 HD22 ' HB2' ' A' ' 41' ' ' LEU . 3.7 pp -62.9 -30.6 71.66 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -177.234 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.3 ptmm? -87.13 -11.12 51.01 Favored 'General case' 0 C--N 1.309 -1.165 0 C-N-CA 118.927 -1.109 . . . . 0.0 111.68 -177.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 . . . . . 0 C--N 1.315 -0.932 0 C-N-CA 120.939 -0.304 . . . . 0.0 110.313 -179.985 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.541 ' HA ' ' CD2' ' A' ' 7' ' ' TRP . 3.9 m . . . . . 0 C--O 1.219 -0.516 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.2 p-80 -74.19 -9.77 58.95 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-O 121.179 0.514 . . . . 0.0 111.494 -178.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -90.42 -9.82 46.12 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 178.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.541 ' CD2' ' HA ' ' A' ' 4' ' ' VAL . 48.3 m0 -84.0 135.37 34.47 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.237 -177.047 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.433 ' O ' ' HB3' ' A' ' 34' ' ' SER . 16.1 m -93.3 -69.63 0.74 Allowed 'General case' 0 C--N 1.298 -1.631 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.638 -178.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.54 ' O ' HG12 ' A' ' 12' ' ' VAL . 61.4 t -143.81 -62.33 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 -179.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.35 -37.47 48.05 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 124.667 1.187 . . . . 0.0 111.952 179.217 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -78.57 -20.07 51.41 Favored 'General case' 0 N--CA 1.435 -1.177 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -174.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.54 HG12 ' O ' ' A' ' 9' ' ' VAL . 2.6 p -70.88 -22.36 23.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 CA-C-O 121.707 0.765 . . . . 0.0 109.218 -178.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.492 ' O ' HG23 ' A' ' 17' ' ' VAL . 1.4 m -73.76 -26.49 60.69 Favored 'General case' 0 N--CA 1.423 -1.807 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.363 -176.159 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 53.7 m-70 -60.48 -42.33 96.05 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 123.414 0.446 . . . . 0.0 110.142 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.486 ' O ' HD23 ' A' ' 19' ' ' LEU . 36.0 t90 -63.13 -59.21 5.07 Favored 'General case' 0 N--CA 1.442 -0.831 0 O-C-N 123.825 0.703 . . . . 0.0 109.749 177.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.428 HD11 ' CD2' ' A' ' 28' ' ' PHE . 43.9 mt -47.53 -51.21 21.46 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 124.43 1.081 . . . . 0.0 112.266 -178.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 13' ' ' SER . 78.1 t -61.92 -26.86 41.09 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 CA-C-O 120.822 0.344 . . . . 0.0 111.219 -177.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -71.13 -29.2 69.04 Favored Glycine 0 C--O 1.223 -0.544 0 N-CA-C 111.945 -0.462 . . . . 0.0 111.945 -177.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.488 HD13 ' CB ' ' A' ' 63' ' ' LYS . 0.5 OUTLIER -104.96 16.16 26.43 Favored 'General case' 0 C--N 1.314 -0.94 0 O-C-N 122.334 -0.51 . . . . 0.0 111.04 177.649 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 62.5 m 62.65 34.3 15.02 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 122.326 1.06 . . . . 0.0 111.497 -178.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.531 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -104.02 17.14 24.72 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 125.105 1.362 . . . . 0.0 108.552 176.792 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -54.96 -25.41 29.47 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.561 178.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.531 ' NE2' ' HA ' ' A' ' 21' ' ' LEU . 0.6 OUTLIER -69.36 -20.31 63.84 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 119.996 -0.682 . . . . 0.0 111.853 177.126 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.423 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 3.8 m-85 -82.08 -19.49 40.11 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.153 -179.694 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 97.7 t -56.05 -36.32 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 O-C-N 123.212 0.32 . . . . 0.0 110.506 177.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 39.0 t -50.37 -38.75 44.05 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.246 1.018 . . . . 0.0 111.573 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.655 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 19.0 tp10 -105.12 -32.71 8.56 Favored 'General case' 0 C--N 1.312 -1.058 0 O-C-N 121.962 -0.461 . . . . 0.0 110.917 -178.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.428 ' CD2' HD11 ' A' ' 16' ' ' LEU . 2.1 m-85 -55.17 -40.6 70.86 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-O 121.72 0.771 . . . . 0.0 110.3 176.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 33.8 t -79.03 -21.81 46.37 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.52 -178.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.47 -38.41 62.93 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.0 0.429 . . . . 0.0 110.654 -177.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.448 HE21 ' HG3' ' A' ' 27' ' ' GLU . 1.4 pt20 -101.35 16.35 25.85 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 -179.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 59.03 39.56 23.26 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 121.194 0.521 . . . . 0.0 111.362 174.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.529 HG23 ' HB2' ' A' ' 37' ' ' GLN . 49.9 mm -71.44 111.43 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.385 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.473 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.433 ' HB3' ' O ' ' A' ' 8' ' ' SER . 65.9 p -105.81 -169.85 1.65 Allowed 'General case' 0 N--CA 1.418 -2.051 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.496 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.14 -25.8 66.82 Favored Glycine 0 N--CA 1.436 -1.303 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.695 176.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -59.78 -36.74 77.3 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 123.379 0.672 . . . . 0.0 109.621 179.083 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.529 ' HB2' HG23 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -89.96 -40.08 12.58 Favored 'General case' 0 C--O 1.215 -0.747 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.326 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.517 HD12 HG23 ' A' ' 12' ' ' VAL . 3.4 tt -49.7 -48.69 49.63 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.971 1.708 . . . . 0.0 111.268 -174.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 29.5 mt -61.96 -40.73 96.57 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.018 -177.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.413 HE22 ' HD2' ' A' ' 45' ' ' LYS . 5.0 pp0? -97.14 11.37 36.52 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -176.064 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.435 ' HG ' ' HA ' ' A' ' 38' ' ' LEU . 46.8 mt -53.86 150.29 7.77 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 121.446 0.641 . . . . 0.0 112.618 178.427 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.431 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 25.8 t70 -153.82 179.51 8.8 Favored 'General case' 0 C--N 1.295 -1.793 0 N-CA-C 105.707 -1.96 . . . . 0.0 105.707 178.187 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -60.92 -35.98 91.37 Favored Glycine 0 CA--C 1.488 -1.655 0 N-CA-C 110.971 -0.852 . . . . 0.0 110.971 -179.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -52.93 -47.66 67.86 Favored 'General case' 0 CA--C 1.498 -1.036 0 C-N-CA 123.322 0.649 . . . . 0.0 111.453 177.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.431 ' HD3' HD23 ' A' ' 41' ' ' LEU . 13.4 mtpp -68.82 -44.04 74.32 Favored 'General case' 0 C--O 1.192 -1.962 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.063 177.176 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 90.0 mt -58.58 -31.0 67.61 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-O 121.702 0.763 . . . . 0.0 111.392 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.733 ' HA ' HG22 ' A' ' 52' ' ' THR . 74.1 mttt -77.71 -26.55 50.18 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.897 177.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.21 -5.48 58.53 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-O 121.691 0.758 . . . . 0.0 110.215 178.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.655 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.5 mm? -83.97 -5.49 59.23 Favored 'General case' 0 C--O 1.203 -1.371 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 172.768 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.21 -7.29 8.27 Favored Glycine 0 C--O 1.222 -0.626 0 CA-C-N 116.114 -0.494 . . . . 0.0 113.534 176.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.423 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 14.1 tpt -81.08 -50.42 9.66 Favored 'General case' 0 N--CA 1.432 -1.364 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 -177.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.733 HG22 ' HA ' ' A' ' 47' ' ' LYS . 80.5 p 57.3 14.37 2.1 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.422 1.489 . . . . 0.0 114.507 173.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.404 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 70.9 m -63.26 129.2 39.27 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 123.801 0.84 . . . . 0.0 112.238 -174.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.8 t -61.15 -47.28 86.94 Favored 'General case' 0 C--O 1.241 0.631 0 C-N-CA 124.59 1.156 . . . . 0.0 112.81 -172.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -54.22 -55.48 27.61 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 122.234 1.016 . . . . 0.0 108.983 177.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.771 ' O ' HG12 ' A' ' 60' ' ' VAL . 4.5 m-20 -60.16 -45.89 91.54 Favored 'General case' 0 N--CA 1.417 -2.121 0 CA-C-N 113.161 -1.836 . . . . 0.0 109.425 -175.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -48.52 -34.13 10.76 Favored 'General case' 0 CA--C 1.507 -0.71 0 C-N-CA 124.411 1.084 . . . . 0.0 112.958 178.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -94.47 -40.34 9.94 Favored 'General case' 0 C--N 1.306 -1.314 0 O-C-N 123.714 0.634 . . . . 0.0 110.873 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.7 tp -68.81 -51.99 34.93 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -175.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.771 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.5 p -67.2 -21.84 28.48 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.249 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.9 tmtt? -70.8 -30.34 66.78 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -178.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.659 ' O ' ' HG2' ' A' ' 65' ' ' LYS . 85.8 tttt -83.17 -42.13 17.67 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 114.447 -1.252 . . . . 0.0 109.134 179.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.488 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -69.54 -28.5 66.07 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.399 -179.396 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.9 pp -79.88 -16.71 54.83 Favored 'General case' 0 C--O 1.204 -1.311 0 CA-C-O 120.971 0.415 . . . . 0.0 111.198 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.659 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 14.5 ptmm? -82.65 -17.07 45.91 Favored 'General case' 0 C--N 1.295 -1.8 0 C-N-CA 118.026 -1.47 . . . . 0.0 109.201 175.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 . . . . . 0 N--CA 1.439 -0.986 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.913 -179.925 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.535 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 17.2 m . . . . . 0 C--O 1.21 -0.974 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 11.3 p-80 -73.36 -11.51 60.51 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-O 121.533 0.682 . . . . 0.0 110.749 -178.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -95.42 1.46 54.17 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.133 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.505 ' CH2' HG12 ' A' ' 4' ' ' VAL . 54.5 m0 -85.64 139.85 31.05 Favored 'General case' 0 CA--C 1.492 -1.259 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 176.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.2 m -94.18 -77.48 0.46 Allowed 'General case' 0 N--CA 1.419 -1.991 0 O-C-N 123.698 0.624 . . . . 0.0 110.701 -177.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.488 ' O ' HG12 ' A' ' 12' ' ' VAL . 55.2 t -141.43 -54.23 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-O 121.601 0.715 . . . . 0.0 109.661 -176.415 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.1 pm0 -77.31 -14.9 59.65 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.644 -178.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.408 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 38.9 mt-30 -83.57 -19.55 35.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.211 179.36 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.9 p -72.63 -25.39 22.56 Favored 'Isoleucine or valine' 0 C--O 1.242 0.671 0 CA-C-O 121.851 0.834 . . . . 0.0 109.489 -177.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.07 -29.21 65.02 Favored 'General case' 0 N--CA 1.427 -1.623 0 CA-C-N 115.012 -0.994 . . . . 0.0 111.397 -175.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . 0.408 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 71.5 m-70 -59.91 -36.9 77.96 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 121.417 0.627 . . . . 0.0 109.77 -178.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.502 ' O ' HD23 ' A' ' 19' ' ' LEU . 32.6 t90 -68.04 -59.65 3.09 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.123 177.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.457 HD11 ' CD2' ' A' ' 28' ' ' PHE . 44.1 mt -48.22 -51.01 27.27 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.103 0.961 . . . . 0.0 112.231 -177.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 90.7 t -60.35 -24.54 31.32 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.959 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.317 -178.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.88 -37.67 50.38 Favored Glycine 0 N--CA 1.441 -1.02 0 N-CA-C 111.413 -0.675 . . . . 0.0 111.413 -177.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.502 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.9 OUTLIER -98.13 18.18 16.78 Favored 'General case' 0 C--N 1.32 -0.704 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.672 -179.844 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.8 m 67.89 23.52 8.34 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-O 122.151 0.977 . . . . 0.0 111.466 179.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.429 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.3 mm? -99.94 20.06 15.04 Favored 'General case' 0 C--N 1.299 -1.611 0 C-N-CA 124.321 1.048 . . . . 0.0 109.538 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.413 ' HA ' HG23 ' A' ' 25' ' ' VAL . 9.5 p-10 -53.08 -27.0 18.13 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.422 1.089 . . . . 0.0 110.373 174.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -61.46 -21.8 64.49 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 125.414 1.486 . . . . 0.0 111.374 178.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.597 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 5.3 m-85 -93.35 -21.02 19.8 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 116.031 -0.532 . . . . 0.0 112.152 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.413 HG23 ' HA ' ' A' ' 22' ' ' ASP . 98.4 t -53.14 -39.53 34.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 O-C-N 123.346 0.404 . . . . 0.0 111.843 -179.389 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.2 m -52.46 -38.29 58.98 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 123.76 0.663 . . . . 0.0 112.1 -177.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.471 ' HG3' HD13 ' A' ' 49' ' ' LEU . 15.3 tp10 -103.93 -30.04 10.57 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.565 -177.43 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.457 ' CD2' HD11 ' A' ' 16' ' ' LEU . 1.7 m-85 -56.99 -47.55 80.56 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-O 121.529 0.68 . . . . 0.0 110.541 177.062 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.1 m -81.3 -5.26 57.62 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.351 -178.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -87.85 -41.21 13.39 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.747 178.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -91.5 8.16 37.82 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 120.088 -0.645 . . . . 0.0 110.793 -177.637 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.493 HD22 ' N ' ' A' ' 32' ' ' ASN . 0.7 OUTLIER 64.89 38.06 6.73 Favored 'General case' 0 CA--C 1.507 -0.7 0 O-C-N 124.045 0.841 . . . . 0.0 109.168 179.166 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 49.0 mm -71.64 109.52 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.311 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 -179.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.433 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 97.1 p -103.94 -167.22 1.34 Allowed 'General case' 0 N--CA 1.432 -1.367 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.574 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.535 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -63.82 -24.62 68.43 Favored Glycine 0 N--CA 1.436 -1.353 0 N-CA-C 111.685 -0.566 . . . . 0.0 111.685 178.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -60.27 -43.43 96.22 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 177.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.439 ' HA ' HE21 ' A' ' 40' ' ' GLN . 0.0 OUTLIER -91.6 -17.74 25.11 Favored 'General case' 0 N--CA 1.436 -1.132 0 C-N-CA 119.921 -0.711 . . . . 0.0 112.489 179.506 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.442 HD12 HG23 ' A' ' 12' ' ' VAL . 4.2 tt -66.34 -49.99 65.1 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 124.18 0.992 . . . . 0.0 109.48 179.085 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.9 mt -63.9 -34.6 78.33 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.223 0.535 . . . . 0.0 112.0 -177.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.439 HE21 ' HA ' ' A' ' 37' ' ' GLN . 5.0 pp0? -100.47 15.1 29.01 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -177.099 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.455 ' HB2' HD22 ' A' ' 64' ' ' LEU . 40.8 mt -53.11 152.17 4.42 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-O 121.759 0.79 . . . . 0.0 112.976 177.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -155.35 167.48 30.23 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 105.666 -1.975 . . . . 0.0 105.666 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.533 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -54.17 -38.8 62.19 Favored Glycine 0 CA--C 1.493 -1.339 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 177.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -50.9 -49.19 59.95 Favored 'General case' 0 CA--C 1.503 -0.844 0 C-N-CA 123.244 0.618 . . . . 0.0 111.843 178.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.434 ' HD3' HD23 ' A' ' 41' ' ' LEU . 13.2 mtpp -64.67 -46.48 82.26 Favored 'General case' 0 C--O 1.196 -1.762 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.119 178.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 93.3 mt -57.22 -35.41 69.63 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-O 121.735 0.779 . . . . 0.0 111.272 -179.106 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.686 ' HA ' HG22 ' A' ' 52' ' ' THR . 55.5 mtpt -71.48 -35.12 70.71 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.315 178.14 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.6 -8.73 58.93 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.254 0.55 . . . . 0.0 110.864 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.471 HD13 ' HG3' ' A' ' 27' ' ' GLU . 4.0 mm? -85.26 -2.51 58.13 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.76 0.791 . . . . 0.0 108.963 174.144 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.84 0.84 57.19 Favored Glycine 0 N--CA 1.445 -0.76 0 CA-C-N 115.202 -0.908 . . . . 0.0 114.846 174.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.597 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 16.7 tpt -83.65 -56.11 3.9 Favored 'General case' 0 CA--C 1.492 -1.277 0 C-N-CA 119.359 -0.937 . . . . 0.0 109.84 -178.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.686 HG22 ' HA ' ' A' ' 47' ' ' LYS . 76.7 p 53.02 40.73 31.67 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.086 0.954 . . . . 0.0 111.991 175.246 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.605 ' HB3' ' OD1' ' A' ' 56' ' ' ASP . 32.6 t -75.88 -179.77 5.04 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 177.116 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.3 m -107.74 -23.23 12.18 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 174.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -69.52 -42.6 74.47 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.857 -178.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.654 ' O ' HG12 ' A' ' 60' ' ' VAL . 8.9 p-10 -75.14 -41.38 58.44 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.065 -175.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 54.5 mmm-85 -55.55 -19.8 11.19 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.958 0.903 . . . . 0.0 112.357 -176.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -101.19 -35.85 9.15 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.082 175.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 30.6 tp -84.01 -53.97 5.18 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 -174.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.654 HG12 ' O ' ' A' ' 56' ' ' ASP . 8.1 p -64.28 -24.41 35.61 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.239 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -178.693 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -69.53 -30.11 67.86 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 114.423 -1.262 . . . . 0.0 108.906 -176.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.41 ' HB2' ' NZ ' ' A' ' 62' ' ' LYS . 3.8 ttmp? -86.49 -38.52 17.18 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-N 114.026 -1.443 . . . . 0.0 109.353 -178.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.421 ' HG2' HD13 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -71.47 -41.5 69.29 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 114.954 -1.021 . . . . 0.0 111.382 -177.508 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.455 HD22 ' HB2' ' A' ' 41' ' ' LEU . 3.6 pp -63.49 -31.5 72.69 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.996 -175.551 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -78.84 -26.91 44.15 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 119.841 -0.743 . . . . 0.0 111.644 -177.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 . . . . . 0 N--CA 1.444 -0.772 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.037 -177.468 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.615 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 43.5 p-80 -152.83 11.27 0.49 Allowed 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 5.0 mpp? -80.41 161.1 25.12 Favored 'General case' 0 N--CA 1.421 -1.895 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.597 -172.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.482 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 2.7 m -74.64 -29.66 23.77 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.959 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -169.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -70.58 -7.72 46.12 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.751 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -101.85 -7.83 22.16 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.203 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.507 ' HA ' HE21 ' A' ' 11' ' ' GLN . 53.5 m0 -71.28 144.59 49.94 Favored 'General case' 0 CA--C 1.501 -0.92 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.1 m -94.84 -71.73 0.65 Allowed 'General case' 0 N--CA 1.419 -1.98 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.615 -173.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 74.9 t -146.08 -68.13 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.203 -1.376 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.2 pm0 -63.76 -20.82 66.05 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.914 -0.585 . . . . 0.0 112.445 -175.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.507 HE21 ' HA ' ' A' ' 7' ' ' TRP . 28.0 mt-30 -77.71 -13.31 59.94 Favored 'General case' 0 C--O 1.217 -0.61 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.402 HG23 HD12 ' A' ' 38' ' ' LEU . 1.1 p -77.16 -19.58 14.36 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.379 0 CA-C-O 121.393 0.616 . . . . 0.0 109.48 178.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 83.3 p -70.81 -39.25 73.17 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.948 -175.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . 0.5 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 42.5 m-70 -50.37 -36.58 33.15 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 114.392 -1.276 . . . . 0.0 110.92 -179.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.489 ' CH2' HG23 ' A' ' 60' ' ' VAL . 24.7 t90 -71.15 -61.85 1.61 Allowed 'General case' 0 N--CA 1.423 -1.788 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.784 175.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.437 HD11 ' CD2' ' A' ' 28' ' ' PHE . 44.5 mt -46.68 -49.07 19.9 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.474 1.11 . . . . 0.0 112.419 -177.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 99.5 t -59.35 -29.53 42.19 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.321 0 C-N-CA 122.74 0.416 . . . . 0.0 111.176 -179.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -72.39 -27.37 69.87 Favored Glycine 0 N--CA 1.447 -0.621 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.179 -176.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.462 HD23 ' O ' ' A' ' 15' ' ' TRP . 1.2 pt? -106.94 15.51 25.3 Favored 'General case' 0 C--N 1.317 -0.847 0 O-C-N 122.586 -0.361 . . . . 0.0 111.064 179.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.3 t 74.46 16.42 3.28 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-O 122.178 0.989 . . . . 0.0 111.523 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -93.95 17.85 11.56 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 114.914 -1.039 . . . . 0.0 109.629 -177.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.429 ' HA ' HG23 ' A' ' 25' ' ' VAL . 13.3 t70 -50.94 -30.79 15.79 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-O 121.538 0.685 . . . . 0.0 111.196 174.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -59.54 -25.74 64.78 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 124.593 1.157 . . . . 0.0 110.834 178.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.411 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 14.3 m-85 -88.7 -21.96 23.63 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.774 -178.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.429 HG23 ' HA ' ' A' ' 22' ' ' ASP . 57.7 t -55.85 -35.09 38.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 122.665 0.386 . . . . 0.0 111.338 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.8 m -57.32 -30.05 64.44 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 123.815 0.846 . . . . 0.0 111.879 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.601 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 21.1 tp10 -109.55 -35.99 6.08 Favored 'General case' 0 N--CA 1.431 -1.377 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.416 -178.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.437 ' CD2' HD11 ' A' ' 16' ' ' LEU . 1.9 m-85 -53.67 -43.44 68.87 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-O 121.411 0.624 . . . . 0.0 110.795 177.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.7 m -77.07 -23.04 52.0 Favored 'General case' 0 N--CA 1.44 -0.972 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.718 -177.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.87 -39.48 69.62 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.624 -178.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.32 9.33 40.26 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.288 -178.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 61.63 42.2 11.31 Favored 'General case' 0 C--O 1.234 0.271 0 O-C-N 123.611 0.569 . . . . 0.0 110.453 177.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.9 mm -72.18 114.25 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.013 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 90.2 p -107.37 -167.85 1.32 Allowed 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 178.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.482 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.17 -27.74 69.56 Favored Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 111.311 -0.716 . . . . 0.0 111.311 178.181 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -55.34 -42.75 74.24 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.044 0.937 . . . . 0.0 110.224 178.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.562 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -94.61 -24.74 17.08 Favored 'General case' 0 N--CA 1.433 -1.286 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.218 -179.271 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.402 HD12 HG23 ' A' ' 12' ' ' VAL . 3.4 tt -57.2 -52.73 64.14 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.868 1.267 . . . . 0.0 109.605 177.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.8 mt -62.58 -38.71 91.17 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -175.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.411 HE22 ' HD2' ' A' ' 45' ' ' LYS . 5.2 pp0? -99.88 10.55 41.12 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -175.058 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.62 ' HB2' HD22 ' A' ' 64' ' ' LEU . 40.5 mt -50.71 135.1 24.03 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 178.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -134.21 179.48 6.24 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 176.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.67 -42.76 85.74 Favored Glycine 0 C--O 1.204 -1.764 0 CA-C-O 119.238 -0.757 . . . . 0.0 112.699 -179.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -55.33 -43.33 74.85 Favored 'General case' 0 CA--C 1.488 -1.409 0 CA-C-N 117.459 0.629 . . . . 0.0 111.873 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.411 ' HD2' HE22 ' A' ' 40' ' ' GLN . 12.6 mtpp -65.23 -49.5 69.42 Favored 'General case' 0 C--O 1.196 -1.754 0 O-C-N 123.763 0.665 . . . . 0.0 110.817 176.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 91.1 mt -60.0 -30.95 69.48 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.848 0.833 . . . . 0.0 111.391 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.714 ' HA ' HG22 ' A' ' 52' ' ' THR . 58.7 mtpt -77.68 -30.24 51.84 Favored 'General case' 0 N--CA 1.426 -1.659 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.127 177.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.38 -4.32 47.63 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.224 0.535 . . . . 0.0 111.267 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.601 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.3 mm? -84.94 -7.56 59.11 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 171.191 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.85 -1.26 39.95 Favored Glycine 0 C--O 1.223 -0.578 0 CA-C-N 115.879 -0.601 . . . . 0.0 113.719 176.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.411 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 15.3 tpt -85.32 -50.18 7.55 Favored 'General case' 0 C--N 1.307 -1.239 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 -178.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.714 HG22 ' HA ' ' A' ' 47' ' ' LYS . 74.8 p 52.88 31.72 11.24 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 123.995 0.918 . . . . 0.0 112.168 174.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.2 t -73.08 129.76 38.79 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.768 -175.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.6 t -53.66 -54.86 31.78 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 125.061 1.344 . . . . 0.0 113.118 -176.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -50.65 -55.88 14.4 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-O 122.513 1.149 . . . . 0.0 109.914 177.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.788 ' O ' HG12 ' A' ' 60' ' ' VAL . 6.3 m-20 -62.0 -42.16 98.85 Favored 'General case' 0 N--CA 1.412 -2.345 0 CA-C-N 113.055 -1.884 . . . . 0.0 111.105 -173.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -52.79 -25.64 11.95 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 177.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -101.35 -38.47 8.03 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-O 120.879 0.371 . . . . 0.0 110.985 176.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 56.0 tp -72.67 -55.2 7.18 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -174.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.788 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.4 p -59.88 -26.4 35.47 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.032 0 CA-C-O 121.637 0.732 . . . . 0.0 109.16 -179.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.416 ' HA ' ' CD2' ' A' ' 64' ' ' LEU . 55.9 tptt -72.01 -28.92 63.71 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 113.655 -1.612 . . . . 0.0 110.16 -172.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -84.44 -40.21 18.03 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 114.73 -1.123 . . . . 0.0 108.655 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.401 ' HG2' HD13 ' A' ' 19' ' ' LEU . 3.0 tppt? -69.43 -42.46 74.94 Favored 'General case' 0 C--N 1.297 -1.686 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.201 -175.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.62 HD22 ' HB2' ' A' ' 41' ' ' LEU . 3.7 pp -65.73 -30.06 70.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.343 -175.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -82.68 -22.13 34.68 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 119.701 -0.8 . . . . 0.0 111.711 -179.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -100.58 7.77 43.83 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.06 0.457 . . . . 0.0 110.205 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.479 ' HG2' ' HA ' ' A' ' 64' ' ' LEU . 49.0 mmm -53.52 -24.28 12.84 Favored 'General case' 0 CA--C 1.488 -1.428 0 N-CA-C 113.72 1.007 . . . . 0.0 113.72 -179.005 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -62.17 -28.04 69.39 Favored 'General case' 0 C--N 1.286 -2.18 0 CA-C-N 115.059 -0.973 . . . . 0.0 112.55 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 19.0 ptp -104.48 -28.18 11.46 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 174.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 18.6 m -76.86 -28.84 55.58 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.634 -173.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.403 ' HB3' ' HE3' ' A' ' 67' ' ' MET . 4.0 pp -58.79 -33.9 70.86 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 121.474 0.654 . . . . 0.0 111.761 -179.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -81.32 -50.11 9.9 Favored 'General case' 0 N--CA 1.403 -2.789 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.379 -176.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 50.7 mttm -83.45 -20.58 33.8 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.087 -0.961 . . . . 0.0 111.679 -169.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.319 0 C-N-CA 125.542 1.537 . . . . 0.0 112.626 176.924 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.744 0 N-CA-C 109.908 -1.277 . . . . 0.0 109.908 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 41.3 p-80 -80.54 -3.21 49.29 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -175.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 65.2 mtt -67.3 158.06 32.45 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 121.432 0.634 . . . . 0.0 112.533 -175.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.651 HG13 HD22 ' A' ' 71' ' ' LEU . 4.3 m -71.02 -26.04 26.81 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.253 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -167.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 12.3 p-80 -71.12 -12.69 61.63 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-O 121.268 0.556 . . . . 0.0 110.643 178.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -91.66 -7.9 48.63 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.85 178.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.488 ' O ' ' HB2' ' A' ' 34' ' ' SER . 49.2 m0 -82.66 147.45 28.51 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 -179.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 58.0 m -115.75 -69.21 0.87 Allowed 'General case' 0 N--CA 1.416 -2.162 0 O-C-N 123.422 0.451 . . . . 0.0 110.917 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.416 ' O ' HG12 ' A' ' 12' ' ' VAL . 59.3 t -141.58 -60.56 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -178.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.7 pm0 -70.29 9.58 0.58 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.629 -1.168 . . . . 0.0 113.865 -177.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.443 HE21 ' HA ' ' A' ' 7' ' ' TRP . 18.8 mt-30 -123.15 -11.9 7.96 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 175.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.574 HG23 HD12 ' A' ' 38' ' ' LEU . 4.2 p -77.4 -19.52 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-O 122.488 1.137 . . . . 0.0 108.474 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.9 p -67.53 -40.38 85.05 Favored 'General case' 0 N--CA 1.425 -1.676 0 C-N-CA 125.692 1.597 . . . . 0.0 112.376 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . 0.418 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 45.1 m-70 -57.61 -38.57 75.15 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.266 -177.287 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.467 ' O ' HD23 ' A' ' 19' ' ' LEU . 42.5 t90 -64.94 -61.06 2.39 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.488 176.141 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.1 mt -45.37 -52.62 9.69 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.657 1.183 . . . . 0.0 112.389 -177.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 85.3 t -62.65 -27.39 42.83 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 CA-C-O 121.148 0.499 . . . . 0.0 111.489 -177.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.67 -30.76 70.57 Favored Glycine 0 C--O 1.217 -0.918 0 CA-C-N 115.914 -0.584 . . . . 0.0 112.034 -178.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.467 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.4 OUTLIER -102.63 15.52 29.06 Favored 'General case' 0 C--N 1.314 -0.953 0 O-C-N 122.503 -0.41 . . . . 0.0 111.215 177.74 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.0 m 67.4 26.99 8.24 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 122.422 1.106 . . . . 0.0 111.008 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.561 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 1.2 mm? -98.0 21.28 10.92 Favored 'General case' 0 C--N 1.31 -1.114 0 C-N-CA 125.173 1.389 . . . . 0.0 108.69 178.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.409 ' HA ' HG12 ' A' ' 25' ' ' VAL . 8.8 p-10 -60.45 -9.97 4.33 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 123.893 0.877 . . . . 0.0 112.939 176.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.561 ' NE2' ' HA ' ' A' ' 21' ' ' LEU . 0.3 OUTLIER -84.07 -18.14 37.95 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 118.957 -1.097 . . . . 0.0 111.431 172.497 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -84.75 -27.72 26.74 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -177.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.544 ' HA ' ' HB2' ' A' ' 28' ' ' PHE . 0.7 OUTLIER -58.89 -25.62 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 177.971 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.3 m -54.7 -40.78 69.53 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.836 0.854 . . . . 0.0 111.383 176.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 38.2 tp10 -105.97 -27.42 11.18 Favored 'General case' 0 C--O 1.219 -0.541 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.044 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.544 ' HB2' ' HA ' ' A' ' 25' ' ' VAL . 1.7 m-85 -53.73 -44.39 69.85 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 121.218 0.533 . . . . 0.0 110.473 176.066 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.414 ' HA ' HG13 ' A' ' 9' ' ' VAL . 17.6 m -69.5 -28.87 66.43 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.615 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -76.88 -19.82 56.99 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.949 -176.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -106.8 4.21 27.29 Favored 'General case' 0 CA--C 1.501 -0.917 0 C-N-CA 119.649 -0.82 . . . . 0.0 109.474 175.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 61.06 38.9 16.86 Favored 'General case' 0 C--O 1.245 0.868 0 O-C-N 124.087 0.867 . . . . 0.0 110.435 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 49.4 mm -67.95 114.64 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.874 0 CA-C-N 115.187 -0.915 . . . . 0.0 108.673 -179.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.488 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 89.1 p -103.49 -169.26 1.62 Allowed 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 178.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.464 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -60.96 -29.04 69.73 Favored Glycine 0 N--CA 1.439 -1.12 0 N-CA-C 111.42 -0.672 . . . . 0.0 111.42 178.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -58.4 -44.8 89.16 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.39 0.614 . . . . 0.0 109.631 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.44 ' HA ' HE21 ' A' ' 40' ' ' GLN . 0.0 OUTLIER -93.94 -4.46 49.75 Favored 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -179.255 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.574 HD12 HG23 ' A' ' 12' ' ' VAL . 3.3 tt -80.57 -49.47 11.27 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 178.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.5 mt -61.38 -39.52 90.97 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.524 -178.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.44 HE21 ' HA ' ' A' ' 37' ' ' GLN . 5.0 pp0? -93.47 15.4 16.0 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -178.31 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.412 ' CB ' HD22 ' A' ' 64' ' ' LEU . 40.8 mt -55.64 160.49 2.48 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.704 0.764 . . . . 0.0 112.674 178.11 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.446 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 15.5 t70 -162.08 172.36 16.0 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 105.784 -1.932 . . . . 0.0 105.784 -177.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.401 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -61.04 -34.73 89.05 Favored Glycine 0 C--O 1.204 -1.748 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 175.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -51.1 -48.55 61.68 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 123.455 0.702 . . . . 0.0 111.16 176.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.45 ' O ' HD23 ' A' ' 49' ' ' LEU . 14.0 mtpp -69.07 -43.08 75.32 Favored 'General case' 0 C--O 1.197 -1.702 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.266 176.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 91.0 mt -59.84 -27.23 66.47 Favored 'General case' 0 C--O 1.255 1.349 0 CA-C-O 121.603 0.716 . . . . 0.0 111.244 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.767 ' HA ' HG22 ' A' ' 52' ' ' THR . 58.4 mtpt -80.8 -40.34 25.19 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.701 175.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.26 -11.26 60.45 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.512 0.672 . . . . 0.0 111.59 179.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.469 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.0 mm? -78.21 -3.23 41.62 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 123.179 0.591 . . . . 0.0 110.029 171.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 70.57 8.99 64.22 Favored Glycine 0 C--N 1.341 0.845 0 CA-C-O 121.259 0.366 . . . . 0.0 112.665 177.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 22.0 mmt -92.13 -59.06 2.19 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 115.418 -0.391 . . . . 0.0 110.929 -178.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.767 HG22 ' HA ' ' A' ' 47' ' ' LYS . 25.5 p 57.68 25.57 11.92 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 124.588 1.155 . . . . 0.0 112.588 175.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.425 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 14.8 m -69.74 118.99 13.29 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 123.19 0.596 . . . . 0.0 111.559 -176.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.0 m -63.2 -34.42 77.61 Favored 'General case' 0 C--O 1.244 0.77 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -177.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.459 ' HG3' ' N ' ' A' ' 56' ' ' ASP . 5.3 pt20 -59.24 -45.26 91.63 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.548 0.689 . . . . 0.0 110.198 176.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.587 ' O ' HG12 ' A' ' 60' ' ' VAL . 70.9 m-20 -74.76 -35.08 62.58 Favored 'General case' 0 N--CA 1.425 -1.724 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.666 -175.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.425 ' HG2' ' O ' ' A' ' 53' ' ' SER . 49.0 mmm-85 -55.22 -25.81 35.51 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.684 0.394 . . . . 0.0 111.548 175.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -98.28 -17.69 18.79 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.889 0.375 . . . . 0.0 111.279 178.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -96.39 -66.55 0.9 Allowed 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 120.641 0.258 . . . . 0.0 110.801 -175.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.587 HG12 ' O ' ' A' ' 56' ' ' ASP . 3.9 p -61.55 -24.57 34.22 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.849 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.769 -174.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -63.59 -36.25 83.17 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 122.107 0.956 . . . . 0.0 109.442 -179.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.445 ' O ' ' HG2' ' A' ' 65' ' ' LYS . 82.5 tttt -81.98 -34.76 29.53 Favored 'General case' 0 C--N 1.29 -2.016 0 CA-C-N 114.163 -1.381 . . . . 0.0 109.571 -177.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.466 ' O ' ' HB3' ' A' ' 67' ' ' MET . 0.5 OUTLIER -74.54 -38.57 62.73 Favored 'General case' 0 C--O 1.191 -1.989 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.229 -176.99 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.412 HD22 ' CB ' ' A' ' 41' ' ' LEU . 3.5 pp -64.36 -29.96 71.02 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -176.003 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.445 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 21.6 pttp -75.25 -34.97 61.44 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 119.933 -0.707 . . . . 0.0 110.309 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -100.52 1.5 41.08 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.15 0.5 . . . . 0.0 111.062 -175.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.466 ' HB3' ' O ' ' A' ' 63' ' ' LYS . 2.6 ppp? -70.83 -22.71 62.29 Favored 'General case' 0 C--O 1.195 -1.788 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.224 -176.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.53 ' HA ' HD23 ' A' ' 71' ' ' LEU . 54.4 pttt -71.67 -17.54 62.23 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.358 179.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 48.1 mtt -100.94 -34.45 9.77 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 172.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 22.8 m -82.91 -12.87 57.01 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.928 -1.033 . . . . 0.0 113.542 -172.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.651 HD22 HG13 ' A' ' 4' ' ' VAL . 4.5 pp -55.98 -31.57 63.13 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.939 0.876 . . . . 0.0 110.857 176.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.507 ' N ' HD12 ' A' ' 71' ' ' LEU . 10.3 tt0 -70.81 -37.22 73.24 Favored 'General case' 0 N--CA 1.416 -2.167 0 CA-C-N 114.051 -1.431 . . . . 0.0 111.727 -179.568 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.78 24.34 8.51 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.892 0.853 . . . . 0.0 110.614 -175.222 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.279 -2.465 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.436 -178.158 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.38 0 N-CA-C 111.74 -0.544 . . . . 0.0 111.74 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 27.6 p80 -116.51 3.39 13.19 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -174.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 96.0 mmm -67.93 169.25 10.24 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 177.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.583 HG12 ' CH2' ' A' ' 7' ' ' TRP . 15.2 m -66.04 -34.99 73.96 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.799 0 O-C-N 121.831 -0.543 . . . . 0.0 112.311 -173.171 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.4 p-80 -73.37 -9.11 58.35 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.843 0.83 . . . . 0.0 110.725 179.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -98.74 -11.27 22.07 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.149 177.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.583 ' CH2' HG12 ' A' ' 4' ' ' VAL . 54.1 m0 -72.53 150.77 42.9 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 177.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.2 m -104.48 -75.0 0.63 Allowed 'General case' 0 N--CA 1.424 -1.759 0 CA-C-O 121.082 0.468 . . . . 0.0 109.992 -178.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.513 ' O ' HG12 ' A' ' 12' ' ' VAL . 94.5 t -139.06 -65.67 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.203 -1.353 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 -175.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -66.71 -14.04 62.06 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.153 0.501 . . . . 0.0 112.301 -176.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.493 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 26.3 mt-30 -88.34 -15.75 34.83 Favored 'General case' 0 N--CA 1.433 -1.299 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 178.038 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.513 HG12 ' O ' ' A' ' 9' ' ' VAL . 2.9 p -75.67 -25.76 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-O 122.028 0.918 . . . . 0.0 109.294 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.412 ' HA ' HD12 ' A' ' 16' ' ' LEU . 0.8 OUTLIER -67.09 -28.38 68.13 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 114.6 -1.182 . . . . 0.0 111.654 -177.039 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . 0.493 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 83.6 m-70 -59.5 -41.68 90.41 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 -178.078 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.528 ' O ' HD23 ' A' ' 19' ' ' LEU . 38.0 t90 -64.51 -57.46 9.13 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.819 177.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.473 HD11 ' CD2' ' A' ' 28' ' ' PHE . 48.5 mt -48.96 -51.24 31.44 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.104 0.962 . . . . 0.0 112.738 -178.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 13' ' ' SER . 88.2 t -62.47 -24.78 36.15 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.033 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.022 -178.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -75.03 -24.13 72.56 Favored Glycine 0 N--CA 1.444 -0.775 0 N-CA-C 112.017 -0.433 . . . . 0.0 112.017 -177.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.528 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.7 OUTLIER -105.56 15.98 26.15 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.143 0.496 . . . . 0.0 110.482 174.818 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.1 m 64.67 28.92 13.09 Favored 'General case' 0 C--O 1.213 -0.862 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.804 178.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.605 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 0.6 OUTLIER -100.51 20.86 14.19 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 126.851 2.06 . . . . 0.0 108.856 -179.593 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -49.59 -29.97 7.97 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.595 0.758 . . . . 0.0 112.242 176.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.605 ' NE2' ' HA ' ' A' ' 21' ' ' LEU . 2.6 pm0 -61.75 -22.37 65.33 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 176.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.414 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 8.4 m-85 -85.97 -22.87 27.14 Favored 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 86.9 t -54.86 -38.71 45.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 O-C-N 123.383 0.427 . . . . 0.0 111.254 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.8 m -50.86 -39.46 53.83 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.283 1.033 . . . . 0.0 111.745 -178.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.623 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 35.4 tp10 -103.34 -30.66 10.47 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.747 -178.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.473 ' CD2' HD11 ' A' ' 16' ' ' LEU . 1.6 m-85 -55.26 -41.13 71.8 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 121.389 0.614 . . . . 0.0 109.884 176.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.463 ' HA ' HG13 ' A' ' 9' ' ' VAL . 47.1 t -69.37 -34.81 75.1 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.911 178.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.52 -32.51 71.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.129 -173.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -99.33 6.44 46.15 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.124 -179.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 59.47 39.15 22.18 Favored 'General case' 0 C--O 1.244 0.783 0 O-C-N 123.867 0.729 . . . . 0.0 110.118 178.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.4 mm -67.76 112.54 2.98 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.219 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.34 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 87.6 p -107.13 -168.23 1.37 Allowed 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.484 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.9 -25.37 67.71 Favored Glycine 0 N--CA 1.441 -0.975 0 N-CA-C 111.458 -0.657 . . . . 0.0 111.458 177.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -56.26 -39.57 72.83 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.265 1.026 . . . . 0.0 108.955 178.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.404 ' HA ' HE21 ' A' ' 40' ' ' GLN . 0.0 OUTLIER -99.1 -20.71 16.54 Favored 'General case' 0 N--CA 1.434 -1.27 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 179.211 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.414 HD12 HG23 ' A' ' 12' ' ' VAL . 2.6 tt -64.75 -51.47 62.16 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.915 0.886 . . . . 0.0 109.856 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.405 HD21 HG21 ' A' ' 4' ' ' VAL . 25.6 mt -62.31 -34.32 76.38 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.547 0.689 . . . . 0.0 111.718 -175.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.404 HE21 ' HA ' ' A' ' 37' ' ' GLN . 5.0 pp0? -101.56 13.59 34.51 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -177.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.409 HD23 ' HD3' ' A' ' 45' ' ' LYS . 41.3 mt -55.03 155.19 4.73 Favored 'General case' 0 C--O 1.24 0.588 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 177.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -159.38 -176.66 5.92 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 176.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.95 -39.25 93.88 Favored Glycine 0 N--CA 1.429 -1.791 0 CA-C-O 118.982 -0.899 . . . . 0.0 113.014 -179.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 -57.55 -45.15 85.47 Favored 'General case' 0 CA--C 1.481 -1.686 0 CA-C-N 117.845 0.822 . . . . 0.0 111.896 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.409 ' HD3' HD23 ' A' ' 41' ' ' LEU . 15.1 mtpp -63.77 -46.31 85.82 Favored 'General case' 0 C--O 1.199 -1.58 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.999 177.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 83.8 mt -60.14 -32.48 71.07 Favored 'General case' 0 C--O 1.244 0.779 0 CA-C-O 121.679 0.752 . . . . 0.0 111.352 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.709 ' HA ' HG22 ' A' ' 52' ' ' THR . 40.9 mtpt -72.11 -34.74 68.83 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.922 175.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.07 -13.26 61.17 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 123.12 0.568 . . . . 0.0 111.434 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.623 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.3 mm? -77.71 -7.66 56.81 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-O 121.449 0.642 . . . . 0.0 109.544 173.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.89 -1.43 46.93 Favored Glycine 0 C--O 1.222 -0.614 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.955 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.414 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 37.6 tpp -85.15 -48.27 9.33 Favored 'General case' 0 N--CA 1.441 -0.885 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -178.395 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.709 HG22 ' HA ' ' A' ' 47' ' ' LYS . 70.5 p 55.72 17.02 2.21 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 125.579 1.552 . . . . 0.0 114.274 172.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.453 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 40.5 t -65.14 118.75 9.66 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 122.669 0.388 . . . . 0.0 111.25 -176.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.5 t -59.61 -46.46 88.89 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 123.745 0.818 . . . . 0.0 110.56 -177.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -57.13 -48.53 78.44 Favored 'General case' 0 C--O 1.241 0.619 0 O-C-N 123.427 0.455 . . . . 0.0 111.434 178.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.667 ' O ' HG12 ' A' ' 60' ' ' VAL . 29.0 m-20 -66.9 -44.81 79.84 Favored 'General case' 0 CA--C 1.474 -1.969 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.576 -177.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.666 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 28.5 mtm180 -58.15 -35.66 71.87 Favored 'General case' 0 C--O 1.196 -1.735 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 -178.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.81 -27.49 62.0 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.315 0.579 . . . . 0.0 110.648 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 47.8 tp -85.58 -51.57 6.4 Favored 'General case' 0 C--O 1.247 0.945 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.891 -177.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.667 HG12 ' O ' ' A' ' 56' ' ' ASP . 4.4 p -60.67 -22.52 26.31 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.513 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.003 178.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.666 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 26.5 tptp -70.55 -33.84 71.58 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 122.082 0.944 . . . . 0.0 108.877 -174.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -82.76 -43.28 16.94 Favored 'General case' 0 C--N 1.288 -2.103 0 CA-C-N 114.221 -1.354 . . . . 0.0 108.974 -178.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.462 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.8 OUTLIER -69.98 -36.31 75.09 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 114.734 -1.121 . . . . 0.0 112.198 -175.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.0 pp -69.7 -17.17 63.45 Favored 'General case' 0 C--O 1.205 -1.285 0 CA-C-N 116.757 -0.202 . . . . 0.0 111.303 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -98.47 0.57 45.45 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 119.719 -0.792 . . . . 0.0 112.342 176.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -128.34 12.05 6.46 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 122.82 1.295 . . . . 0.0 108.538 177.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.486 ' SD ' ' N ' ' A' ' 67' ' ' MET . 0.0 OUTLIER -58.21 -26.16 62.5 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 126.649 1.979 . . . . 0.0 110.142 179.428 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -58.12 -34.34 70.11 Favored 'General case' 0 C--N 1.304 -1.392 0 C-N-CA 126.021 1.729 . . . . 0.0 111.676 177.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.447 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 18.2 ptp -98.82 -26.83 14.18 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 176.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.446 ' HB3' ' HA ' ' A' ' 67' ' ' MET . 16.6 t -65.02 -40.68 95.23 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.825 -177.173 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.503 HD22 HG13 ' A' ' 4' ' ' VAL . 4.1 pp -60.0 -30.23 69.0 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.27 0.557 . . . . 0.0 111.343 178.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -83.63 -45.7 13.18 Favored 'General case' 0 N--CA 1.397 -3.08 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.747 -172.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 69' ' ' MET . 56.1 mtpt -63.01 -77.95 0.05 OUTLIER 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.287 -169.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.997 0 C-N-CA 126.811 2.044 . . . . 0.0 105.597 -177.593 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.534 0 N-CA-C 110.751 -0.94 . . . . 0.0 110.751 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -97.96 -6.25 32.54 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 117.703 0.752 . . . . 0.0 110.557 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 78.2 mtm -79.88 154.63 28.23 Favored 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.624 178.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.632 HG11 ' SD ' ' A' ' 67' ' ' MET . 10.2 m -67.32 -30.6 49.66 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.355 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 -166.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.4 p-80 -70.98 -12.98 61.84 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-O 121.39 0.615 . . . . 0.0 110.488 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -95.46 -2.18 49.29 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 123.908 0.883 . . . . 0.0 110.132 178.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.615 ' CH2' HG12 ' A' ' 4' ' ' VAL . 52.1 m0 -84.75 131.09 34.6 Favored 'General case' 0 N--CA 1.433 -1.304 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 179.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.2 m -87.57 -72.98 0.5 Allowed 'General case' 0 C--N 1.296 -1.754 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.801 -175.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.44 ' O ' HG12 ' A' ' 12' ' ' VAL . 66.7 t -143.49 -63.71 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.2 -1.514 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -179.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.427 ' NE2' ' HG3' ' A' ' 11' ' ' GLN . 4.3 pm0 -64.38 -24.7 67.73 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.051 -177.352 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.57 HE21 ' HA ' ' A' ' 7' ' ' TRP . 23.4 mt-30 -79.01 -14.51 59.15 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.44 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.8 p -73.12 -26.19 22.58 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 CA-C-O 121.666 0.746 . . . . 0.0 109.688 179.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.462 ' HA ' HD12 ' A' ' 16' ' ' LEU . 1.5 m -71.62 -26.4 62.56 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.538 -174.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . 0.545 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 78.5 m-70 -61.72 -34.48 75.87 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.194 0.521 . . . . 0.0 110.348 -178.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.489 ' O ' HD23 ' A' ' 19' ' ' LEU . 40.3 t90 -68.05 -61.44 1.86 Allowed 'General case' 0 N--CA 1.433 -1.287 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 174.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.492 HD11 ' CG ' ' A' ' 28' ' ' PHE . 46.9 mt -45.43 -51.75 11.03 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.67 1.188 . . . . 0.0 112.676 -177.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 13' ' ' SER . 93.1 t -59.5 -31.51 46.84 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.261 -177.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.7 -35.9 86.57 Favored Glycine 0 N--CA 1.438 -1.229 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.342 -176.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.489 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.5 OUTLIER -100.19 20.54 14.43 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 121.297 -0.161 . . . . 0.0 111.414 -179.214 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.5 m 68.43 20.3 8.58 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-O 121.638 0.732 . . . . 0.0 111.679 178.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.454 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -102.33 20.91 16.0 Favored 'General case' 0 C--N 1.294 -1.828 0 C-N-CA 123.961 0.904 . . . . 0.0 110.15 -178.745 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.43 ' HA ' HG23 ' A' ' 25' ' ' VAL . 5.9 p-10 -52.8 -24.33 8.7 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.533 0.733 . . . . 0.0 110.964 174.07 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -60.68 -25.14 66.15 Favored 'General case' 0 C--N 1.301 -1.502 0 C-N-CA 125.338 1.455 . . . . 0.0 111.692 176.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.556 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 3.9 m-85 -89.17 -20.24 24.47 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.43 HG23 ' HA ' ' A' ' 22' ' ' ASP . 88.5 t -54.15 -38.58 39.13 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 O-C-N 123.553 0.533 . . . . 0.0 111.95 -179.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.2 m -52.1 -37.25 53.42 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.505 0.722 . . . . 0.0 112.324 -177.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 12.9 tp10 -105.18 -30.11 9.91 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.431 -178.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.492 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.4 m-85 -54.74 -42.97 72.26 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.177 0.513 . . . . 0.0 110.894 177.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.9 m -73.57 -25.17 60.24 Favored 'General case' 0 N--CA 1.435 -1.221 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.531 -179.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -76.22 -33.39 59.22 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.482 -175.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -95.95 7.27 46.83 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 119.825 -0.75 . . . . 0.0 110.073 -179.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 60.29 37.11 20.55 Favored 'General case' 0 CA--C 1.505 -0.752 0 O-C-N 123.861 0.726 . . . . 0.0 109.569 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 50.0 mm -68.5 113.62 4.47 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 179.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.52 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 99.0 p -104.74 -170.74 1.81 Allowed 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 178.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.478 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.47 -28.26 70.89 Favored Glycine 0 C--O 1.224 -0.522 0 N-CA-C 110.895 -0.882 . . . . 0.0 110.895 179.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -54.64 -44.89 73.59 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 125.027 1.331 . . . . 0.0 110.282 177.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.78 -1.07 50.48 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.9 tt -84.07 -43.03 15.49 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 9.4 mt -58.82 -40.43 84.1 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.542 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -100.96 18.25 20.14 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -175.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.477 HD23 ' HD3' ' A' ' 45' ' ' LYS . 40.5 mt -53.74 146.67 13.12 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 178.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -153.08 172.33 17.04 Favored 'General case' 0 C--N 1.297 -1.674 0 N-CA-C 106.592 -1.632 . . . . 0.0 106.592 178.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -57.64 -30.92 62.99 Favored Glycine 0 CA--C 1.481 -2.076 0 N-CA-C 111.29 -0.724 . . . . 0.0 111.29 177.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -53.36 -47.44 69.41 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.477 ' HD3' HD23 ' A' ' 41' ' ' LEU . 14.5 mtpp -72.73 -43.96 62.3 Favored 'General case' 0 C--O 1.186 -2.255 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.378 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 91.8 mt -55.55 -37.55 68.14 Favored 'General case' 0 N--CA 1.485 1.317 0 CA-C-O 122.142 0.972 . . . . 0.0 110.835 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.798 ' HA ' HG22 ' A' ' 52' ' ' THR . 41.4 mttm -71.49 -38.73 71.16 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 114.867 -1.061 . . . . 0.0 111.106 175.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.51 -13.04 60.35 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.475 0.655 . . . . 0.0 111.357 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.47 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.0 mm? -84.09 -1.78 55.54 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 174.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 69.84 6.57 56.43 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 115.516 -0.765 . . . . 0.0 114.956 174.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.556 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 13.5 tpt -85.34 -50.92 6.93 Favored 'General case' 0 CA--C 1.494 -1.183 0 C-N-CA 118.708 -1.197 . . . . 0.0 108.007 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.798 HG22 ' HA ' ' A' ' 47' ' ' LYS . 68.5 p 54.07 28.94 9.46 Favored 'General case' 0 C--O 1.25 1.091 0 C-N-CA 125.007 1.323 . . . . 0.0 113.252 170.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.573 ' HB2' ' OD1' ' A' ' 56' ' ' ASP . 58.5 m -72.99 -166.43 0.3 Allowed 'General case' 0 N--CA 1.425 -1.695 0 C-N-CA 123.228 0.611 . . . . 0.0 112.158 -176.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.0 t -117.93 -38.57 3.22 Favored 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 121.802 -0.561 . . . . 0.0 111.13 -177.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -72.94 -32.43 65.25 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-O 121.312 0.577 . . . . 0.0 110.99 -175.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.684 ' O ' HG12 ' A' ' 60' ' ' VAL . 10.4 p-10 -70.85 -40.31 72.43 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 -176.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.9 mmm180 -57.98 -14.7 6.93 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 125.161 1.384 . . . . 0.0 112.203 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -106.02 -38.39 6.33 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.396 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.431 HD12 HD12 ' A' ' 19' ' ' LEU . 0.8 OUTLIER -75.3 -63.09 1.35 Allowed 'General case' 0 C--O 1.243 0.745 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.467 -176.17 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.684 HG12 ' O ' ' A' ' 56' ' ' ASP . 11.8 p -62.98 -24.39 35.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 122.083 0.944 . . . . 0.0 109.977 -174.204 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 51.8 tptt -68.87 -28.24 66.53 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 113.893 -1.503 . . . . 0.0 110.088 -175.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -89.98 -32.79 16.63 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.508 179.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.11 -39.89 60.32 Favored 'General case' 0 C--N 1.294 -1.843 0 CA-C-N 114.95 -1.023 . . . . 0.0 112.049 -177.06 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.1 pp -65.41 -28.31 69.16 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.184 0.516 . . . . 0.0 110.977 -176.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -83.81 -10.76 57.83 Favored 'General case' 0 C--N 1.316 -0.885 0 C-N-CA 120.665 -0.414 . . . . 0.0 111.894 -178.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -112.93 -9.54 13.61 Favored 'General case' 0 CA--C 1.489 -1.384 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.632 ' SD ' HG11 ' A' ' 4' ' ' VAL . 7.1 tmm? -54.04 -37.35 64.05 Favored 'General case' 0 C--N 1.296 -1.736 0 C-N-CA 127.209 2.204 . . . . 0.0 109.515 -174.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.503 ' HA ' HD23 ' A' ' 71' ' ' LEU . 22.1 pttp -62.92 -17.38 61.72 Favored 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 114.532 -1.213 . . . . 0.0 114.201 178.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 27.0 ptm -115.51 -23.23 8.89 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 108.914 -0.772 . . . . 0.0 108.914 173.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 49.1 m -81.02 -27.91 35.64 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.758 -176.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.503 HD23 ' HA ' ' A' ' 68' ' ' LYS . 4.1 pp -59.71 -31.0 69.2 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.795 0.807 . . . . 0.0 110.555 176.673 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -67.99 -33.06 73.9 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.202 -178.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -83.87 -13.57 53.29 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.215 -176.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.261 1.67 0 C-N-CA 125.123 1.369 . . . . 0.0 112.349 178.472 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.69 0 N-CA-C 111.773 -0.531 . . . . 0.0 111.773 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 42.3 p-80 -96.07 -7.55 35.84 Favored 'General case' 0 C--N 1.321 -0.642 0 O-C-N 122.899 -0.177 . . . . 0.0 111.3 -175.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.428 ' HB2' ' CE1' ' A' ' 5' ' ' HIS . 58.6 mtt -73.8 169.79 16.66 Favored 'General case' 0 N--CA 1.437 -1.077 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -172.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.513 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 4.4 m -68.07 -28.3 40.57 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.049 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 -167.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.428 ' CE1' ' HB2' ' A' ' 3' ' ' MET . 9.6 p-80 -67.79 -17.93 64.69 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 120.977 0.418 . . . . 0.0 110.775 179.403 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -91.6 -12.36 34.52 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 123.224 0.61 . . . . 0.0 110.117 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.491 ' O ' ' HB2' ' A' ' 34' ' ' SER . 51.4 m0 -65.84 140.17 58.36 Favored 'General case' 0 CA--C 1.494 -1.206 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.33 -178.279 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.52 -89.28 0.16 Allowed 'General case' 0 N--CA 1.412 -2.333 0 CA-C-N 114.992 -1.004 . . . . 0.0 111.501 -178.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.537 ' O ' HG12 ' A' ' 12' ' ' VAL . 91.9 t -137.36 -59.88 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.284 -2.254 0 CA-C-N 114.2 -1.364 . . . . 0.0 108.145 -177.376 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -71.85 -14.73 62.04 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-O 121.246 0.546 . . . . 0.0 111.697 -178.168 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.535 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 47.2 mt-30 -78.68 -22.67 46.41 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.109 176.609 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.537 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.4 p -75.28 -27.02 19.11 Favored 'Isoleucine or valine' 0 C--O 1.244 0.781 0 CA-C-O 121.761 0.791 . . . . 0.0 109.029 -177.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.2 -29.21 67.13 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 114.823 -1.08 . . . . 0.0 110.574 -178.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . 0.535 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 67.4 m-70 -60.19 -36.38 77.5 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.517 ' O ' HD23 ' A' ' 19' ' ' LEU . 37.6 t90 -69.41 -61.21 1.88 Allowed 'General case' 0 N--CA 1.426 -1.632 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.564 176.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.42 HD11 ' CD2' ' A' ' 28' ' ' PHE . 32.6 mt -47.53 -50.9 22.45 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.137 0.975 . . . . 0.0 112.466 -176.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.5 t -60.85 -28.74 43.89 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 C-N-CA 122.311 0.244 . . . . 0.0 111.092 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -72.37 -23.16 78.4 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 116.177 -0.465 . . . . 0.0 112.147 -176.065 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.517 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -110.55 19.59 18.56 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 121.009 -0.276 . . . . 0.0 110.933 176.623 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.4 m 66.81 24.42 9.83 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.384 0.673 . . . . 0.0 112.139 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.468 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -99.72 19.81 15.25 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 124.978 1.311 . . . . 0.0 108.836 -179.02 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -52.6 -28.41 21.05 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 124.228 1.011 . . . . 0.0 111.773 176.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.468 ' NE2' ' HA ' ' A' ' 21' ' ' LEU . 0.4 OUTLIER -70.23 -14.67 62.72 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 120.071 -0.652 . . . . 0.0 112.468 177.901 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.427 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 2.3 m-85 -88.53 -20.69 24.76 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.114 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 96.8 t -58.0 -34.19 48.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.344 178.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.7 m -48.41 -42.11 31.11 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.701 1.2 . . . . 0.0 111.457 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 10.9 tp10 -106.52 -29.62 9.56 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.569 -177.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.42 ' CD2' HD11 ' A' ' 16' ' ' LEU . 1.9 m-85 -55.0 -42.2 72.23 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-O 121.524 0.678 . . . . 0.0 110.316 176.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.417 ' HA ' HG13 ' A' ' 9' ' ' VAL . 39.7 t -71.96 -24.68 61.64 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.158 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -80.13 -31.37 39.09 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.531 -174.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -99.1 3.47 46.68 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 119.734 -0.787 . . . . 0.0 110.266 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 60.46 41.37 15.98 Favored 'General case' 0 C--O 1.243 0.743 0 O-C-N 123.881 0.738 . . . . 0.0 109.398 -179.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 42.7 mm -70.4 108.79 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.097 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.491 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 80.7 p -100.57 -170.43 1.86 Allowed 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 108.496 -0.928 . . . . 0.0 108.496 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.513 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -61.49 -27.05 67.3 Favored Glycine 0 N--CA 1.448 -0.552 0 N-CA-C 111.468 -0.653 . . . . 0.0 111.468 178.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -56.27 -43.94 79.27 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 124.548 1.139 . . . . 0.0 109.598 177.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.63 -5.5 35.29 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.427 -179.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.494 HD12 HG23 ' A' ' 12' ' ' VAL . 3.4 tt -78.78 -49.65 12.65 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 124.368 1.067 . . . . 0.0 108.86 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.416 HD21 HG21 ' A' ' 4' ' ' VAL . 54.7 mt -59.54 -35.83 74.96 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.698 -178.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.436 HE22 ' HD2' ' A' ' 45' ' ' LYS . 4.6 pp0? -97.01 11.77 34.92 Favored 'General case' 0 C--N 1.297 -1.699 0 CA-C-N 115.348 -0.842 . . . . 0.0 112.955 -176.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.405 ' CB ' HD22 ' A' ' 64' ' ' LEU . 41.3 mt -54.64 154.96 4.46 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 178.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -157.73 168.91 25.89 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 -178.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.81 -36.96 67.49 Favored Glycine 0 CA--C 1.496 -1.124 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -54.47 -46.57 73.4 Favored 'General case' 0 CA--C 1.5 -0.973 0 C-N-CA 122.965 0.506 . . . . 0.0 111.988 178.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.436 ' HD2' HE22 ' A' ' 40' ' ' GLN . 11.8 mtpp -66.48 -45.78 78.49 Favored 'General case' 0 C--O 1.195 -1.791 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.993 175.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 82.2 mt -59.6 -24.98 64.25 Favored 'General case' 0 C--O 1.254 1.319 0 C-N-CA 123.192 0.597 . . . . 0.0 111.954 -178.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.673 ' HA ' HG22 ' A' ' 52' ' ' THR . 23.4 mtpp -81.19 -31.2 34.1 Favored 'General case' 0 N--CA 1.437 -1.105 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.391 176.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.28 -4.73 57.74 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 123.253 0.621 . . . . 0.0 111.205 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.456 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.5 mm? -85.01 -3.89 58.95 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 173.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.18 -8.13 7.07 Favored Glycine 0 C--N 1.333 0.369 0 CA-C-N 115.708 -0.678 . . . . 0.0 113.842 176.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.427 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 4.9 tpt -77.69 -48.28 17.12 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.673 HG22 ' HA ' ' A' ' 47' ' ' LYS . 67.9 p 52.3 26.31 3.96 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.323 1.449 . . . . 0.0 113.1 174.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.44 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 45.2 t -66.66 117.5 8.91 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 120.909 0.385 . . . . 0.0 110.994 -175.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.1 m -61.6 -39.18 90.28 Favored 'General case' 0 C--O 1.248 1.008 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.262 -176.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -68.37 -45.31 73.1 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.145 179.241 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.567 ' O ' HG12 ' A' ' 60' ' ' VAL . 36.5 m-20 -71.18 -40.46 71.22 Favored 'General case' 0 CA--C 1.487 -1.462 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.488 -177.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.504 ' HA ' HG12 ' A' ' 60' ' ' VAL . 31.0 mtm180 -60.72 -31.44 70.74 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -78.46 -2.56 39.12 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.138 0.494 . . . . 0.0 110.88 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 40.5 tp -115.64 -47.99 2.79 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 120.96 0.409 . . . . 0.0 110.968 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.567 HG12 ' O ' ' A' ' 56' ' ' ASP . 5.2 p -60.4 -27.23 39.4 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.209 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.817 178.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -68.16 -36.45 79.65 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 122.005 0.907 . . . . 0.0 109.269 -175.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.414 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 23.8 ttmm -77.99 -41.81 34.72 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 113.724 -1.58 . . . . 0.0 108.776 -177.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.478 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.5 OUTLIER -69.67 -41.97 74.79 Favored 'General case' 0 C--O 1.186 -2.266 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.61 -177.65 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.405 HD22 ' CB ' ' A' ' 41' ' ' LEU . 3.2 pp -65.63 -30.88 71.65 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 120.828 0.347 . . . . 0.0 111.411 -176.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -81.79 -18.91 42.43 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.162 -0.615 . . . . 0.0 111.307 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.419 ' O ' ' HG2' ' A' ' 69' ' ' MET . 11.6 pt-20 -103.28 -15.76 15.87 Favored 'General case' 0 C--O 1.212 -0.883 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.356 177.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.468 ' HB3' ' O ' ' A' ' 63' ' ' LYS . 2.1 ppp? -60.66 -33.69 73.19 Favored 'General case' 0 C--O 1.194 -1.85 0 CA-C-O 121.2 0.524 . . . . 0.0 109.777 -175.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -70.33 -13.07 62.0 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.733 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 66' ' ' GLU . 23.2 ptp -120.8 5.4 10.49 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 177.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.4 t -121.11 -33.53 3.69 Favored 'General case' 0 C--O 1.191 -2.018 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.486 -176.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.465 ' HG ' HG13 ' A' ' 4' ' ' VAL . 0.0 OUTLIER -46.35 -36.39 6.34 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 114.363 1.245 . . . . 0.0 114.363 -171.475 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -75.16 -50.57 15.88 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 121.618 0.723 . . . . 0.0 111.582 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -86.12 -34.57 20.58 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.65 -167.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.419 -1.994 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 -176.852 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.914 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 38.0 p-80 -147.88 -16.09 0.36 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 117.152 0.476 . . . . 0.0 110.666 -179.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.415 ' HA ' HD13 ' A' ' 71' ' ' LEU . 66.1 mtt -77.49 162.17 27.36 Favored 'General case' 0 N--CA 1.438 -1.063 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 -175.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.601 HG12 ' CH2' ' A' ' 7' ' ' TRP . 9.4 m -61.41 -37.26 77.3 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.523 0 CA-C-O 121.133 0.492 . . . . 0.0 112.316 -171.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.1 p-80 -70.91 -9.59 58.06 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.382 -177.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -102.73 -0.82 31.04 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.487 179.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.601 ' CH2' HG12 ' A' ' 4' ' ' VAL . 54.5 m0 -79.5 149.82 31.37 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.098 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.9 m -102.1 -79.49 0.52 Allowed 'General case' 0 N--CA 1.419 -2.023 0 O-C-N 123.469 0.481 . . . . 0.0 109.779 -177.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.483 ' O ' HG12 ' A' ' 12' ' ' VAL . 57.9 t -139.38 -60.46 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.432 HE21 ' HG3' ' A' ' 11' ' ' GLN . 0.4 OUTLIER -75.3 5.19 5.9 Favored 'General case' 0 C--O 1.215 -0.76 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -176.37 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.527 HE21 ' HA ' ' A' ' 7' ' ' TRP . 25.9 mt-30 -103.62 -13.08 16.66 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.602 175.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.515 HG23 HD12 ' A' ' 38' ' ' LEU . 2.4 p -81.08 -24.46 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 CA-C-O 121.811 0.815 . . . . 0.0 109.406 -179.186 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.472 ' HB3' ' CG1' ' A' ' 25' ' ' VAL . 0.3 OUTLIER -67.61 -36.15 80.3 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.449 -178.557 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 80.9 m-70 -57.77 -32.15 67.21 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.084 0.469 . . . . 0.0 110.486 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.511 ' O ' HD23 ' A' ' 19' ' ' LEU . 30.2 t90 -72.83 -60.97 1.98 Allowed 'General case' 0 N--CA 1.426 -1.658 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.202 174.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.586 HD11 ' CD2' ' A' ' 28' ' ' PHE . 44.2 mt -47.04 -51.96 16.14 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.132 0.973 . . . . 0.0 112.656 -177.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 13' ' ' SER . 77.4 t -61.69 -24.75 34.95 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 C-N-CA 122.896 0.478 . . . . 0.0 111.0 -177.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.11 -34.92 54.49 Favored Glycine 0 N--CA 1.436 -1.31 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 -177.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.511 HD23 ' O ' ' A' ' 15' ' ' TRP . 1.2 pt? -97.83 16.03 22.0 Favored 'General case' 0 C--O 1.214 -0.802 0 C-N-CA 121.071 -0.252 . . . . 0.0 111.107 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.0 m 73.81 14.49 4.09 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.146 0.978 . . . . 0.0 112.156 178.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -93.16 21.97 5.47 Favored 'General case' 0 C--N 1.292 -1.895 0 C-N-CA 124.55 1.14 . . . . 0.0 108.928 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -51.75 -32.82 32.29 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 124.165 0.986 . . . . 0.0 110.554 174.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -63.12 -22.71 67.05 Favored 'General case' 0 CA--C 1.548 0.88 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.757 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -86.84 -22.37 25.84 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.76 -178.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.472 ' CG1' ' HB3' ' A' ' 13' ' ' SER . 35.0 t -57.8 -34.06 47.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 O-C-N 123.101 0.25 . . . . 0.0 110.518 179.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.1 t -51.0 -35.56 34.59 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.995 0.918 . . . . 0.0 111.487 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 19.2 tp10 -108.15 -32.43 7.52 Favored 'General case' 0 N--CA 1.432 -1.346 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.916 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.586 ' CD2' HD11 ' A' ' 16' ' ' LEU . 2.1 m-85 -53.95 -40.34 66.72 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-O 121.214 0.53 . . . . 0.0 110.793 175.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 33.7 t -73.23 -25.56 60.79 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.594 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.56 -34.1 53.87 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 121.965 -0.459 . . . . 0.0 110.909 -175.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 2.5 mt-30 -95.63 -3.29 46.53 Favored 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 120.397 -0.521 . . . . 0.0 109.98 -178.732 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.1 m-80 62.85 45.08 5.82 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 121.799 0.809 . . . . 0.0 109.139 -178.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.4 mm -68.87 110.29 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.195 0 CA-C-N 114.358 -1.292 . . . . 0.0 108.638 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.455 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 89.8 p -102.53 -169.26 1.64 Allowed 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.567 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -63.49 -22.46 65.76 Favored Glycine 0 N--CA 1.439 -1.117 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.955 177.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -59.29 -42.46 91.36 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 177.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.542 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -93.93 -22.29 18.69 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.813 -179.415 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.515 HD12 HG23 ' A' ' 12' ' ' VAL . 3.0 tt -62.51 -50.41 71.49 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 124.587 1.155 . . . . 0.0 109.65 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 67.8 mt -64.14 -38.51 91.31 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.235 -0.438 . . . . 0.0 112.128 -177.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -96.23 11.05 35.9 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -177.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.572 ' HB2' HD22 ' A' ' 64' ' ' LEU . 29.0 mt -50.5 136.61 20.62 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 122.322 1.058 . . . . 0.0 113.444 178.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -137.5 165.56 25.99 Favored 'General case' 0 C--N 1.285 -2.231 0 N-CA-C 107.34 -1.355 . . . . 0.0 107.34 -179.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -53.46 -39.46 59.87 Favored Glycine 0 C--O 1.212 -1.232 0 O-C-N 123.732 0.645 . . . . 0.0 111.774 178.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -53.01 -44.72 67.51 Favored 'General case' 0 CA--C 1.496 -1.111 0 C-N-CA 122.669 0.387 . . . . 0.0 111.23 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.415 ' HE3' ' HB3' ' A' ' 45' ' ' LYS . 11.4 mtpp -67.83 -50.05 58.81 Favored 'General case' 0 C--O 1.201 -1.48 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.664 178.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.8 mt -56.88 -31.12 64.53 Favored 'General case' 0 C--O 1.256 1.441 0 C-N-CA 123.645 0.778 . . . . 0.0 112.072 -177.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.755 ' HA ' HG22 ' A' ' 52' ' ' THR . 57.0 mtpt -80.08 -37.81 33.02 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.981 178.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.85 -15.4 62.64 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 122.99 0.516 . . . . 0.0 111.218 178.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.437 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.3 mm? -72.47 -4.78 32.39 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.245 0.618 . . . . 0.0 110.143 173.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 71.02 20.28 77.75 Favored Glycine 0 CA--C 1.501 -0.815 0 CA-C-N 116.416 -0.356 . . . . 0.0 112.524 177.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 23.2 mmt -105.71 -63.81 1.21 Allowed 'General case' 0 C--N 1.304 -1.389 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.795 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.755 HG22 ' HA ' ' A' ' 47' ' ' LYS . 20.2 p 64.15 13.33 7.75 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.697 1.599 . . . . 0.0 113.301 173.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.6 m -58.92 122.48 13.75 Favored 'General case' 0 N--CA 1.433 -1.314 0 C-N-CA 123.914 0.886 . . . . 0.0 111.143 -176.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.8 m -55.53 -35.13 65.33 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 -174.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -79.87 -33.7 39.85 Favored 'General case' 0 CA--C 1.497 -1.064 0 C-N-CA 119.255 -0.978 . . . . 0.0 111.207 -178.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.694 ' O ' HG12 ' A' ' 60' ' ' VAL . 1.7 m-20 -68.35 -44.9 74.25 Favored 'General case' 0 CA--C 1.477 -1.828 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -50.21 -29.4 9.33 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 124.75 1.22 . . . . 0.0 113.168 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -98.0 -37.5 9.75 Favored 'General case' 0 C--N 1.307 -1.279 0 O-C-N 123.578 0.549 . . . . 0.0 111.134 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 43.0 tp -74.4 -51.54 14.69 Favored 'General case' 0 C--O 1.243 0.715 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -175.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.694 HG12 ' O ' ' A' ' 56' ' ' ASP . 10.7 p -62.51 -24.62 35.78 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.986 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -179.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.426 ' HA ' ' CD2' ' A' ' 64' ' ' LEU . 56.5 tptt -73.57 -27.07 61.13 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.971 -1.468 . . . . 0.0 110.054 -173.394 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -88.41 -37.03 16.2 Favored 'General case' 0 C--N 1.291 -1.937 0 CA-C-N 114.956 -1.02 . . . . 0.0 108.834 178.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.438 ' HG2' HD13 ' A' ' 19' ' ' LEU . 2.6 tppt? -69.33 -41.33 76.8 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.165 -177.314 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.572 HD22 ' HB2' ' A' ' 41' ' ' LEU . 4.1 pp -64.42 -30.93 71.96 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 122.919 0.488 . . . . 0.0 112.263 -177.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -82.44 -27.24 32.06 Favored 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 119.784 -0.766 . . . . 0.0 111.642 -178.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -95.34 1.32 54.31 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.529 -0.468 . . . . 0.0 109.826 178.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.489 ' HA ' ' CE ' ' A' ' 67' ' ' MET . 0.0 OUTLIER -53.67 -38.75 64.49 Favored 'General case' 0 C--O 1.189 -2.116 0 CA-C-O 121.653 0.739 . . . . 0.0 111.057 178.382 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.431 ' H ' ' HG2' ' A' ' 68' ' ' LYS . 45.9 pttt -79.46 2.08 23.19 Favored 'General case' 0 C--N 1.272 -2.771 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -174.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 23.0 ptp -128.33 5.13 5.74 Favored 'General case' 0 C--N 1.286 -2.156 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 174.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.6 t -143.4 -6.89 0.8 Allowed 'General case' 0 N--CA 1.441 -0.922 0 C-N-CA 119.507 -0.877 . . . . 0.0 112.591 -175.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.533 HD12 ' N ' ' A' ' 72' ' ' GLU . 4.4 pp -50.99 -35.98 36.78 Favored 'General case' 0 CA--C 1.503 -0.849 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.533 ' N ' HD12 ' A' ' 71' ' ' LEU . 20.9 tt0 -68.68 -45.04 72.74 Favored 'General case' 0 C--N 1.301 -1.504 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.925 178.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -89.4 -58.97 2.34 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -170.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.236 -0.887 . . . . 0.0 108.639 -174.638 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.376 0 N-CA-C 112.098 -0.401 . . . . 0.0 112.098 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 41.9 p-80 -95.05 -12.04 27.29 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 111.616 0.228 . . . . 0.0 111.616 -174.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.465 ' O ' ' HB2' ' A' ' 6' ' ' GLU . 59.2 mtt -68.74 164.81 20.91 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 -174.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.5 HG13 ' HG ' ' A' ' 71' ' ' LEU . 4.2 m -72.61 -29.5 30.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -170.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 9.3 p-80 -71.44 -9.8 58.75 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.527 0.68 . . . . 0.0 110.444 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' A' ' 3' ' ' MET . 12.9 mm-40 -93.09 -10.3 36.49 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.94 179.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 54.8 m0 -80.98 146.94 30.45 Favored 'General case' 0 CA--C 1.498 -1.045 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 70.2 m -104.62 -73.83 0.66 Allowed 'General case' 0 N--CA 1.413 -2.289 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.488 ' O ' HG12 ' A' ' 12' ' ' VAL . 55.6 t -140.79 -50.31 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.096 0 CA-C-O 121.918 0.866 . . . . 0.0 110.497 -174.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -75.61 -21.74 57.5 Favored 'General case' 0 C--N 1.282 -2.336 0 CA-C-N 114.503 -1.226 . . . . 0.0 111.348 -177.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.493 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 27.1 mt-30 -91.94 -11.42 36.27 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -176.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 9' ' ' VAL . 3.8 p -74.36 -25.83 19.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 CA-C-O 122.026 0.917 . . . . 0.0 108.545 178.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.44 ' HA ' HD12 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -69.76 -28.95 66.19 Favored 'General case' 0 N--CA 1.427 -1.583 0 CA-C-N 114.505 -1.225 . . . . 0.0 111.519 -176.139 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . 0.493 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 37.8 m-70 -63.61 -32.51 74.0 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.946 0.403 . . . . 0.0 110.15 -177.403 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.487 ' O ' HD23 ' A' ' 19' ' ' LEU . 27.5 t90 -69.41 -58.49 3.93 Favored 'General case' 0 N--CA 1.436 -1.147 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.46 175.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.461 HD11 ' CD2' ' A' ' 28' ' ' PHE . 48.3 mt -46.84 -50.39 18.57 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.307 1.043 . . . . 0.0 112.539 -177.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.0 t -60.2 -30.19 45.46 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.1 0 CA-C-O 120.822 0.344 . . . . 0.0 111.135 -178.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.01 -27.04 74.27 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 116.027 -0.533 . . . . 0.0 112.148 -176.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.487 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -107.28 15.93 24.52 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 178.845 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.5 m 70.64 25.62 4.09 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-O 121.694 0.759 . . . . 0.0 111.589 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.406 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.2 mm? -102.74 19.46 19.17 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 124.828 1.251 . . . . 0.0 110.516 -179.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -51.92 -30.6 25.03 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.214 0.531 . . . . 0.0 111.243 175.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -58.74 -23.13 59.36 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.87 0.868 . . . . 0.0 111.84 177.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -88.45 -22.98 23.4 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 94.8 t -54.44 -36.39 34.29 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 CA-C-O 120.885 0.374 . . . . 0.0 110.889 -178.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 22.7 t -46.62 -40.98 13.93 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.585 1.554 . . . . 0.0 111.649 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 39.2 tp10 -108.17 -28.93 9.2 Favored 'General case' 0 N--CA 1.438 -1.027 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.676 -179.024 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.461 ' CD2' HD11 ' A' ' 16' ' ' LEU . 1.1 m-85 -54.39 -46.1 73.02 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-O 121.432 0.634 . . . . 0.0 110.775 177.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 41.3 m -83.43 -6.33 59.43 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.038 -178.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.93 -37.14 20.89 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -91.4 0.79 57.46 Favored 'General case' 0 CA--C 1.506 -0.725 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.223 -178.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 66.17 38.64 4.57 Favored 'General case' 0 CA--C 1.512 -0.507 0 O-C-N 124.059 0.849 . . . . 0.0 109.731 -178.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.3 mm -67.75 116.06 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 178.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 90.8 p -105.94 -166.71 1.23 Allowed 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.465 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -63.35 -25.02 68.06 Favored Glycine 0 N--CA 1.439 -1.154 0 N-CA-C 110.956 -0.858 . . . . 0.0 110.956 177.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -56.65 -45.98 81.3 Favored 'General case' 0 CA--C 1.508 -0.635 0 C-N-CA 123.474 0.71 . . . . 0.0 109.786 177.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.573 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -92.61 -14.85 27.62 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.925 -177.485 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.437 HD12 HG23 ' A' ' 12' ' ' VAL . 3.7 tt -69.2 -50.41 47.65 Favored 'General case' 0 C--N 1.311 -1.076 0 O-C-N 123.955 0.784 . . . . 0.0 109.092 179.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 37.8 mt -63.92 -42.71 97.32 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.454 -177.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.434 HE21 ' HA ' ' A' ' 37' ' ' GLN . 5.1 pp0? -91.8 14.97 13.9 Favored 'General case' 0 CA--C 1.564 1.519 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -176.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' A' ' 37' ' ' GLN . 35.4 mt -57.01 158.42 4.98 Favored 'General case' 0 C--O 1.246 0.909 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 176.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.417 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 3.1 p-10 -165.4 -178.67 5.1 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 177.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.81 -41.28 83.09 Favored Glycine 0 C--O 1.214 -1.154 0 CA-C-O 119.256 -0.747 . . . . 0.0 113.464 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -55.63 -46.09 77.47 Favored 'General case' 0 CA--C 1.485 -1.521 0 CA-C-N 117.355 0.578 . . . . 0.0 111.376 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.465 ' HD3' HD23 ' A' ' 41' ' ' LEU . 14.5 mtpp -66.12 -45.67 80.27 Favored 'General case' 0 C--O 1.198 -1.652 0 O-C-N 123.522 0.514 . . . . 0.0 110.724 177.2 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 92.2 mt -60.85 -24.1 65.64 Favored 'General case' 0 C--O 1.258 1.548 0 CA-C-O 121.391 0.615 . . . . 0.0 111.601 -178.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.735 ' HA ' HG22 ' A' ' 52' ' ' THR . 58.1 mtpt -85.16 -39.54 17.75 Favored 'General case' 0 N--CA 1.433 -1.285 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.044 176.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.23 -14.15 61.28 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.744 0.783 . . . . 0.0 110.956 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.553 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 3.6 mm? -75.74 3.27 10.13 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.296 172.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 63.75 19.22 62.71 Favored Glycine 0 C--N 1.342 0.891 0 CA-C-O 121.283 0.38 . . . . 0.0 112.506 177.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 23.1 mmt -103.57 -63.1 1.22 Allowed 'General case' 0 N--CA 1.421 -1.921 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -176.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.735 HG22 ' HA ' ' A' ' 47' ' ' LYS . 29.5 p 57.64 22.25 8.09 Favored 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 124.447 1.099 . . . . 0.0 112.24 176.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 35.6 t -61.08 118.74 7.17 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 124.47 1.108 . . . . 0.0 111.248 -174.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.9 m -53.29 -41.24 65.41 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 124.414 1.086 . . . . 0.0 113.609 -176.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -65.77 -51.91 55.29 Favored 'General case' 0 CA--C 1.5 -0.945 0 CA-C-O 122.295 1.045 . . . . 0.0 109.922 177.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.674 ' O ' HG12 ' A' ' 60' ' ' VAL . 63.7 m-20 -66.66 -35.92 81.32 Favored 'General case' 0 N--CA 1.419 -2.013 0 CA-C-N 113.734 -1.575 . . . . 0.0 111.364 -170.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.7 mmm180 -58.53 -14.68 8.6 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 175.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -107.56 -35.57 6.7 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-O 120.656 0.265 . . . . 0.0 110.965 174.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 48.8 tp -81.14 -57.57 3.45 Favored 'General case' 0 C--O 1.241 0.612 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -176.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.674 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.7 p -61.31 -21.03 23.94 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.801 0 CA-C-O 121.535 0.683 . . . . 0.0 110.31 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.455 ' HD2' HD21 ' A' ' 64' ' ' LEU . 0.9 OUTLIER -70.22 -26.17 63.74 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.579 -179.689 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.492 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 51.5 tttp -86.98 -40.58 14.63 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 114.939 -1.028 . . . . 0.0 108.828 178.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.486 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.6 OUTLIER -69.76 -43.63 71.83 Favored 'General case' 0 C--O 1.19 -2.065 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.801 -175.054 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.455 HD21 ' HD2' ' A' ' 61' ' ' LYS . 3.7 pp -61.58 -30.03 70.41 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.028 0.442 . . . . 0.0 111.805 -175.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 53.7 pttt -84.98 -18.97 32.85 Favored 'General case' 0 C--N 1.315 -0.93 0 C-N-CA 119.675 -0.81 . . . . 0.0 112.504 -178.083 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 12.0 pt-20 -111.65 -3.54 15.02 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-O 121.169 0.509 . . . . 0.0 111.116 178.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.457 ' HB3' ' O ' ' A' ' 63' ' ' LYS . 2.6 ppp? -66.41 -28.55 68.71 Favored 'General case' 0 C--O 1.202 -1.435 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -179.264 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -70.76 -9.5 57.49 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.943 178.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 48.6 mtp -109.93 -18.49 13.38 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.433 175.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 23.1 t -103.34 -26.11 13.05 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -171.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.5 ' HG ' HG13 ' A' ' 4' ' ' VAL . 0.0 OUTLIER -53.5 -33.33 53.97 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -175.03 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -68.01 -37.19 81.14 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 121.514 0.673 . . . . 0.0 110.795 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -85.7 -22.18 27.96 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 114.92 -1.036 . . . . 0.0 109.992 -170.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.483 0 C-N-CA 125.414 1.485 . . . . 0.0 111.588 178.445 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.618 0 N-CA-C 110.764 -0.934 . . . . 0.0 110.764 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.1 p80 -168.15 10.86 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.911 0.386 . . . . 0.0 110.428 -176.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 62.9 mtt -84.27 168.44 15.68 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 120.656 0.265 . . . . 0.0 111.106 -171.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.557 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.5 m -67.4 -29.79 46.84 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.003 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 -169.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -72.89 -4.54 32.57 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-O 121.445 0.64 . . . . 0.0 110.828 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -103.36 -2.47 26.98 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.291 178.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.618 ' HA ' HE21 ' A' ' 11' ' ' GLN . 53.2 m0 -83.19 136.99 34.22 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.327 -177.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.7 m -90.69 -72.88 0.55 Allowed 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.899 -176.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.45 ' O ' HG12 ' A' ' 12' ' ' VAL . 79.4 t -143.56 -65.91 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.199 -1.564 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 -179.476 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 -66.91 -17.92 65.13 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.153 0.501 . . . . 0.0 112.349 -175.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.618 HE21 ' HA ' ' A' ' 7' ' ' TRP . 27.1 mt-30 -81.05 -17.75 49.09 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.98 178.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.495 ' HA ' ' CE3' ' A' ' 7' ' ' TRP . 2.2 p -69.45 -24.95 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-O 121.912 0.863 . . . . 0.0 109.47 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.415 ' HA ' HD12 ' A' ' 16' ' ' LEU . 1.0 OUTLIER -70.58 -23.87 62.67 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-N 114.609 -1.178 . . . . 0.0 111.449 -176.881 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 51.5 m-70 -62.19 -39.19 91.89 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 110.285 -0.265 . . . . 0.0 110.285 -178.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.498 ' O ' HD23 ' A' ' 19' ' ' LEU . 32.6 t90 -67.91 -58.29 4.8 Favored 'General case' 0 N--CA 1.44 -0.94 0 O-C-N 123.816 0.697 . . . . 0.0 109.827 176.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.539 HD11 ' CD2' ' A' ' 28' ' ' PHE . 43.9 mt -47.1 -50.17 20.48 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.141 0.976 . . . . 0.0 112.511 -177.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 86.1 t -61.5 -26.38 39.36 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.076 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.463 -178.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.76 -26.09 68.06 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 116.33 -0.396 . . . . 0.0 112.197 -177.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.498 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -105.6 13.68 29.59 Favored 'General case' 0 C--N 1.321 -0.666 0 O-C-N 122.405 -0.467 . . . . 0.0 111.349 177.89 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.6 m 70.74 21.45 5.24 Favored 'General case' 0 C--O 1.211 -0.94 0 CA-C-O 121.866 0.841 . . . . 0.0 111.611 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.412 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.9 mm? -98.52 19.8 13.91 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.984 178.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -53.04 -25.76 13.51 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.829 0.852 . . . . 0.0 111.163 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -69.63 -18.77 63.62 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 123.504 0.722 . . . . 0.0 110.723 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -85.92 -22.06 27.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.526 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 89.3 t -54.49 -37.98 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 O-C-N 123.633 0.583 . . . . 0.0 111.132 -179.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.3 m -52.31 -33.09 40.76 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.077 0.951 . . . . 0.0 112.296 -177.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 53.3 tp10 -111.63 -27.69 8.44 Favored 'General case' 0 N--CA 1.444 -0.732 0 O-C-N 122.358 -0.214 . . . . 0.0 110.802 179.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.539 ' CD2' HD11 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -56.68 -42.29 78.79 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 121.677 0.751 . . . . 0.0 109.884 175.138 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 31.0 t -73.73 -21.56 60.17 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.709 -1.132 . . . . 0.0 109.605 -179.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.54 -39.79 24.1 Favored 'General case' 0 N--CA 1.436 -1.132 0 O-C-N 121.905 -0.497 . . . . 0.0 110.907 -176.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -87.36 2.51 50.15 Favored 'General case' 0 CA--C 1.501 -0.94 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.182 -177.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 65.07 34.94 8.34 Favored 'General case' 0 CA--C 1.501 -0.922 0 O-C-N 124.322 1.014 . . . . 0.0 109.713 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.8 mm -66.32 112.41 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.529 0 CA-C-N 114.7 -1.136 . . . . 0.0 108.244 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.489 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 97.5 p -103.46 -170.33 1.77 Allowed 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 178.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.557 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.43 -30.04 75.15 Favored Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -51.7 -48.0 63.69 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 123.986 0.914 . . . . 0.0 110.02 175.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.09 -22.51 25.36 Favored 'General case' 0 CA--C 1.502 -0.894 0 C-N-CA 120.49 -0.484 . . . . 0.0 111.786 -177.197 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.4 tt -61.33 -48.63 80.44 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 124.84 1.256 . . . . 0.0 109.272 178.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 35' ' ' GLY . 28.2 mt -65.89 -39.61 90.79 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.604 -178.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -95.55 22.17 7.38 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -177.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.459 HD23 ' HD3' ' A' ' 45' ' ' LYS . 59.7 mt -64.04 158.85 21.5 Favored 'General case' 0 C--O 1.247 0.923 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 176.025 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.478 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 2.8 p30 -164.52 178.28 7.5 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 175.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.51 -38.35 70.27 Favored Glycine 0 C--O 1.218 -0.883 0 O-C-N 123.764 0.665 . . . . 0.0 113.898 -177.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -59.89 -42.56 94.06 Favored 'General case' 0 CA--C 1.483 -1.603 0 CA-C-N 117.39 0.595 . . . . 0.0 111.325 -178.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.459 ' HD3' HD23 ' A' ' 41' ' ' LEU . 11.6 mtpp -66.45 -45.01 81.25 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.929 178.127 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 78.3 mt -61.1 -25.28 66.86 Favored 'General case' 0 C--O 1.256 1.419 0 CA-C-O 121.599 0.714 . . . . 0.0 110.966 -179.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.814 ' HA ' HG22 ' A' ' 52' ' ' THR . 7.3 mtpm? -82.63 -41.39 19.51 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 114.782 -1.099 . . . . 0.0 110.297 176.016 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.73 -13.44 62.29 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.462 0.705 . . . . 0.0 111.396 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.493 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 3.9 mm? -75.33 -2.36 27.98 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.52 172.289 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 70.65 16.06 73.82 Favored Glycine 0 C--N 1.342 0.864 0 CA-C-O 121.774 0.652 . . . . 0.0 111.598 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 97.7 mmm -100.97 -67.58 0.85 Allowed 'General case' 0 N--CA 1.423 -1.821 0 CA-C-N 114.782 -0.709 . . . . 0.0 110.002 -176.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.814 HG22 ' HA ' ' A' ' 47' ' ' LYS . 20.9 p 65.64 -3.41 0.71 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.863 1.665 . . . . 0.0 113.938 175.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.6 m -50.75 121.39 5.82 Favored 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 126.665 1.986 . . . . 0.0 112.427 -173.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.1 p -54.31 -48.77 70.96 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -173.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -56.05 -50.06 72.02 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-O 121.844 0.83 . . . . 0.0 109.832 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.701 ' O ' HG12 ' A' ' 60' ' ' VAL . 4.8 m-20 -63.39 -47.95 79.91 Favored 'General case' 0 CA--C 1.486 -1.485 0 CA-C-N 113.874 -1.512 . . . . 0.0 109.622 -176.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 39.1 mmm-85 -49.05 -38.49 24.09 Favored 'General case' 0 CA--C 1.506 -0.721 0 C-N-CA 124.587 1.155 . . . . 0.0 112.44 -179.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -83.11 -33.74 26.25 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-O 121.197 0.523 . . . . 0.0 111.402 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.422 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 45.9 tp -80.36 -51.08 9.29 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -174.689 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.701 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.4 p -64.25 -21.26 28.61 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.217 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 4.9 tppp? -69.28 -35.95 76.57 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.149 -178.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.422 ' HG2' ' O ' ' A' ' 59' ' ' LEU . 19.1 ptmt -90.2 -18.75 25.15 Favored 'General case' 0 N--CA 1.419 -1.99 0 CA-C-N 115.089 -0.96 . . . . 0.0 109.507 -176.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.438 ' HG2' HD13 ' A' ' 19' ' ' LEU . 1.8 tppt? -84.56 -38.79 19.55 Favored 'General case' 0 C--O 1.199 -1.588 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.035 177.166 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.6 pp -66.42 -14.55 62.33 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.619 0.368 . . . . 0.0 111.731 -176.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 59.4 pttt -90.03 -12.99 36.94 Favored 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.477 176.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.501 ' O ' ' HG2' ' A' ' 69' ' ' MET . 11.7 pt-20 -135.02 18.93 3.45 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-O 123.041 1.4 . . . . 0.0 109.985 -176.544 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.524 ' SD ' ' N ' ' A' ' 67' ' ' MET . 0.0 OUTLIER -59.66 -20.68 57.79 Favored 'General case' 0 C--N 1.293 -1.869 0 C-N-CA 127.162 2.185 . . . . 0.0 110.245 178.246 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -68.33 -23.7 64.74 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.689 178.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.501 ' HG2' ' O ' ' A' ' 66' ' ' GLU . 23.0 ptp -102.42 -30.67 10.88 Favored 'General case' 0 C--O 1.248 0.983 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 174.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.428 ' HB2' ' HA ' ' A' ' 67' ' ' MET . 38.0 m -71.85 -27.18 62.71 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.655 -177.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.483 HD12 ' N ' ' A' ' 72' ' ' GLU . 4.5 pp -54.12 -33.61 58.21 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-O 121.419 0.628 . . . . 0.0 112.056 176.101 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.483 ' N ' HD12 ' A' ' 71' ' ' LEU . 18.7 tt0 -84.41 -44.61 13.55 Favored 'General case' 0 N--CA 1.4 -2.958 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.822 -175.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -80.32 -51.93 8.3 Favored 'General case' 0 N--CA 1.432 -1.329 0 C-N-CA 119.898 -0.721 . . . . 0.0 111.407 -172.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.257 1.489 0 C-N-CA 125.362 1.465 . . . . 0.0 112.702 179.399 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.056 0 N-CA-C 112.228 -0.349 . . . . 0.0 112.228 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -124.87 -29.3 3.39 Favored 'General case' 0 C--N 1.314 -0.955 0 O-C-N 122.521 -0.4 . . . . 0.0 110.352 -178.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.46 ' HB3' ' CE1' ' A' ' 5' ' ' HIS . 23.0 mmt -84.87 154.3 22.36 Favored 'General case' 0 N--CA 1.427 -1.596 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.682 HG13 HD22 ' A' ' 71' ' ' LEU . 6.8 m -74.09 -28.7 23.89 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.991 0 CA-C-N 116.03 -0.532 . . . . 0.0 112.311 -171.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.46 ' CE1' ' HB3' ' A' ' 3' ' ' MET . 20.5 p-80 -71.67 -12.8 61.51 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-O 120.97 0.414 . . . . 0.0 110.801 178.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -91.03 -19.43 23.2 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.625 177.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.448 ' CH2' HG12 ' A' ' 4' ' ' VAL . 50.7 m0 -58.36 145.38 38.39 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -174.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.4 m -95.43 -80.36 0.42 Allowed 'General case' 0 N--CA 1.415 -2.184 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.465 -175.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.513 ' O ' HG12 ' A' ' 12' ' ' VAL . 73.8 t -146.03 -61.85 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.554 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 -178.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.5 pm0 -67.34 -17.69 64.85 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.542 -177.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -80.02 -17.68 52.16 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.402 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.513 HG12 ' O ' ' A' ' 9' ' ' VAL . 2.6 p -74.27 -21.86 17.78 Favored 'Isoleucine or valine' 0 C--O 1.245 0.847 0 CA-C-O 121.908 0.861 . . . . 0.0 109.096 -177.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.87 -26.58 64.26 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.957 -177.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 -62.47 -32.59 73.51 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.332 0.587 . . . . 0.0 109.7 -177.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.483 ' CH2' HG23 ' A' ' 60' ' ' VAL . 28.4 t90 -74.24 -58.82 3.04 Favored 'General case' 0 N--CA 1.427 -1.591 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.473 175.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.439 HD11 ' CG ' ' A' ' 28' ' ' PHE . 38.8 mt -48.05 -48.85 32.97 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.261 1.024 . . . . 0.0 112.5 -176.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 77.2 t -60.5 -29.25 44.18 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 CA-C-O 120.769 0.319 . . . . 0.0 110.97 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -71.72 -22.2 78.74 Favored Glycine 0 N--CA 1.442 -0.952 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.406 -176.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.485 HD13 ' HG2' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -113.7 17.8 17.91 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 117.076 0.438 . . . . 0.0 111.716 177.791 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.5 m 68.84 20.82 7.87 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.699 0.8 . . . . 0.0 112.063 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.464 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.8 mm? -98.94 18.34 17.42 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.963 179.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.501 ' HA ' HG23 ' A' ' 25' ' ' VAL . 8.7 p-10 -52.34 -25.2 9.03 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.912 0.885 . . . . 0.0 111.216 175.284 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -64.47 -23.75 67.39 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 124.023 0.929 . . . . 0.0 111.373 178.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.501 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 3.0 m-85 -86.57 -20.79 27.43 Favored 'General case' 0 N--CA 1.437 -1.087 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.87 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.501 HG23 ' HA ' ' A' ' 22' ' ' ASP . 90.7 t -53.08 -40.87 39.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 C-N-CA 123.495 0.718 . . . . 0.0 111.404 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.9 m -53.7 -35.49 61.19 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.237 0.615 . . . . 0.0 112.163 -177.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.612 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 21.2 tp10 -103.7 -28.94 11.37 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.851 -179.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.439 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.9 m-85 -56.22 -32.99 64.94 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-O 121.851 0.834 . . . . 0.0 109.965 176.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.485 ' HA ' HG13 ' A' ' 9' ' ' VAL . 21.6 p -80.76 -31.73 35.79 Favored 'General case' 0 N--CA 1.423 -1.823 0 CA-C-N 114.809 -1.087 . . . . 0.0 111.722 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.36 -45.5 76.15 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-O 121.819 0.819 . . . . 0.0 110.441 -176.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -94.72 14.72 20.29 Favored 'General case' 0 C--N 1.299 -1.617 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.815 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . 0.285 4.3 p30 46.05 60.92 2.93 Favored 'General case' 0 CA--C 1.502 -0.892 0 CA-C-O 122.476 1.132 . . . . 0.0 113.429 177.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 49.5 mm -85.11 117.51 30.43 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.846 0 CA-C-N 113.86 -1.518 . . . . 0.0 107.024 176.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.6 p -106.59 -166.03 1.14 Allowed 'General case' 0 C--N 1.293 -1.861 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 177.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.472 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -64.15 -25.81 69.91 Favored Glycine 0 N--CA 1.441 -1.007 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 178.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -57.38 -45.21 84.7 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 123.693 0.797 . . . . 0.0 109.381 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.57 -3.22 43.42 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.539 -179.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.477 HD12 HG23 ' A' ' 12' ' ' VAL . 3.5 tt -81.85 -51.11 8.44 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 46.6 mt -61.08 -30.85 70.59 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.473 -176.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -103.09 13.63 33.7 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.443 ' HB2' HD22 ' A' ' 64' ' ' LEU . 37.8 mt -47.32 148.39 1.31 Allowed 'General case' 0 C--O 1.246 0.872 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 179.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.456 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 12.8 t70 -143.9 165.44 27.71 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 106.368 -1.716 . . . . 0.0 106.368 -175.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -57.28 -38.23 85.29 Favored Glycine 0 C--O 1.214 -1.143 0 N-CA-C 109.646 -1.382 . . . . 0.0 109.646 175.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -54.28 -47.98 71.75 Favored 'General case' 0 CA--C 1.495 -1.146 0 C-N-CA 123.806 0.843 . . . . 0.0 111.168 177.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.426 ' O ' HD23 ' A' ' 49' ' ' LEU . 14.2 mtpp -63.97 -46.64 83.71 Favored 'General case' 0 C--O 1.199 -1.555 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.531 177.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 83.4 mt -58.73 -25.49 63.02 Favored 'General case' 0 C--O 1.256 1.435 0 CA-C-O 121.604 0.716 . . . . 0.0 111.181 -179.272 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.775 ' HA ' HG22 ' A' ' 52' ' ' THR . 23.8 mtpp -83.43 -36.62 24.08 Favored 'General case' 0 N--CA 1.432 -1.357 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.467 176.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.34 -16.38 61.88 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.541 0.686 . . . . 0.0 111.127 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.612 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.6 mm? -73.68 -6.66 48.19 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.631 0.729 . . . . 0.0 109.094 172.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 69.87 4.52 48.16 Favored Glycine 0 CA--C 1.502 -0.779 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.512 177.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.605 ' HG3' ' OG ' ' A' ' 53' ' ' SER . 30.2 tpp -88.0 -51.16 5.97 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 -176.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.775 HG22 ' HA ' ' A' ' 47' ' ' LYS . 62.0 p 51.66 23.45 1.96 Allowed 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 125.257 1.423 . . . . 0.0 113.826 174.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.605 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 12.9 m -62.27 127.02 29.35 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 124.29 1.036 . . . . 0.0 111.939 -174.264 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.1 m -55.2 -51.25 67.15 Favored 'General case' 0 CA--C 1.553 1.079 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -172.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -58.33 -54.27 48.95 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 122.836 1.303 . . . . 0.0 109.634 178.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.743 ' O ' HG12 ' A' ' 60' ' ' VAL . 6.2 m-20 -59.57 -44.16 93.38 Favored 'General case' 0 C--N 1.282 -2.368 0 CA-C-N 112.279 -2.237 . . . . 0.0 111.026 -172.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.1 mmm180 -54.26 -23.17 13.88 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 177.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -100.18 -34.16 10.14 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.962 0.41 . . . . 0.0 110.78 176.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 48.7 tp -77.22 -57.29 3.92 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -176.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.743 HG12 ' O ' ' A' ' 56' ' ' ASP . 4.8 p -60.15 -21.01 21.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 CA-C-O 121.729 0.776 . . . . 0.0 110.628 -179.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 15.1 tppt? -65.62 -35.03 79.62 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 114.296 -1.32 . . . . 0.0 109.846 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -91.68 -30.25 16.41 Favored 'General case' 0 C--N 1.292 -1.897 0 CA-C-N 114.788 -1.097 . . . . 0.0 109.989 -177.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.485 ' HG2' HD13 ' A' ' 19' ' ' LEU . 2.8 tppt? -72.08 -40.73 68.03 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 115.067 -0.969 . . . . 0.0 111.29 -178.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.443 HD22 ' HB2' ' A' ' 41' ' ' LEU . 3.8 pp -59.2 -30.09 67.97 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.884 0.373 . . . . 0.0 111.677 -176.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -82.63 -22.27 34.78 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 120.37 -0.532 . . . . 0.0 111.901 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -101.03 -13.6 18.17 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 121.062 0.458 . . . . 0.0 110.178 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.46 ' HA ' ' HB3' ' A' ' 70' ' ' SER . 1.9 ppp? -60.85 -25.51 66.71 Favored 'General case' 0 C--O 1.195 -1.779 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.905 -173.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.573 ' HA ' HD23 ' A' ' 71' ' ' LEU . 17.3 ptmt -71.02 -18.87 62.57 Favored 'General case' 0 C--N 1.294 -1.847 0 CA-C-O 121.05 0.452 . . . . 0.0 112.116 -178.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 54.5 mtm -100.48 -33.4 10.36 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 122.257 1.027 . . . . 0.0 108.279 174.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.46 ' HB3' ' HA ' ' A' ' 67' ' ' MET . 32.4 t -81.85 -23.93 36.11 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 114.189 -1.369 . . . . 0.0 112.453 -171.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.682 HD22 HG13 ' A' ' 4' ' ' VAL . 4.5 pp -49.42 -34.67 17.03 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.579 1.152 . . . . 0.0 112.322 -177.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.478 ' N ' HD12 ' A' ' 71' ' ' LEU . 20.8 tt0 -69.59 -47.46 63.46 Favored 'General case' 0 N--CA 1.421 -1.89 0 CA-C-N 114.422 -1.263 . . . . 0.0 112.678 -178.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 43.3 mtpt -95.61 -44.1 7.64 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.189 -166.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.163 0 C-N-CA 125.256 1.422 . . . . 0.0 109.89 -172.816 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.883 0 N-CA-C 109.98 -1.248 . . . . 0.0 109.98 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -100.88 -12.63 18.83 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 117.389 0.594 . . . . 0.0 110.72 -178.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 67.7 mtt -78.66 158.49 28.37 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.224 -178.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.572 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 4.4 m -65.02 -31.18 52.81 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.022 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -167.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.441 ' CD2' ' HG2' ' A' ' 6' ' ' GLU . 9.3 p-80 -70.62 -13.39 62.07 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 121.478 0.656 . . . . 0.0 110.719 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.441 ' HG2' ' CD2' ' A' ' 5' ' ' HIS . 18.3 mm-40 -96.17 -4.27 42.9 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.138 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.523 ' CD2' ' HA ' ' A' ' 4' ' ' VAL . 52.3 m0 -83.77 142.16 30.88 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.62 -178.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 21.3 m -103.58 -72.14 0.71 Allowed 'General case' 0 N--CA 1.423 -1.813 0 CA-C-O 121.195 0.522 . . . . 0.0 110.918 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.539 ' O ' HG12 ' A' ' 12' ' ' VAL . 69.9 t -139.57 -61.7 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.208 -1.12 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 -176.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.7 pm0 -66.01 -19.86 66.0 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.305 -176.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.401 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 37.2 mt-30 -86.23 -17.74 33.96 Favored 'General case' 0 N--CA 1.435 -1.212 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.477 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.539 HG12 ' O ' ' A' ' 9' ' ' VAL . 3.2 p -72.39 -24.27 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 CA-C-O 121.79 0.805 . . . . 0.0 109.785 -177.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.455 ' O ' HG23 ' A' ' 17' ' ' VAL . 1.1 m -71.22 -27.89 63.81 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.357 -177.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . 0.401 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 33.2 m-70 -59.54 -40.57 87.66 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-O 120.978 0.418 . . . . 0.0 110.095 -178.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.466 ' CH2' HG23 ' A' ' 60' ' ' VAL . 35.6 t90 -64.65 -57.22 9.65 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.51 177.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.447 HD11 ' CG ' ' A' ' 28' ' ' PHE . 41.4 mt -49.02 -46.32 43.91 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.932 0.893 . . . . 0.0 112.138 -177.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 13' ' ' SER . 98.1 t -61.2 -26.21 38.58 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.208 0 CA-C-O 121.208 0.528 . . . . 0.0 111.114 -179.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.95 -24.84 73.04 Favored Glycine 0 N--CA 1.438 -1.198 0 C-N-CA 121.32 -0.467 . . . . 0.0 112.491 -177.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.516 HD13 ' CB ' ' A' ' 63' ' ' LYS . 0.7 OUTLIER -114.49 21.97 14.08 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -179.06 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.1 m 71.49 17.5 5.69 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.756 0.789 . . . . 0.0 111.266 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.468 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.3 mm? -100.54 15.12 29.05 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.311 -177.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.453 ' HA ' HG23 ' A' ' 25' ' ' VAL . 7.2 p-10 -56.02 -19.6 13.34 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 121.253 0.549 . . . . 0.0 111.6 174.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -68.38 -23.72 64.7 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 124.125 0.97 . . . . 0.0 111.112 176.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -86.86 -19.81 28.38 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.592 -179.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.453 HG23 ' HA ' ' A' ' 22' ' ' ASP . 88.7 t -52.21 -39.24 26.76 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 C-N-CA 123.117 0.567 . . . . 0.0 111.654 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.1 m -51.25 -37.63 48.18 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.085 0.954 . . . . 0.0 112.166 -178.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 14.9 tp10 -103.28 -31.73 9.93 Favored 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.112 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.447 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.3 m-85 -54.49 -45.33 73.23 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 121.198 0.523 . . . . 0.0 111.618 178.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 35.2 m -76.32 -16.88 59.67 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.71 -178.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -79.69 -35.04 39.68 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.699 -178.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -90.87 2.56 56.05 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 119.844 -0.742 . . . . 0.0 110.04 -177.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.518 HD22 ' N ' ' A' ' 32' ' ' ASN . 0.6 OUTLIER 67.0 32.84 6.08 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.105 178.896 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.3 mm -64.39 118.73 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.051 -178.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.505 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 93.3 p -107.07 -172.35 2.06 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 176.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.572 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -64.43 -22.77 67.9 Favored Glycine 0 N--CA 1.439 -1.164 0 N-CA-C 111.184 -0.767 . . . . 0.0 111.184 179.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -59.5 -45.78 90.7 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 123.219 0.608 . . . . 0.0 109.366 176.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.435 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -88.48 -17.05 31.17 Favored 'General case' 0 CA--C 1.494 -1.21 0 C-N-CA 120.413 -0.515 . . . . 0.0 111.47 -178.447 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.453 HD12 HG23 ' A' ' 12' ' ' VAL . 2.1 tt -69.51 -49.59 53.17 Favored 'General case' 0 C--N 1.308 -1.198 0 O-C-N 124.367 1.042 . . . . 0.0 108.802 -179.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.9 mt -59.6 -42.54 92.8 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.551 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -94.57 25.84 3.77 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -178.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.499 ' CB ' HD22 ' A' ' 64' ' ' LEU . 28.2 mt -65.74 161.4 20.85 Favored 'General case' 0 C--O 1.247 0.924 0 CA-C-O 121.173 0.511 . . . . 0.0 111.869 175.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -167.94 176.73 6.03 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.79 -39.09 93.32 Favored Glycine 0 CA--C 1.497 -1.07 0 CA-C-O 119.608 -0.551 . . . . 0.0 112.193 -178.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -51.12 -48.18 61.81 Favored 'General case' 0 CA--C 1.506 -0.731 0 C-N-CA 123.331 0.652 . . . . 0.0 110.667 178.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.423 ' HD3' HD23 ' A' ' 41' ' ' LEU . 11.2 mtpp -67.65 -44.88 76.85 Favored 'General case' 0 C--O 1.197 -1.67 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.297 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 91.3 mt -59.46 -28.84 67.35 Favored 'General case' 0 C--O 1.255 1.343 0 CA-C-O 121.488 0.661 . . . . 0.0 111.734 -179.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.685 ' HA ' HG22 ' A' ' 52' ' ' THR . 22.2 mtpp -76.77 -33.07 58.08 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.906 176.593 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.03 -12.78 60.02 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.685 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.523 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.5 mm? -78.56 -2.16 37.46 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.347 0.594 . . . . 0.0 109.421 173.11 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.07 -0.72 37.03 Favored Glycine 0 C--O 1.216 -1.017 0 CA-C-N 115.832 -0.622 . . . . 0.0 113.185 176.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 24.6 mmt -85.33 -53.72 5.04 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 120.721 0.296 . . . . 0.0 111.365 -177.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.685 HG22 ' HA ' ' A' ' 47' ' ' LYS . 20.0 p 56.11 25.22 8.75 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.584 1.154 . . . . 0.0 112.547 174.1 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 47.4 t -68.28 127.66 33.74 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 123.289 0.636 . . . . 0.0 111.158 -174.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.6 m -58.01 -44.33 87.21 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -175.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -58.94 -55.34 36.44 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.969 0.89 . . . . 0.0 109.658 178.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.733 ' O ' HG12 ' A' ' 60' ' ' VAL . 48.5 m-20 -62.33 -38.58 90.03 Favored 'General case' 0 N--CA 1.42 -1.967 0 CA-C-N 113.838 -1.528 . . . . 0.0 111.245 -173.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 46.9 mmm-85 -56.53 -15.7 4.74 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 176.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -108.57 -39.29 5.44 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-O 121.042 0.449 . . . . 0.0 110.169 175.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 47.6 tp -73.68 -54.93 6.97 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -173.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.733 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.0 p -64.64 -25.13 37.12 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.02 0 CA-C-O 121.352 0.596 . . . . 0.0 110.195 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.489 ' HD2' HD21 ' A' ' 64' ' ' LEU . 19.1 mmmt -70.91 -23.75 62.33 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.662 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.503 ' O ' ' HG2' ' A' ' 65' ' ' LYS . 22.5 ttmm -87.39 -40.88 14.02 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 114.656 -1.156 . . . . 0.0 108.964 178.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.516 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -72.6 -34.11 67.16 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-N 115.344 -0.844 . . . . 0.0 112.699 -178.344 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.499 HD22 ' CB ' ' A' ' 41' ' ' LEU . 3.2 pp -72.34 -24.56 61.31 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.003 0.43 . . . . 0.0 111.352 -177.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 21.5 ptmt -83.98 -9.33 58.76 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 120.465 -0.494 . . . . 0.0 111.339 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -119.9 7.77 10.98 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.441 ' SD ' HG11 ' A' ' 4' ' ' VAL . 3.8 tmm? -60.59 -31.07 70.23 Favored 'General case' 0 C--O 1.188 -2.147 0 CA-C-N 114.291 -1.322 . . . . 0.0 111.181 -170.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.447 ' HA ' HD23 ' A' ' 71' ' ' LEU . 22.7 pttm -68.63 -16.19 63.76 Favored 'General case' 0 C--N 1.282 -2.34 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 178.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 27.4 ptm -112.62 -11.18 13.59 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.421 0.629 . . . . 0.0 109.342 174.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 67.1 m -107.77 -11.02 15.48 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -176.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.507 HD12 ' N ' ' A' ' 72' ' ' GLU . 4.4 pp -54.63 -31.6 57.53 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.874 0.845 . . . . 0.0 111.353 173.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.507 ' N ' HD12 ' A' ' 71' ' ' LEU . 6.8 tt0 -68.31 -29.5 68.28 Favored 'General case' 0 N--CA 1.427 -1.617 0 CA-C-N 114.12 -1.4 . . . . 0.0 111.303 179.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -98.7 26.02 6.0 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 121.678 0.751 . . . . 0.0 110.437 -169.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.28 -2.446 0 CA-C-N 114.432 -1.258 . . . . 0.0 108.638 -178.062 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.555 0 N-CA-C 111.114 -0.794 . . . . 0.0 111.114 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -116.64 -0.29 12.43 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -176.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 78.0 mtm -76.84 167.77 21.26 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.564 -179.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.52 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.5 m -64.21 -29.93 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 N-CA-C 113.842 1.052 . . . . 0.0 113.842 -167.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 15.6 p-80 -70.77 -8.47 52.55 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-O 121.175 0.512 . . . . 0.0 111.223 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -99.75 -8.02 24.78 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.631 0.772 . . . . 0.0 109.862 177.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.521 ' O ' ' HB2' ' A' ' 34' ' ' SER . 50.1 m0 -74.53 133.01 42.32 Favored 'General case' 0 CA--C 1.489 -1.373 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -178.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.41 ' O ' ' HB3' ' A' ' 34' ' ' SER . 3.3 m -91.3 -75.51 0.47 Allowed 'General case' 0 N--CA 1.428 -1.56 0 CA-C-O 121.317 0.579 . . . . 0.0 110.156 -175.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.474 ' O ' HG12 ' A' ' 12' ' ' VAL . 97.9 t -140.83 -63.83 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.2 -1.535 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 179.129 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -62.88 -18.79 63.46 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.98 -177.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.459 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 47.0 mt-30 -82.13 -20.97 36.92 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.142 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.509 HG23 HD12 ' A' ' 38' ' ' LEU . 1.3 p -76.49 -26.42 16.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 CA-C-O 122.114 0.959 . . . . 0.0 108.652 -178.119 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.426 ' HA ' HD12 ' A' ' 16' ' ' LEU . 2.5 m -66.05 -33.41 75.73 Favored 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 114.479 -1.237 . . . . 0.0 112.342 -176.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . 0.459 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 44.6 m-70 -59.35 -37.67 78.45 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.666 0.746 . . . . 0.0 109.028 -178.013 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.543 ' O ' HD23 ' A' ' 19' ' ' LEU . 42.3 t90 -67.67 -58.89 3.87 Favored 'General case' 0 N--CA 1.424 -1.766 0 CA-C-N 114.374 -1.285 . . . . 0.0 109.983 176.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.448 HD11 ' CD2' ' A' ' 28' ' ' PHE . 46.8 mt -47.99 -49.83 29.49 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 124.181 0.992 . . . . 0.0 111.945 -178.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 94.5 t -67.21 -18.09 23.59 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.225 -178.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -86.79 -33.13 13.25 Favored Glycine 0 N--CA 1.438 -1.213 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 -176.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.543 HD23 ' O ' ' A' ' 15' ' ' TRP . 1.8 pt? -95.09 12.19 29.48 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.207 178.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.7 m 66.06 40.58 3.93 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 122.295 1.045 . . . . 0.0 110.29 -178.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.434 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.7 mm? -119.63 20.04 12.44 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 113.947 -1.479 . . . . 0.0 109.36 177.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.466 ' HA ' HG12 ' A' ' 25' ' ' VAL . 4.6 p-10 -55.57 -14.74 2.26 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-O 121.57 0.7 . . . . 0.0 112.139 174.189 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -65.97 -26.13 67.42 Favored 'General case' 0 C--N 1.293 -1.879 0 C-N-CA 123.978 0.911 . . . . 0.0 110.343 174.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.589 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 6.8 m-85 -89.77 -25.13 21.28 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -177.534 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.556 ' HA ' ' HB2' ' A' ' 28' ' ' PHE 0.325 1.4 p -59.64 -26.6 35.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 178.81 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.2 m -59.15 -27.88 66.06 Favored 'General case' 0 CA--C 1.562 1.439 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.887 177.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 16.0 tp10 -112.02 -33.31 6.31 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 179.305 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.556 ' HB2' ' HA ' ' A' ' 25' ' ' VAL . 3.5 m-85 -54.39 -40.96 68.7 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 121.011 0.434 . . . . 0.0 110.407 175.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.1 t -72.37 -22.91 61.07 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.252 -178.441 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -80.03 -37.56 33.79 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.611 -177.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -94.88 4.83 53.36 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 119.844 -0.743 . . . . 0.0 111.291 -178.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 61.1 39.13 16.49 Favored 'General case' 0 C--N 1.351 0.65 0 C-N-CA 123.148 0.579 . . . . 0.0 109.586 179.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.2 mm -66.37 110.02 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.049 0 CA-C-N 115.304 -0.862 . . . . 0.0 108.698 -179.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.521 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 78.5 p -105.76 -169.68 1.62 Allowed 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.52 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -58.73 -31.83 68.41 Favored Glycine 0 N--CA 1.445 -0.716 0 O-C-N 123.575 0.547 . . . . 0.0 112.102 -179.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -53.49 -50.12 66.05 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 123.678 0.791 . . . . 0.0 110.075 176.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.533 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -86.79 -17.3 33.85 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.229 -177.799 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.509 HD12 HG23 ' A' ' 12' ' ' VAL . 2.1 tt -70.51 -51.38 29.29 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.924 0.89 . . . . 0.0 109.171 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 47.1 mt -61.01 -36.05 78.47 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-O 121.341 0.591 . . . . 0.0 112.419 -176.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.42 HE21 ' HA ' ' A' ' 37' ' ' GLN . 5.0 pp0? -102.76 17.63 23.38 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.05 -177.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 37' ' ' GLN . 21.4 mt -54.6 154.94 4.42 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 121.789 0.804 . . . . 0.0 112.203 176.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -161.89 168.24 23.32 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 -175.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.15 -38.05 65.88 Favored Glycine 0 C--O 1.209 -1.41 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 177.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -51.48 -48.48 62.85 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 122.674 0.389 . . . . 0.0 111.093 176.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.3 mtpp -70.06 -45.31 67.35 Favored 'General case' 0 C--O 1.193 -1.915 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.89 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 94.3 mt -56.61 -38.04 71.5 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-O 121.825 0.821 . . . . 0.0 110.751 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.785 ' HA ' HG22 ' A' ' 52' ' ' THR . 24.5 mtpp -69.73 -36.58 75.98 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.161 177.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.85 -10.68 59.73 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 123.223 0.609 . . . . 0.0 111.378 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.521 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.2 mm? -84.55 -1.94 56.61 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.522 0.677 . . . . 0.0 109.286 173.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 70.62 7.11 60.59 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.761 -0.654 . . . . 0.0 114.284 174.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.589 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 40.3 tpp -90.29 -53.93 4.24 Favored 'General case' 0 C--N 1.311 -1.078 0 C-N-CA 119.07 -1.052 . . . . 0.0 109.3 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.785 HG22 ' HA ' ' A' ' 47' ' ' LYS . 63.7 p 54.9 33.25 19.57 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 124.586 1.154 . . . . 0.0 112.714 172.118 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.524 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 60.5 m -70.66 -174.68 0.93 Allowed 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 123.473 0.709 . . . . 0.0 112.909 -178.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.1 p -102.01 -41.18 6.54 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -60.8 -45.36 94.72 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.498 0.666 . . . . 0.0 111.036 -177.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.637 ' O ' HG12 ' A' ' 60' ' ' VAL . 11.5 p-10 -66.01 -45.21 82.37 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.89 -172.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 56.6 mmm-85 -56.33 -18.59 11.28 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 123.332 0.653 . . . . 0.0 111.954 -176.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -104.15 -44.26 5.03 Favored 'General case' 0 N--CA 1.419 -1.994 0 CA-C-O 121.048 0.451 . . . . 0.0 110.213 174.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 23.4 tp -76.84 -55.99 5.0 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -172.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.637 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.6 p -65.51 -22.04 30.24 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.779 0 CA-C-O 121.419 0.628 . . . . 0.0 109.37 -178.483 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -68.92 -31.21 69.94 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 114.254 -1.339 . . . . 0.0 108.8 -177.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -86.41 -42.14 13.88 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.425 -1.261 . . . . 0.0 109.39 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.505 ' HE3' ' HB2' ' A' ' 19' ' ' LEU . 0.9 OUTLIER -65.29 -40.84 94.37 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.213 -176.785 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.544 ' HA ' ' HG2' ' A' ' 67' ' ' MET . 3.6 pp -64.1 -32.36 73.89 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.163 -177.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -80.81 -18.88 46.04 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.287 -0.565 . . . . 0.0 111.999 -178.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -108.3 9.98 27.78 Favored 'General case' 0 C--N 1.318 -0.775 0 O-C-N 122.474 -0.141 . . . . 0.0 111.082 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.544 ' HG2' ' HA ' ' A' ' 64' ' ' LEU . 89.6 mmm -51.09 -41.11 59.77 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 121.091 0.472 . . . . 0.0 112.066 -178.434 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 14.6 ptpt -64.12 -22.46 66.94 Favored 'General case' 0 C--N 1.291 -1.943 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -174.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 27.3 ptt? -112.17 9.13 20.1 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-O 121.248 0.547 . . . . 0.0 109.939 178.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 40.0 m -122.51 -32.85 3.53 Favored 'General case' 0 C--O 1.209 -1.06 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.276 -178.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.483 HD22 HG13 ' A' ' 4' ' ' VAL . 4.5 pp -51.56 -30.17 19.83 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 -174.146 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.47 ' N ' HD12 ' A' ' 71' ' ' LEU . 11.8 tt0 -98.27 -36.2 10.1 Favored 'General case' 0 N--CA 1.414 -2.243 0 CA-C-O 121.382 0.61 . . . . 0.0 111.492 178.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -84.52 -37.73 20.91 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.401 -169.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.429 -1.494 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -176.465 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.324 0 N-CA-C 111.648 -0.581 . . . . 0.0 111.648 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 50.2 p-80 -95.21 -8.22 36.82 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 122.959 0.504 . . . . 0.0 110.452 -175.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.442 ' O ' ' HB2' ' A' ' 6' ' ' GLU . 66.5 mtt -70.31 165.04 23.16 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.544 -173.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.528 HG13 HD22 ' A' ' 71' ' ' LEU . 3.6 m -68.24 -30.34 47.46 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -168.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.2 p-80 -70.54 -7.27 42.52 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-O 121.498 0.666 . . . . 0.0 110.783 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.442 ' HB2' ' O ' ' A' ' 3' ' ' MET . 9.1 mm-40 -99.61 -9.41 23.23 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 124.268 1.027 . . . . 0.0 110.298 178.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.551 ' HA ' ' NE2' ' A' ' 11' ' ' GLN . 54.4 m0 -76.03 142.35 41.85 Favored 'General case' 0 CA--C 1.504 -0.794 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.307 -175.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.9 m -94.81 -79.42 0.43 Allowed 'General case' 0 N--CA 1.418 -2.039 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.862 -178.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.506 ' O ' HG12 ' A' ' 12' ' ' VAL . 94.9 t -141.77 -59.66 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -179.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.6 pm0 -60.46 -26.45 66.78 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.03 -0.987 . . . . 0.0 111.437 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.559 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 23.8 mt-30 -81.31 -16.99 50.8 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 115.01 -0.995 . . . . 0.0 112.356 -175.425 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.506 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.7 p -79.91 -20.17 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 121.894 0.854 . . . . 0.0 109.073 -179.379 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.44 ' HA ' HD12 ' A' ' 16' ' ' LEU . 2.5 m -77.15 -23.51 51.64 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.461 -174.306 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . 0.559 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 97.6 m-70 -60.63 -41.01 94.01 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.497 ' O ' HD23 ' A' ' 19' ' ' LEU . 31.3 t90 -61.99 -60.03 4.22 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 114.649 -1.16 . . . . 0.0 110.163 177.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.459 HD11 ' CG ' ' A' ' 28' ' ' PHE . 43.3 mt -47.97 -47.61 32.72 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.262 1.025 . . . . 0.0 112.441 -177.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 89.4 t -64.43 -22.55 31.46 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.168 0 CA-C-O 121.257 0.551 . . . . 0.0 111.018 -179.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.11 -29.84 61.95 Favored Glycine 0 N--CA 1.442 -0.913 0 CA-C-N 116.23 -0.441 . . . . 0.0 112.105 -179.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.523 HD13 ' CB ' ' A' ' 63' ' ' LYS . 0.6 OUTLIER -108.69 17.67 21.66 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -178.821 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.2 m 68.17 25.28 7.36 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 121.845 0.831 . . . . 0.0 111.169 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.473 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.1 mm? -103.62 16.29 26.79 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 124.247 1.019 . . . . 0.0 109.383 178.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -51.5 -26.51 8.52 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.078 0.951 . . . . 0.0 111.606 175.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -64.38 -23.52 67.32 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 124.066 0.946 . . . . 0.0 111.129 178.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.447 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 2.0 m-85 -85.89 -19.01 31.19 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.34 -178.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 95.7 t -53.64 -38.56 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.863 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.9 t -50.01 -39.23 40.69 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.774 0.829 . . . . 0.0 111.734 -179.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 12.3 tp10 -104.22 -30.53 10.12 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 120.978 -0.289 . . . . 0.0 110.829 -178.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.459 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.7 m-85 -56.18 -39.22 72.05 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 121.48 0.657 . . . . 0.0 110.238 176.656 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.8 t -76.05 -30.16 58.31 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.403 179.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.76 -45.18 72.06 Favored 'General case' 0 CA--C 1.504 -0.817 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.01 -176.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.439 ' HG3' HG12 ' A' ' 33' ' ' ILE . 4.3 pt20 -94.7 13.94 22.78 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 -178.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 57.57 39.91 27.32 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.857 0.863 . . . . 0.0 111.837 174.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.439 HG12 ' HG3' ' A' ' 31' ' ' GLN . 49.9 mm -68.84 115.47 7.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -179.526 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.475 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 89.6 p -108.7 -170.21 1.63 Allowed 'General case' 0 N--CA 1.423 -1.789 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 178.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.481 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -60.04 -32.72 76.51 Favored Glycine 0 CA--C 1.507 -0.406 0 N-CA-C 111.379 -0.688 . . . . 0.0 111.379 -179.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -50.28 -45.27 54.32 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 125.146 1.378 . . . . 0.0 110.387 176.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.471 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -96.79 -14.8 21.69 Favored 'General case' 0 C--O 1.214 -0.765 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 179.778 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.465 HD22 ' HG3' ' A' ' 67' ' ' MET . 2.6 tt -69.03 -53.06 22.47 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 -179.226 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 36.3 mt -60.3 -36.23 77.4 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.949 -176.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -97.36 10.51 39.45 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 113.755 1.021 . . . . 0.0 113.755 -175.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.721 ' HB2' HD22 ' A' ' 64' ' ' LEU . 41.0 mt -54.51 136.14 45.01 Favored 'General case' 0 C--O 1.243 0.745 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 179.28 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.408 ' OD1' ' HG3' ' A' ' 45' ' ' LYS . 4.0 p-10 -134.78 -177.77 4.77 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 177.148 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -58.18 -41.99 95.05 Favored Glycine 0 C--O 1.211 -1.338 0 CA-C-O 119.169 -0.795 . . . . 0.0 113.412 -178.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -62.52 -37.43 86.0 Favored 'General case' 0 CA--C 1.475 -1.932 0 CA-C-N 117.654 0.727 . . . . 0.0 112.442 -177.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HG3' ' OD1' ' A' ' 42' ' ' ASP . 8.5 mtpp -63.48 -49.6 72.97 Favored 'General case' 0 C--N 1.299 -1.6 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.791 175.232 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.6 mt -60.99 -22.58 64.64 Favored 'General case' 0 C--O 1.261 1.694 0 CA-C-O 121.328 0.585 . . . . 0.0 111.725 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.734 ' HA ' HG22 ' A' ' 52' ' ' THR . 62.2 mtpt -82.98 -41.67 18.48 Favored 'General case' 0 N--CA 1.433 -1.304 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.966 176.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.37 -11.23 60.79 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.554 0.693 . . . . 0.0 110.795 177.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.47 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 3.7 mm? -77.01 -3.28 38.24 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 172.37 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.14 1.85 51.0 Favored Glycine 0 CA--C 1.506 -0.506 0 CA-C-N 116.226 -0.443 . . . . 0.0 113.591 175.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.447 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 15.7 tpt -91.89 -50.89 5.48 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.367 -177.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.734 HG22 ' HA ' ' A' ' 47' ' ' LYS . 68.6 p 53.51 20.17 1.98 Allowed 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 124.959 1.304 . . . . 0.0 113.736 176.161 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 42.4 t -68.78 130.19 42.09 Favored 'General case' 0 C--N 1.31 -1.122 0 C-N-CA 123.057 0.543 . . . . 0.0 111.472 -172.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 31.7 t -56.38 -47.57 78.65 Favored 'General case' 0 C--O 1.247 0.931 0 C-N-CA 124.633 1.173 . . . . 0.0 111.631 -175.497 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 -53.88 -58.2 8.12 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-O 122.165 0.984 . . . . 0.0 110.471 177.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.72 ' O ' HG12 ' A' ' 60' ' ' VAL . 7.7 m-20 -63.15 -40.85 98.76 Favored 'General case' 0 N--CA 1.422 -1.869 0 CA-C-N 113.451 -1.704 . . . . 0.0 110.592 -171.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -54.06 -26.3 26.08 Favored 'General case' 0 C--O 1.218 -0.571 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 178.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -104.79 -14.92 15.37 Favored 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 121.134 -0.226 . . . . 0.0 111.504 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.405 HD13 ' C ' ' A' ' 59' ' ' LEU . 3.4 tm? -96.57 -59.01 1.91 Allowed 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 -175.12 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.72 HG12 ' O ' ' A' ' 56' ' ' ASP . 4.8 p -57.41 -26.77 27.17 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.553 0 CA-C-O 120.805 0.336 . . . . 0.0 110.865 -177.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.689 ' HD2' HD21 ' A' ' 64' ' ' LEU . 24.7 mmmt -62.12 -30.53 71.09 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.84 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.459 ' HA ' ' HE2' ' A' ' 65' ' ' LYS . 37.9 ttmt -79.25 -44.69 21.25 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 121.952 0.882 . . . . 0.0 109.114 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.523 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -70.54 -31.74 68.92 Favored 'General case' 0 C--N 1.295 -1.795 0 CA-C-N 114.01 -1.45 . . . . 0.0 112.404 -174.356 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.721 HD22 ' HB2' ' A' ' 41' ' ' LEU . 3.9 pp -75.05 -32.15 61.47 Favored 'General case' 0 N--CA 1.437 -1.107 0 N-CA-C 112.0 0.371 . . . . 0.0 112.0 179.507 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.459 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 64.2 pttt -80.07 -29.2 39.13 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 119.491 -0.884 . . . . 0.0 111.022 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.488 ' HG2' ' HA ' ' A' ' 63' ' ' LYS . 12.1 pt-20 -84.12 -2.54 56.96 Favored 'General case' 0 C--O 1.242 0.677 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 178.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.465 ' HG3' HD22 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -46.68 -36.8 7.48 Favored 'General case' 0 CA--C 1.488 -1.408 0 C-N-CA 123.597 0.759 . . . . 0.0 112.654 -178.457 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -55.13 -30.49 59.88 Favored 'General case' 0 C--N 1.309 -1.186 0 O-C-N 124.05 0.844 . . . . 0.0 112.622 -175.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 25.9 ptt? -107.79 -32.0 7.81 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.227 0.537 . . . . 0.0 110.029 177.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 49.2 m -78.53 -19.75 52.22 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -173.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.528 HD22 HG13 ' A' ' 4' ' ' VAL . 4.3 pp -68.98 -32.01 71.28 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-O 121.463 0.649 . . . . 0.0 109.941 176.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -87.25 -51.17 6.12 Favored 'General case' 0 N--CA 1.413 -2.319 0 CA-C-N 114.584 -1.189 . . . . 0.0 112.283 -174.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.411 ' HB2' ' NZ ' ' A' ' 73' ' ' LYS . 6.8 mtmp? -80.61 -73.97 0.34 Allowed 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 121.613 0.721 . . . . 0.0 109.147 -174.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.409 ' H ' ' HB2' ' A' ' 73' ' ' LYS . . . . . . . . 0 N--CA 1.416 -2.141 1 N-CA-C 99.948 -4.093 . . . . 0.0 99.948 -175.2 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.174 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 29.5 p80 53.05 16.23 0.71 Allowed 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 126.682 1.993 . . . . 0.0 115.124 177.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 67.4 mtt -85.41 156.5 20.83 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 178.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.561 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.4 m -70.79 -28.63 34.6 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.249 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -167.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 22.8 p-80 -73.38 -6.77 48.36 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 121.044 0.45 . . . . 0.0 110.606 178.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -105.25 -2.22 24.33 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.611 178.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.5 ' HA ' ' NE2' ' A' ' 11' ' ' GLN . 53.5 m0 -78.74 142.12 37.29 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.337 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.9 m -96.41 -81.92 0.41 Allowed 'General case' 0 N--CA 1.415 -2.222 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.98 -177.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.556 ' O ' HG12 ' A' ' 12' ' ' VAL . 87.2 t -139.71 -58.62 0.31 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.951 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 -178.426 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.4 pm0 -63.07 -29.47 70.84 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.523 0.678 . . . . 0.0 111.356 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.5 ' NE2' ' HA ' ' A' ' 7' ' ' TRP . 20.4 mt-30 -75.66 -15.63 60.29 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.802 -176.712 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.556 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.9 p -80.73 -18.32 12.06 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-O 121.285 0.564 . . . . 0.0 109.789 -179.423 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.437 ' O ' HG23 ' A' ' 17' ' ' VAL . 86.1 p -73.6 -39.27 64.72 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.448 -174.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -50.69 -41.07 55.49 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 114.831 -1.077 . . . . 0.0 110.842 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.477 ' O ' HD23 ' A' ' 19' ' ' LEU . 28.6 t90 -65.52 -58.81 4.9 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.988 176.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 40.4 mt -48.66 -48.28 39.99 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.963 0.905 . . . . 0.0 112.189 -178.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 13' ' ' SER . 60.6 t -65.68 -16.34 20.26 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.393 0 CA-C-O 121.069 0.462 . . . . 0.0 111.162 -178.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -85.81 -21.26 53.86 Favored Glycine 0 N--CA 1.444 -0.807 0 N-CA-C 112.336 -0.306 . . . . 0.0 112.336 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.485 ' HB2' ' HE3' ' A' ' 63' ' ' LYS . 1.3 pt? -112.45 21.66 15.46 Favored 'General case' 0 C--O 1.213 -0.839 0 O-C-N 122.154 -0.615 . . . . 0.0 111.572 177.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.4 m 68.82 22.26 7.33 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.613 0.765 . . . . 0.0 111.747 -179.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -103.11 17.74 23.36 Favored 'General case' 0 C--N 1.3 -1.564 0 C-N-CA 123.905 0.882 . . . . 0.0 110.55 -178.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -54.68 -26.82 35.92 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.468 0.707 . . . . 0.0 111.312 176.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -64.88 -21.66 66.85 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 124.599 1.16 . . . . 0.0 111.327 177.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.476 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 3.2 m-85 -89.65 -20.63 23.44 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.784 -179.097 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.1 t -55.73 -38.15 49.78 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 O-C-N 123.321 0.388 . . . . 0.0 111.532 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.4 m -51.12 -41.09 59.83 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.812 0.845 . . . . 0.0 111.282 -178.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.581 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 16.1 tp10 -99.31 -34.58 10.26 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.267 -177.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -54.21 -48.19 71.31 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-O 121.297 0.57 . . . . 0.0 110.919 178.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 45.8 m -77.81 -11.23 59.86 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.516 -178.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.22 -29.63 26.38 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.878 0.371 . . . . 0.0 110.401 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.74 2.45 47.02 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 120.132 -0.627 . . . . 0.0 109.871 178.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 65.53 32.44 9.38 Favored 'General case' 0 CA--C 1.514 -0.439 0 C-N-CA 123.981 0.912 . . . . 0.0 110.826 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.401 ' HA ' ' HG3' ' A' ' 37' ' ' GLN . 47.9 mm -62.63 113.13 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 O-C-N 123.643 0.589 . . . . 0.0 109.628 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 71.1 p -100.09 -172.09 2.16 Favored 'General case' 0 N--CA 1.423 -1.822 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.561 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -65.17 -23.05 69.54 Favored Glycine 0 N--CA 1.439 -1.159 0 N-CA-C 111.513 -0.635 . . . . 0.0 111.513 178.331 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -62.45 -40.44 96.62 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 123.641 0.776 . . . . 0.0 109.917 179.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.475 ' HA ' HE21 ' A' ' 40' ' ' GLN . 0.0 OUTLIER -93.04 -17.37 23.94 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.909 179.743 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.523 HD12 HG23 ' A' ' 12' ' ' VAL . 3.2 tt -69.0 -51.48 38.84 Favored 'General case' 0 C--N 1.314 -0.96 0 C-N-CA 124.593 1.157 . . . . 0.0 109.217 179.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 63.5 mt -58.63 -38.91 79.07 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.369 0.604 . . . . 0.0 111.776 -178.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.475 HE21 ' HA ' ' A' ' 37' ' ' GLN . 4.9 pp0? -97.77 13.73 29.4 Favored 'General case' 0 C--N 1.299 -1.611 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.715 -176.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.546 ' HB2' HD22 ' A' ' 64' ' ' LEU . 31.4 mt -54.22 139.22 36.56 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.801 0.81 . . . . 0.0 112.271 177.443 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -139.39 170.62 15.59 Favored 'General case' 0 C--N 1.284 -2.264 0 N-CA-C 106.296 -1.742 . . . . 0.0 106.296 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -53.3 -37.56 55.41 Favored Glycine 0 C--O 1.211 -1.324 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 177.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -49.56 -49.87 44.59 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.834 0.853 . . . . 0.0 110.352 178.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.433 ' HE3' ' HB3' ' A' ' 45' ' ' LYS . 13.3 mtpp -71.31 -44.04 65.92 Favored 'General case' 0 N--CA 1.421 -1.879 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.624 -177.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 88.2 mt -60.17 -28.38 67.89 Favored 'General case' 0 C--O 1.255 1.387 0 CA-C-O 121.49 0.662 . . . . 0.0 111.121 -179.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.784 ' HA ' HG22 ' A' ' 52' ' ' THR . 54.3 mtpt -78.92 -33.13 45.72 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 115.151 -0.932 . . . . 0.0 109.952 176.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.98 -4.89 46.35 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 123.127 0.571 . . . . 0.0 111.574 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.581 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.4 mm? -87.53 -2.15 58.42 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 173.17 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.06 -9.76 6.46 Favored Glycine 0 C--O 1.222 -0.602 0 CA-C-N 115.713 -0.676 . . . . 0.0 114.128 175.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.782 ' SD ' ' HB2' ' A' ' 53' ' ' SER . 0.0 OUTLIER -79.49 -50.36 10.88 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -176.336 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.784 HG22 ' HA ' ' A' ' 47' ' ' LYS . 70.1 p 53.21 27.44 6.0 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.833 1.253 . . . . 0.0 113.103 175.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.782 ' HB2' ' SD ' ' A' ' 51' ' ' MET . 40.0 t -65.7 123.55 20.02 Favored 'General case' 0 C--N 1.313 -1.015 0 C-N-CA 123.532 0.733 . . . . 0.0 111.944 -174.6 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.1 m -54.6 -41.72 70.27 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.958 0.903 . . . . 0.0 113.198 -177.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -61.07 -55.83 28.09 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.982 0.896 . . . . 0.0 109.557 176.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.727 ' O ' HG12 ' A' ' 60' ' ' VAL . 67.0 m-20 -62.61 -40.55 97.31 Favored 'General case' 0 N--CA 1.427 -1.577 0 CA-C-N 113.593 -1.64 . . . . 0.0 111.135 -171.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.1 mmm180 -53.79 -22.39 9.38 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 124.058 0.943 . . . . 0.0 113.045 177.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -106.8 -26.2 11.37 Favored 'General case' 0 N--CA 1.444 -0.752 0 O-C-N 123.138 0.274 . . . . 0.0 111.425 177.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 47.8 tp -86.42 -52.57 5.52 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -176.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.727 HG12 ' O ' ' A' ' 56' ' ' ASP . 6.5 p -62.77 -22.88 31.36 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.244 0 CA-C-O 121.414 0.625 . . . . 0.0 109.485 178.063 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.433 ' HA ' ' CD2' ' A' ' 64' ' ' LEU . 26.7 tptp -71.22 -27.53 63.56 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 114.422 -1.263 . . . . 0.0 108.797 -176.594 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -83.44 -46.78 12.11 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.909 -1.496 . . . . 0.0 108.995 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.485 ' HE3' ' HB2' ' A' ' 19' ' ' LEU . 0.9 OUTLIER -67.58 -40.01 84.84 Favored 'General case' 0 N--CA 1.426 -1.657 0 CA-C-N 114.143 -1.39 . . . . 0.0 110.933 -174.885 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.546 HD22 ' HB2' ' A' ' 41' ' ' LEU . 3.9 pp -64.05 -30.72 71.77 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.012 -176.279 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -87.29 -10.17 53.03 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 118.078 -1.449 . . . . 0.0 111.639 -178.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -113.45 15.76 19.02 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 120.364 -0.534 . . . . 0.0 109.605 178.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.485 ' HG2' ' HA ' ' A' ' 64' ' ' LEU . 90.6 mmm -47.49 -33.12 5.88 Favored 'General case' 0 C--O 1.19 -2.069 0 C-N-CA 123.567 0.747 . . . . 0.0 112.291 177.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.1 ptpt -52.35 -28.81 20.84 Favored 'General case' 0 C--N 1.283 -2.304 0 C-N-CA 124.804 1.242 . . . . 0.0 112.781 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 23.0 ptp -113.08 -27.28 8.09 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 174.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.5 t -74.19 -29.0 61.54 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.751 -175.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.1 pp -63.62 -31.8 73.08 Favored 'General case' 0 CA--C 1.491 -1.323 0 CA-C-O 121.101 0.477 . . . . 0.0 110.988 179.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -68.81 -50.01 53.72 Favored 'General case' 0 N--CA 1.409 -2.495 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.707 -178.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -65.95 -56.76 10.05 Favored 'General case' 0 N--CA 1.427 -1.621 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.448 -176.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.633 0 O-C-N 124.598 1.186 . . . . 0.0 110.029 -177.309 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.171 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.1 p80 -118.71 -5.02 10.7 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 111.725 0.268 . . . . 0.0 111.725 -177.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 94.4 mmm -82.7 156.83 23.58 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.557 HG13 HD22 ' A' ' 71' ' ' LEU . 3.4 m -69.85 -30.02 42.84 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -169.126 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 18.0 p-80 -71.55 -12.85 61.58 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-O 121.292 0.568 . . . . 0.0 110.969 178.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -96.73 -12.6 23.53 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.994 178.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.407 ' CD2' ' HA ' ' A' ' 4' ' ' VAL . 51.0 m0 -66.45 141.03 58.06 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.171 -178.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.1 m -94.54 -80.06 0.41 Allowed 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.647 -178.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.546 ' O ' HG12 ' A' ' 12' ' ' VAL . 91.9 t -141.12 -60.43 0.22 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.143 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 -176.351 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.424 ' H ' ' CD ' ' A' ' 10' ' ' GLN . 4.1 pm0 -64.01 -23.29 67.28 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 115.186 -0.916 . . . . 0.0 112.265 -179.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.531 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 34.6 mt-30 -81.16 -18.26 46.94 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 179.375 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.546 HG12 ' O ' ' A' ' 9' ' ' VAL . 2.0 p -73.77 -24.34 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-O 121.63 0.728 . . . . 0.0 109.699 -179.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.453 ' O ' HG23 ' A' ' 17' ' ' VAL . 0.7 OUTLIER -70.8 -30.1 66.46 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.195 -176.214 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . 0.531 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 94.8 m-70 -58.09 -39.33 78.33 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-O 121.037 0.446 . . . . 0.0 110.039 -178.258 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.564 ' O ' HD23 ' A' ' 19' ' ' LEU . 35.4 t90 -65.17 -60.47 2.98 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.936 176.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.499 HD11 ' CG ' ' A' ' 28' ' ' PHE . 50.3 mt -48.59 -51.08 29.7 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.103 0.961 . . . . 0.0 112.441 -177.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 13' ' ' SER . 59.2 t -66.22 -20.78 27.78 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 CA-C-O 121.044 0.449 . . . . 0.0 110.572 -177.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -76.6 -30.33 56.53 Favored Glycine 0 N--CA 1.439 -1.158 0 N-CA-C 111.174 -0.77 . . . . 0.0 111.174 -177.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.564 HD23 ' O ' ' A' ' 15' ' ' TRP . 1.0 OUTLIER -102.11 14.11 32.87 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.995 -0.282 . . . . 0.0 110.579 177.197 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.9 m 65.03 37.82 6.57 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-O 121.591 0.71 . . . . 0.0 112.255 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.699 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -109.82 22.31 15.82 Favored 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 127.082 2.153 . . . . 0.0 107.889 176.61 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -53.24 -27.77 23.93 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.321 0.648 . . . . 0.0 112.621 177.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.699 ' NE2' ' HA ' ' A' ' 21' ' ' LEU . 3.5 pm0 -66.39 -18.38 65.32 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 175.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.42 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 2.5 m-85 -87.45 -21.53 25.49 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.225 178.381 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 90.8 t -57.48 -37.96 60.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 122.508 0.323 . . . . 0.0 110.705 179.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 7.2 m -49.66 -36.76 25.87 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 124.81 1.244 . . . . 0.0 111.929 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 19.8 tp10 -106.62 -34.06 7.45 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.507 -178.531 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.499 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.2 m-85 -53.02 -48.14 67.81 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 121.37 0.605 . . . . 0.0 110.811 177.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.4 m -76.83 -21.17 55.45 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.385 -177.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.69 -31.82 63.62 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.818 0.342 . . . . 0.0 111.273 -178.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.74 7.58 44.96 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 119.78 -0.768 . . . . 0.0 111.94 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 65.24 36.98 6.72 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.68 0.792 . . . . 0.0 110.695 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.49 HG23 ' HB2' ' A' ' 37' ' ' GLN . 45.0 mm -69.04 119.2 14.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 178.467 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 63.1 p -106.33 -172.31 2.06 Favored 'General case' 0 N--CA 1.419 -2.003 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 179.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.521 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -64.48 -22.96 68.17 Favored Glycine 0 N--CA 1.447 -0.592 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 177.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -60.08 -44.29 94.88 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 123.673 0.789 . . . . 0.0 109.791 177.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.49 ' HB2' HG23 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -83.96 -26.25 29.41 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 -177.703 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.434 ' HA ' ' HG ' ' A' ' 41' ' ' LEU . 3.1 tt -62.79 -50.64 70.2 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.007 1.323 . . . . 0.0 110.724 -174.428 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 38.6 mt -62.96 -31.47 72.58 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.161 -177.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -103.41 13.08 34.41 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-N 115.575 -0.738 . . . . 0.0 112.553 -177.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.434 ' HG ' ' HA ' ' A' ' 38' ' ' LEU . 48.7 mt -53.49 145.67 14.3 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 177.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.418 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 24.5 t70 -142.39 169.04 18.33 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 105.827 -1.916 . . . . 0.0 105.827 179.016 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.495 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -54.03 -36.32 55.97 Favored Glycine 0 CA--C 1.487 -1.705 0 N-CA-C 110.502 -1.039 . . . . 0.0 110.502 176.286 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.467 ' HA ' ' HD3' ' A' ' 47' ' ' LYS . 66.1 t30 -50.67 -51.25 50.99 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-O 121.748 0.785 . . . . 0.0 110.238 178.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.466 ' HE3' ' HB3' ' A' ' 45' ' ' LYS . 13.5 mtpp -68.27 -39.8 82.06 Favored 'General case' 0 C--O 1.198 -1.64 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.3 -177.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 81.6 mt -62.89 -24.7 67.95 Favored 'General case' 0 C--O 1.254 1.299 0 CA-C-O 121.452 0.644 . . . . 0.0 110.767 179.211 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.858 ' HA ' HG22 ' A' ' 52' ' ' THR . 6.8 mtpm? -80.11 -35.78 36.31 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.067 -0.97 . . . . 0.0 108.931 175.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.45 -9.24 58.29 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 123.63 0.772 . . . . 0.0 111.581 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.481 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 2.9 mm? -86.06 -4.49 59.18 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 172.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 69.71 -0.07 22.34 Favored Glycine 0 C--N 1.328 0.135 0 CA-C-N 116.088 -0.506 . . . . 0.0 114.11 176.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 0.6 OUTLIER -84.37 -43.6 14.57 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 179.212 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.858 HG22 ' HA ' ' A' ' 47' ' ' LYS . 72.0 p 50.39 21.09 0.77 Allowed 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 125.721 1.608 . . . . 0.0 114.406 172.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.405 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 30.1 t -73.04 121.92 20.94 Favored 'General case' 0 C--N 1.3 -1.565 0 C-N-CA 122.428 0.291 . . . . 0.0 111.331 -174.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.2 m -63.59 -28.74 70.14 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -178.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.93 -54.59 24.36 Favored 'General case' 0 CA--C 1.503 -0.839 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 176.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.605 ' O ' HG12 ' A' ' 60' ' ' VAL . 4.6 m-20 -61.13 -45.71 93.55 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.182 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.521 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 12.0 mtm180 -63.51 -17.4 62.73 Favored 'General case' 0 C--O 1.207 -1.152 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.7 -15.5 30.21 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 121.373 0.606 . . . . 0.0 110.332 177.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.531 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 39.3 tp -100.81 -49.06 4.27 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.181 -178.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.605 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.5 p -60.62 -25.81 35.98 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.767 0 CA-C-O 121.727 0.775 . . . . 0.0 109.998 179.16 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.521 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 56.8 tptt -71.85 -34.03 68.92 Favored 'General case' 0 C--N 1.295 -1.776 0 CA-C-N 114.246 -1.343 . . . . 0.0 109.701 -172.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 59' ' ' LEU . 21.0 ptmt -87.9 -31.86 19.24 Favored 'General case' 0 N--CA 1.418 -2.061 0 CA-C-N 114.78 -1.1 . . . . 0.0 108.306 -177.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.443 ' O ' ' HB3' ' A' ' 67' ' ' MET . 2.6 tppt? -70.98 -44.87 65.06 Favored 'General case' 0 N--CA 1.417 -2.09 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.854 -178.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.411 HD22 ' HB2' ' A' ' 41' ' ' LEU . 3.7 pp -59.15 -31.42 68.95 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.959 0.409 . . . . 0.0 111.858 -176.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -87.86 -5.04 58.79 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -177.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -118.35 -13.17 9.82 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 120.268 -0.573 . . . . 0.0 109.685 174.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.477 ' HA ' ' HB2' ' A' ' 70' ' ' SER . 2.5 ppp? -61.2 -18.81 60.14 Favored 'General case' 0 C--O 1.191 -1.989 0 C-N-CA 124.021 0.928 . . . . 0.0 111.8 -172.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -68.85 -23.58 64.26 Favored 'General case' 0 C--N 1.29 -1.997 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.772 178.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 39.4 mtt -106.39 -35.06 7.24 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 107.775 -1.195 . . . . 0.0 107.775 174.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.477 ' HB2' ' HA ' ' A' ' 67' ' ' MET . 19.0 m -75.43 -21.29 58.3 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 -175.444 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.557 HD22 HG13 ' A' ' 4' ' ' VAL . 2.3 pp -57.21 -33.65 67.74 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-O 122.039 0.923 . . . . 0.0 109.245 178.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -78.73 -52.26 8.64 Favored 'General case' 0 N--CA 1.403 -2.82 0 CA-C-N 114.209 -1.36 . . . . 0.0 111.979 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.458 ' HG2' ' HA ' ' A' ' 70' ' ' SER . 55.8 pttt -82.95 -31.89 27.42 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -171.244 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.392 0 CA-C-O 119.413 -0.327 . . . . 0.0 110.952 -173.69 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.625 0 N-CA-C 111.091 -0.804 . . . . 0.0 111.091 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 34.7 p80 -82.61 0.74 41.6 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 121.163 0.506 . . . . 0.0 111.327 -179.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -73.67 154.48 39.68 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.126 -176.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.525 HG12 ' CH2' ' A' ' 7' ' ' TRP . 10.9 m -69.0 -33.0 56.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -171.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -69.37 -13.08 62.18 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-O 121.603 0.716 . . . . 0.0 110.75 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -88.95 -12.45 41.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.671 178.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.525 ' CH2' HG12 ' A' ' 4' ' ' VAL . 50.2 m0 -79.12 142.84 36.07 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 -179.525 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 13.1 m -99.83 -72.16 0.67 Allowed 'General case' 0 C--N 1.294 -1.819 0 O-C-N 123.657 0.598 . . . . 0.0 110.374 -178.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.534 ' O ' HG12 ' A' ' 12' ' ' VAL . 54.6 t -141.48 -65.76 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.209 -1.076 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 -179.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -62.4 -22.86 66.49 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -176.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.456 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 18.3 mt-30 -80.32 -18.47 49.09 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 176.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.534 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.4 p -75.25 -23.0 16.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 179.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.442 ' HA ' HD12 ' A' ' 16' ' ' LEU . 1.4 m -76.04 -27.56 57.36 Favored 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.246 -176.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . 0.456 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 84.4 m-70 -63.16 -34.82 78.45 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.475 ' O ' HD23 ' A' ' 19' ' ' LEU . 30.4 t90 -66.38 -62.21 1.59 Allowed 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.483 175.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.505 HD11 ' CG ' ' A' ' 28' ' ' PHE . 56.8 mt -44.83 -50.18 10.4 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.354 1.061 . . . . 0.0 112.946 -177.527 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 99.0 t -62.01 -27.73 42.99 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.277 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.688 -178.052 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.63 -35.44 74.39 Favored Glycine 0 N--CA 1.444 -0.831 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 -177.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.475 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.8 OUTLIER -98.55 10.0 41.96 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 -179.305 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.3 m 75.59 19.47 2.06 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 124.206 1.002 . . . . 0.0 112.301 179.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.413 ' HG ' ' CD1' ' A' ' 19' ' ' LEU . 1.4 mm? -95.99 19.32 11.75 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.103 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -48.21 -33.56 8.73 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.231 1.412 . . . . 0.0 111.187 173.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -62.56 -22.05 66.05 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.77 -1.105 . . . . 0.0 111.124 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.51 ' HD2' HD13 ' A' ' 49' ' ' LEU . 13.4 m-85 -90.77 -20.24 22.59 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.877 -178.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 99.0 t -52.84 -37.62 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 C-N-CA 123.055 0.542 . . . . 0.0 111.855 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 29.7 t -57.58 -33.27 67.99 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 122.902 0.481 . . . . 0.0 111.923 -177.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.442 ' HG2' ' HA ' ' A' ' 49' ' ' LEU . 19.7 tp10 -106.91 -28.21 10.22 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 121.176 -0.21 . . . . 0.0 110.898 -179.376 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.505 ' CG ' HD11 ' A' ' 16' ' ' LEU . 2.1 m-85 -54.79 -38.76 67.68 Favored 'General case' 0 C--N 1.347 0.476 0 CA-C-O 121.829 0.823 . . . . 0.0 109.462 174.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 31.1 p -74.17 -27.56 60.89 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 114.841 -1.072 . . . . 0.0 111.887 -179.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.09 -31.95 64.68 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-O 121.166 0.508 . . . . 0.0 110.387 -175.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.481 HE21 HD23 ' A' ' 49' ' ' LEU . 5.6 mt-30 -95.16 -1.39 51.95 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 119.815 -0.754 . . . . 0.0 110.41 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 63.58 38.69 9.45 Favored 'General case' 0 CA--C 1.512 -0.486 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -179.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.517 HG23 ' HB2' ' A' ' 37' ' ' GLN . 44.7 mm -65.01 114.75 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.603 -179.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.4 p -97.34 -175.53 3.24 Favored 'General case' 0 N--CA 1.407 -2.584 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 176.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.49 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -65.25 -21.46 68.31 Favored Glycine 0 N--CA 1.433 -1.533 0 N-CA-C 111.563 -0.615 . . . . 0.0 111.563 178.126 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -65.49 -38.7 90.54 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.517 ' HB2' HG23 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -84.85 -28.39 26.07 Favored 'General case' 0 CA--C 1.507 -0.685 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 -179.227 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.526 HD12 HG23 ' A' ' 12' ' ' VAL . 2.6 tt -58.56 -51.05 71.54 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 125.196 1.398 . . . . 0.0 109.654 -178.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 21.7 mt -57.37 -37.94 73.43 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.366 -178.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -100.48 21.49 13.16 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -177.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.485 ' HB2' HD22 ' A' ' 64' ' ' LEU . 27.9 mt -62.37 139.02 58.55 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.116 0.484 . . . . 0.0 111.786 175.253 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.476 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 0.6 OUTLIER -138.95 178.05 7.44 Favored 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 177.656 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.59 -37.93 69.45 Favored Glycine 0 C--O 1.203 -1.815 0 CA-C-O 119.322 -0.71 . . . . 0.0 113.209 178.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -62.35 -41.67 98.77 Favored 'General case' 0 CA--C 1.482 -1.636 0 CA-C-N 117.747 0.774 . . . . 0.0 112.666 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.541 ' O ' ' HG ' ' A' ' 49' ' ' LEU . 16.5 mtpp -66.02 -40.6 91.2 Favored 'General case' 0 C--N 1.31 -1.141 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.087 175.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.766 ' HA ' HD12 ' A' ' 49' ' ' LEU . 87.5 mt -63.96 -34.16 77.35 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-O 121.773 0.797 . . . . 0.0 110.548 178.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.676 ' HA ' HG22 ' A' ' 52' ' ' THR . 43.1 mtpt -71.39 -37.1 71.58 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.242 176.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.11 3.74 16.65 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.455 0.645 . . . . 0.0 110.87 -179.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.766 HD12 ' HA ' ' A' ' 46' ' ' LEU . 72.4 mt -95.94 -0.84 50.26 Favored 'General case' 0 N--CA 1.428 -1.535 0 CA-C-O 121.663 0.744 . . . . 0.0 109.215 176.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 81.14 -23.26 4.63 Favored Glycine 0 CA--C 1.501 -0.79 0 CA-C-N 115.271 -0.877 . . . . 0.0 113.58 173.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 16.4 mmt -74.97 -55.4 5.8 Favored 'General case' 0 C--N 1.296 -1.742 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 -176.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.676 HG22 ' HA ' ' A' ' 47' ' ' LYS . 14.7 p 60.49 23.37 13.01 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.312 1.045 . . . . 0.0 110.922 174.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.8 m -68.38 126.11 28.58 Favored 'General case' 0 N--CA 1.421 -1.877 0 C-N-CA 124.531 1.133 . . . . 0.0 112.426 -173.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.9 m -58.98 -40.85 86.09 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.391 1.077 . . . . 0.0 113.398 -175.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -55.23 -57.87 10.01 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 122.817 1.294 . . . . 0.0 109.072 177.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.765 ' O ' HG12 ' A' ' 60' ' ' VAL . 9.8 m-20 -60.42 -42.53 96.18 Favored 'General case' 0 N--CA 1.415 -2.219 0 CA-C-N 112.462 -2.154 . . . . 0.0 110.961 -174.198 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.5 mmm-85 -52.35 -24.48 7.68 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 177.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -104.08 -36.56 7.67 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-O 120.97 0.414 . . . . 0.0 111.081 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.45 HD12 HD12 ' A' ' 19' ' ' LEU . 2.1 tm? -72.59 -60.67 2.12 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.301 -176.249 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.765 HG12 ' O ' ' A' ' 56' ' ' ASP . 8.2 p -60.63 -25.28 34.42 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.72 0 CA-C-O 121.837 0.827 . . . . 0.0 109.417 -176.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -71.02 -25.92 62.88 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.059 -175.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.435 ' HA ' ' HE3' ' A' ' 65' ' ' LYS . 58.3 tttm -85.14 -39.56 17.75 Favored 'General case' 0 N--CA 1.424 -1.769 0 CA-C-N 115.428 -0.806 . . . . 0.0 109.057 176.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.429 ' HG2' HD13 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -67.06 -40.76 87.13 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.408 -176.086 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.535 ' HA ' ' HG2' ' A' ' 67' ' ' MET . 4.1 pp -66.36 -29.02 69.12 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.934 -177.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.435 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 22.4 pttp -88.24 -1.87 58.27 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 120.099 -0.64 . . . . 0.0 111.773 -179.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.508 ' O ' ' HG2' ' A' ' 69' ' ' MET . 12.8 pt-20 -124.52 15.86 8.88 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 176.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.535 ' HG2' ' HA ' ' A' ' 64' ' ' LEU . 89.0 mmm -49.54 -36.99 25.3 Favored 'General case' 0 CA--C 1.469 -2.154 0 CA-C-O 121.319 0.581 . . . . 0.0 111.739 179.419 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -61.59 -20.18 63.03 Favored 'General case' 0 C--N 1.277 -2.556 0 CA-C-N 114.658 -1.156 . . . . 0.0 113.015 -176.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.508 ' HG2' ' O ' ' A' ' 66' ' ' GLU . 23.4 ptp -113.77 -3.96 13.43 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 120.611 -0.436 . . . . 0.0 109.9 178.367 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 22.7 t -107.92 -33.31 7.26 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.192 -175.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.566 HD12 ' N ' ' A' ' 72' ' ' GLU . 3.8 pp -47.96 -35.09 10.19 Favored 'General case' 0 CA--C 1.501 -0.923 0 N-CA-C 115.244 1.572 . . . . 0.0 115.244 -174.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.566 ' N ' HD12 ' A' ' 71' ' ' LEU . 16.8 tt0 -63.28 -39.46 94.65 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.005 -179.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -90.37 -69.95 0.7 Allowed 'General case' 0 N--CA 1.415 -2.211 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 -175.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.815 0 C-N-CA 127.638 2.375 . . . . 0.0 105.031 178.447 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.718 0 N-CA-C 111.122 -0.791 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . 0.448 ' NE2' ' HA ' ' A' ' 72' ' ' GLU . 46.4 p-80 -96.22 -9.01 31.47 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.804 0.302 . . . . 0.0 110.611 -178.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -65.99 165.12 13.87 Favored 'General case' 0 C--N 1.322 -0.603 0 O-C-N 124.326 1.016 . . . . 0.0 111.877 -173.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.504 HG12 ' CH2' ' A' ' 7' ' ' TRP . 4.5 m -70.58 -30.2 41.54 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -170.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 11.1 p-80 -68.34 -15.91 63.74 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.338 0.589 . . . . 0.0 110.895 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -86.48 -11.85 50.61 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.555 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.504 ' CH2' HG12 ' A' ' 4' ' ' VAL . 51.2 m0 -78.8 142.32 37.04 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-O 121.436 0.636 . . . . 0.0 111.132 -176.517 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.98 -80.66 0.33 Allowed 'General case' 0 N--CA 1.417 -2.1 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.104 -178.567 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.48 ' O ' HG12 ' A' ' 12' ' ' VAL . 59.5 t -143.27 -60.76 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.839 0 CA-C-N 113.82 -1.537 . . . . 0.0 108.882 -177.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.0 pm0 -74.12 -10.94 60.12 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.296 0.57 . . . . 0.0 112.091 -175.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -86.32 -17.46 34.5 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.72 176.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.48 HG12 ' O ' ' A' ' 9' ' ' VAL . 2.5 p -70.66 -24.12 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-O 122.125 0.964 . . . . 0.0 108.979 -178.565 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.489 ' HA ' HD12 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -70.06 -26.24 63.93 Favored 'General case' 0 N--CA 1.418 -2.064 0 CA-C-N 114.425 -1.261 . . . . 0.0 111.31 -176.733 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 29.3 m-70 -63.67 -39.36 94.14 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -177.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.495 ' O ' HD23 ' A' ' 19' ' ' LEU . 28.0 t90 -63.93 -55.83 19.67 Favored 'General case' 0 CA--C 1.511 -0.544 0 O-C-N 123.814 0.696 . . . . 0.0 109.743 176.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.489 HD12 ' HA ' ' A' ' 13' ' ' SER . 46.4 mt -48.11 -48.71 33.64 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.269 1.028 . . . . 0.0 112.458 -178.213 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 13' ' ' SER . 86.7 t -61.16 -27.08 41.01 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 C-N-CA 122.471 0.308 . . . . 0.0 111.381 -178.797 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.24 -28.73 65.56 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.735 -0.546 . . . . 0.0 111.735 -176.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.495 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.9 OUTLIER -106.34 17.95 22.68 Favored 'General case' 0 C--O 1.212 -0.87 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.336 179.114 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.5 t 65.91 29.88 10.12 Favored 'General case' 0 C--O 1.208 -1.111 0 CA-C-O 121.575 0.702 . . . . 0.0 110.55 179.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.41 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.7 mm? -107.71 18.79 20.97 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 123.552 0.741 . . . . 0.0 109.989 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -48.91 -32.09 8.39 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.921 0.889 . . . . 0.0 111.444 174.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -59.51 -20.67 57.13 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 124.686 1.195 . . . . 0.0 112.014 178.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -90.45 -19.9 23.35 Favored 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 179.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 92.6 t -53.13 -38.01 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 C-N-CA 122.798 0.439 . . . . 0.0 110.722 179.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.1 m -50.63 -29.38 10.86 Favored 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 125.706 1.602 . . . . 0.0 112.881 -179.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.581 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 18.3 tp10 -117.49 -30.47 5.52 Favored 'General case' 0 N--CA 1.432 -1.359 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.289 178.347 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.423 ' CG ' HD11 ' A' ' 16' ' ' LEU . 1.6 m-85 -54.61 -42.83 71.63 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-O 121.508 0.671 . . . . 0.0 110.938 177.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 45.8 m -84.36 -9.44 58.44 Favored 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.87 -178.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -83.07 -41.24 18.86 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.674 0.75 . . . . 0.0 110.059 179.606 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.478 ' HG3' HG12 ' A' ' 33' ' ' ILE . 3.7 pt20 -93.21 17.0 11.78 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 59.84 36.57 21.99 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.668 174.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.478 HG12 ' HG3' ' A' ' 31' ' ' GLN . 49.6 mm -70.35 118.19 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.087 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 -179.789 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 91.5 p -107.04 -167.74 1.31 Allowed 'General case' 0 N--CA 1.423 -1.797 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 176.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.486 ' O ' ' HG ' ' A' ' 39' ' ' LEU . . . -63.07 -28.43 72.1 Favored Glycine 0 N--CA 1.43 -1.737 0 N-CA-C 110.647 -0.981 . . . . 0.0 110.647 177.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -54.64 -46.34 73.93 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.538 0.735 . . . . 0.0 110.112 178.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.84 -19.98 23.99 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 120.27 -0.572 . . . . 0.0 112.271 -177.727 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.8 tt -63.94 -48.37 76.79 Favored 'General case' 0 C--N 1.316 -0.882 0 O-C-N 124.536 1.147 . . . . 0.0 108.53 177.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 35' ' ' GLY . 21.7 mt -63.68 -37.29 86.78 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.827 -178.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -100.9 20.88 14.59 Favored 'General case' 0 C--N 1.309 -1.161 0 N-CA-C 114.141 1.163 . . . . 0.0 114.141 -177.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.1 mt -54.79 153.53 5.98 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 176.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.501 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 14.3 t70 -159.8 161.93 34.68 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 -176.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -55.91 -34.32 61.42 Favored Glycine 0 CA--C 1.49 -1.504 0 O-C-N 123.569 0.543 . . . . 0.0 112.032 178.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -56.72 -43.94 81.13 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-O 121.031 0.443 . . . . 0.0 110.456 176.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.417 ' HE3' ' HB3' ' A' ' 45' ' ' LYS . 12.2 mtpp -68.79 -48.46 63.58 Favored 'General case' 0 C--O 1.193 -1.893 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.82 176.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 80.3 mt -54.99 -35.15 64.05 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-O 121.59 0.71 . . . . 0.0 111.451 -178.129 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.742 ' HA ' HG22 ' A' ' 52' ' ' THR . 22.6 mttm -75.57 -35.72 60.55 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.167 176.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.32 -12.72 60.93 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.144 0.578 . . . . 0.0 111.35 -179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.581 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.4 mm? -74.88 -8.71 57.28 Favored 'General case' 0 C--O 1.22 -0.5 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 172.003 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 71.35 1.29 42.35 Favored Glycine 0 C--O 1.225 -0.418 0 CA-C-N 115.935 -0.575 . . . . 0.0 112.543 178.05 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.586 ' HG3' ' OG ' ' A' ' 53' ' ' SER . 12.0 tpt -87.67 -49.36 7.2 Favored 'General case' 0 N--CA 1.433 -1.314 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -177.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.742 HG22 ' HA ' ' A' ' 47' ' ' LYS . 70.7 p 57.93 10.23 1.1 Allowed 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.783 1.633 . . . . 0.0 114.393 172.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.586 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 16.2 m -57.29 118.41 5.07 Favored 'General case' 0 C--N 1.31 -1.135 0 C-N-CA 124.807 1.243 . . . . 0.0 112.22 -175.107 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 p -63.69 -39.93 95.53 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 -172.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.444 HE21 ' CG ' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -71.25 -32.17 68.41 Favored 'General case' 0 CA--C 1.49 -1.336 0 CA-C-O 122.338 1.066 . . . . 0.0 108.904 -179.11 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.651 ' O ' HG12 ' A' ' 60' ' ' VAL . 17.7 m-20 -74.65 -40.85 61.22 Favored 'General case' 0 N--CA 1.413 -2.282 0 CA-C-N 113.137 -1.847 . . . . 0.0 109.369 -178.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.593 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 24.7 mmm-85 -51.43 -36.35 43.42 Favored 'General case' 0 C--O 1.2 -1.519 0 C-N-CA 124.3 1.04 . . . . 0.0 111.132 175.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.44 -35.67 27.33 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.035 0.445 . . . . 0.0 111.894 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 30.7 tp -80.23 -43.79 20.83 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 120.306 -0.558 . . . . 0.0 112.216 -174.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.651 HG12 ' O ' ' A' ' 56' ' ' ASP . 9.7 p -65.26 -26.1 38.82 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.737 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.593 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 55.0 tptt -70.36 -31.98 69.47 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 122.734 1.254 . . . . 0.0 108.896 -175.502 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -80.62 -44.75 18.38 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-N 113.118 -1.856 . . . . 0.0 109.026 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.46 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.3 OUTLIER -72.31 -35.68 68.71 Favored 'General case' 0 N--CA 1.423 -1.824 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.191 -176.776 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.7 pp -70.0 -13.74 62.37 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 -176.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -98.84 -5.12 31.65 Favored 'General case' 0 C--N 1.309 -1.167 0 C-N-CA 119.026 -1.069 . . . . 0.0 112.275 175.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -125.78 4.47 7.4 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 122.159 0.98 . . . . 0.0 109.381 -179.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.492 ' SD ' ' N ' ' A' ' 67' ' ' MET . 0.0 OUTLIER -54.24 -24.74 19.78 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 127.585 2.354 . . . . 0.0 112.173 -176.532 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -69.88 -20.46 63.38 Favored 'General case' 0 C--N 1.298 -1.631 0 CA-C-N 115.087 -0.961 . . . . 0.0 111.854 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 25.9 ptt? -110.11 -14.59 14.18 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 173.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.424 ' HB2' ' HA ' ' A' ' 67' ' ' MET . 9.0 m -76.95 -36.07 56.81 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.937 178.094 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.545 HD12 ' N ' ' A' ' 72' ' ' GLU . 4.3 pp -53.16 -29.17 29.91 Favored 'General case' 0 CA--C 1.495 -1.149 0 C-N-CA 124.01 0.924 . . . . 0.0 112.825 179.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.545 ' N ' HD12 ' A' ' 71' ' ' LEU . 10.2 tt0 -70.69 -31.17 67.97 Favored 'General case' 0 N--CA 1.402 -2.863 0 CA-C-N 114.073 -1.421 . . . . 0.0 111.99 -174.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 57.3 mttp -99.53 -87.97 0.35 Allowed 'General case' 0 N--CA 1.405 -2.713 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.654 -169.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.012 0 N-CA-C 107.807 -1.182 . . . . 0.0 107.807 -178.971 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.759 0 N-CA-C 111.611 -0.595 . . . . 0.0 111.611 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 25.3 p80 -113.56 5.29 16.53 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 121.112 0.482 . . . . 0.0 110.259 -178.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -72.6 174.78 7.05 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.367 -176.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.686 HG13 HD22 ' A' ' 71' ' ' LEU . 3.9 m -68.48 -29.81 45.32 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.158 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 -169.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.5 p-80 -72.41 -6.39 43.17 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 121.467 0.651 . . . . 0.0 110.941 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -103.08 -7.01 21.69 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.822 178.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.519 ' CH2' HG12 ' A' ' 4' ' ' VAL . 54.2 m0 -79.69 156.59 27.49 Favored 'General case' 0 CA--C 1.473 -1.996 0 CA-C-O 121.821 0.82 . . . . 0.0 111.607 -178.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.453 ' H ' ' HB2' ' A' ' 11' ' ' GLN . 7.8 m -111.91 -131.22 0.32 Allowed 'General case' 1 N--CA 1.37 -4.446 0 CA-C-N 113.578 -1.647 . . . . 0.0 106.866 177.037 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.569 ' O ' HG12 ' A' ' 12' ' ' VAL . 59.8 t -95.41 -52.4 9.52 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.991 0 C-N-CA 123.524 0.729 . . . . 0.0 110.628 -170.231 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.406 ' CD ' ' H ' ' A' ' 10' ' ' GLN . 4.7 pm0 -71.18 -19.77 62.37 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 122.36 1.076 . . . . 0.0 109.83 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.556 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 29.3 mt-30 -86.03 -19.4 30.36 Favored 'General case' 0 N--CA 1.413 -2.297 0 CA-C-N 114.158 -1.383 . . . . 0.0 111.787 -176.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.569 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.3 p -78.54 -20.98 13.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.778 0.799 . . . . 0.0 109.007 -179.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.5 ' HA ' HD12 ' A' ' 16' ' ' LEU . 1.8 m -74.94 -23.85 58.39 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.814 -176.125 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . 0.556 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 87.2 m-70 -61.34 -36.16 79.41 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-O 120.998 0.428 . . . . 0.0 110.44 -179.03 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.438 ' O ' HD23 ' A' ' 19' ' ' LEU . 31.3 t90 -68.09 -59.3 3.35 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.698 176.226 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.515 HD11 ' CD2' ' A' ' 28' ' ' PHE . 44.9 mt -46.49 -50.61 16.77 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.283 1.033 . . . . 0.0 112.326 -177.505 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 13' ' ' SER . 94.0 t -60.55 -26.09 36.6 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.174 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.308 -178.054 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -70.91 -34.35 65.55 Favored Glycine 0 N--CA 1.449 -0.492 0 CA-C-N 116.413 -0.358 . . . . 0.0 112.332 -178.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.466 ' HG ' ' HB2' ' A' ' 21' ' ' LEU . 0.5 OUTLIER -100.52 15.71 27.09 Favored 'General case' 0 C--N 1.317 -0.841 0 O-C-N 122.731 -0.276 . . . . 0.0 111.357 -179.565 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 43.4 m 70.21 18.34 6.94 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.413 1.085 . . . . 0.0 111.415 -179.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.466 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.6 mm? -94.25 18.81 10.31 Favored 'General case' 0 C--N 1.301 -1.537 0 C-N-CA 124.17 0.988 . . . . 0.0 109.422 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.446 ' HB3' HG22 ' A' ' 17' ' ' VAL . 1.1 p30 -51.64 -26.63 9.38 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.341 1.056 . . . . 0.0 111.212 172.513 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -62.51 -26.97 68.82 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 124.098 0.959 . . . . 0.0 111.344 177.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.422 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 1.8 m-85 -85.1 -19.85 31.25 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.627 -178.004 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 91.0 t -54.53 -33.35 26.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 122.842 0.457 . . . . 0.0 110.91 178.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 4.4 m -48.61 -39.62 24.58 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.201 1.4 . . . . 0.0 112.266 178.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.628 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 15.5 tp10 -108.59 -30.09 8.41 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.33 -177.328 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.515 ' CD2' HD11 ' A' ' 16' ' ' LEU . 2.7 m-85 -54.09 -36.89 63.67 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.356 0.598 . . . . 0.0 110.795 176.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.2 p -73.04 -32.28 64.98 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.359 178.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.08 -31.16 61.15 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.864 -174.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -96.82 0.93 50.09 Favored 'General case' 0 CA--C 1.509 -0.604 0 C-N-CA 119.931 -0.708 . . . . 0.0 110.246 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 62.66 40.1 10.61 Favored 'General case' 0 CA--C 1.509 -0.617 0 O-C-N 123.939 0.774 . . . . 0.0 109.988 179.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 43.7 mm -65.61 128.17 27.99 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.131 0 CA-C-N 115.12 -0.945 . . . . 0.0 108.57 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.437 ' H ' ' HG2' ' A' ' 37' ' ' GLN . 74.9 p -120.14 -168.85 1.69 Allowed 'General case' 0 N--CA 1.428 -1.528 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 174.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.532 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.09 -29.62 73.28 Favored Glycine 0 CA--C 1.502 -0.781 0 N-CA-C 111.881 -0.487 . . . . 0.0 111.881 -177.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -54.47 -47.74 72.6 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 123.252 0.621 . . . . 0.0 109.657 176.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.437 ' HG2' ' H ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -87.03 -19.89 27.99 Favored 'General case' 0 C--N 1.312 -1.062 0 C-N-CA 119.535 -0.866 . . . . 0.0 111.52 -177.752 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.405 ' HA ' ' HG ' ' A' ' 41' ' ' LEU . 2.7 tt -67.66 -51.16 53.14 Favored 'General case' 0 CA--C 1.548 0.884 0 O-C-N 124.192 0.932 . . . . 0.0 109.745 -178.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 50.8 mt -62.46 -34.57 77.08 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.473 0.654 . . . . 0.0 111.592 -177.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -101.9 24.92 9.27 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.589 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.478 ' HA ' ' HD3' ' A' ' 45' ' ' LYS . 32.6 mt -63.35 153.1 36.1 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.063 173.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -157.06 172.81 18.01 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 -177.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.426 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -58.8 -40.68 95.38 Favored Glycine 0 C--O 1.204 -1.73 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -51.35 -46.95 62.86 Favored 'General case' 0 CA--C 1.507 -0.705 0 C-N-CA 123.58 0.752 . . . . 0.0 111.539 176.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.48 ' O ' HD23 ' A' ' 49' ' ' LEU . 15.0 mtpp -67.02 -44.05 81.29 Favored 'General case' 0 C--O 1.193 -1.894 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.8 176.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 98.1 mt -59.55 -27.19 65.99 Favored 'General case' 0 C--O 1.256 1.423 0 CA-C-O 121.704 0.764 . . . . 0.0 111.646 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.654 ' HA ' HG22 ' A' ' 52' ' ' THR . 56.3 mtpt -83.98 -34.37 24.4 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.157 178.079 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.67 -12.67 60.24 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 121.79 0.805 . . . . 0.0 110.263 176.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.628 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 3.7 mm? -82.14 2.17 32.72 Favored 'General case' 0 C--O 1.211 -0.949 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.009 173.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 63.06 6.04 11.77 Favored Glycine 0 C--N 1.333 0.397 0 CA-C-N 115.7 -0.682 . . . . 0.0 114.446 175.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.422 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 6.5 tpt -88.15 -48.73 7.5 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 -177.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.654 HG22 ' HA ' ' A' ' 47' ' ' LYS . 81.7 p 53.99 21.26 2.8 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 125.471 1.509 . . . . 0.0 114.618 174.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.9 t -66.41 117.65 8.94 Favored 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 123.536 0.734 . . . . 0.0 110.032 -179.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.2 m -67.51 -26.78 66.51 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-O 121.005 0.431 . . . . 0.0 110.449 -177.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -58.14 -53.64 55.96 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 122.11 0.957 . . . . 0.0 108.522 173.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.621 ' O ' HG12 ' A' ' 60' ' ' VAL . 67.5 m-20 -71.23 -37.17 72.03 Favored 'General case' 0 N--CA 1.427 -1.596 0 CA-C-N 114.15 -1.386 . . . . 0.0 110.78 -176.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -52.76 -27.15 16.58 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.674 0.79 . . . . 0.0 112.768 177.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.34 -37.79 13.79 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.973 176.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -81.21 -64.4 1.2 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.434 -172.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.621 HG12 ' O ' ' A' ' 56' ' ' ASP . 3.4 p -58.9 -23.01 22.77 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.839 0 CA-C-O 121.431 0.634 . . . . 0.0 111.249 -175.268 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -68.05 -33.25 74.22 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.809 -178.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt -84.22 -30.87 25.38 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-N 114.882 -1.054 . . . . 0.0 109.727 -178.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.428 ' HG2' HD13 ' A' ' 19' ' ' LEU . 1.4 tppt? -77.43 -41.46 39.73 Favored 'General case' 0 C--N 1.298 -1.647 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.041 -177.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.41 HD22 ' CB ' ' A' ' 41' ' ' LEU . 3.9 pp -61.89 -32.67 73.06 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.02 0.438 . . . . 0.0 112.049 -175.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -76.77 -28.14 55.58 Favored 'General case' 0 C--N 1.31 -1.113 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.098 -178.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -102.6 0.5 33.44 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.34 0.59 . . . . 0.0 110.195 -178.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.449 ' CE ' HG11 ' A' ' 4' ' ' VAL . 2.3 ppp? -69.31 -23.2 63.77 Favored 'General case' 0 C--O 1.197 -1.677 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.915 -175.356 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.664 ' HA ' HD23 ' A' ' 71' ' ' LEU . 54.7 pttt -71.97 -14.37 61.88 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-O 121.507 0.67 . . . . 0.0 111.805 178.08 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.2 mtp -99.9 -28.9 12.88 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 174.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 16.9 m -91.93 -24.73 19.19 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.167 -0.924 . . . . 0.0 113.465 -170.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.686 HD22 HG13 ' A' ' 4' ' ' VAL . 4.5 pp -50.24 -30.36 11.5 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 124.628 1.171 . . . . 0.0 113.309 -177.572 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.49 ' N ' HD12 ' A' ' 71' ' ' LEU . 10.6 tt0 -68.2 -44.89 74.82 Favored 'General case' 0 N--CA 1.417 -2.081 0 CA-C-N 114.382 -1.281 . . . . 0.0 111.285 -178.453 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -78.29 -53.39 7.37 Favored 'General case' 0 C--N 1.298 -1.674 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.426 -170.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.421 -1.898 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 -176.018 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.805 0 N-CA-C 111.305 -0.718 . . . . 0.0 111.305 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 68.5 t60 67.39 -71.01 0.11 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.704 1.202 . . . . 0.0 113.639 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 56.5 mtt -77.03 152.09 35.27 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.578 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 3.1 m -73.82 -27.61 22.99 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.134 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -165.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.0 p-80 -68.65 -12.05 60.88 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-O 121.272 0.558 . . . . 0.0 111.154 176.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -97.88 -0.3 45.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.127 178.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.523 ' O ' ' HB2' ' A' ' 34' ' ' SER . 52.2 m0 -82.31 143.77 31.06 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.983 -179.114 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.5 m -99.63 -73.74 0.62 Allowed 'General case' 0 N--CA 1.428 -1.538 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.355 -175.012 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.431 ' O ' HG12 ' A' ' 12' ' ' VAL . 98.4 t -143.44 -65.48 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.198 -1.615 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 -59.74 -27.24 66.33 Favored 'General case' 0 C--N 1.312 -1.024 0 C-N-CA 124.076 0.951 . . . . 0.0 112.465 -177.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.568 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 43.3 mt-30 -72.6 -18.88 61.56 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.881 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.466 HG23 HD12 ' A' ' 38' ' ' LEU . 0.8 OUTLIER -78.83 -28.14 13.93 Favored 'Isoleucine or valine' 0 C--O 1.243 0.731 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -178.179 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.521 ' O ' HG23 ' A' ' 17' ' ' VAL . 1.2 m -67.88 -34.5 76.77 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.359 -176.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . 0.568 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 30.6 m-70 -59.13 -36.41 75.15 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.737 0.648 . . . . 0.0 109.631 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.443 ' CH2' HG23 ' A' ' 60' ' ' VAL . 25.0 t90 -67.18 -59.04 3.78 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.74 176.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.445 HD12 ' HA ' ' A' ' 13' ' ' SER . 31.4 mt -47.3 -48.82 24.88 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 124.441 1.088 . . . . 0.0 112.218 -177.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 13' ' ' SER . 64.9 t -61.2 -25.82 37.44 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.014 0 CA-C-O 120.882 0.373 . . . . 0.0 111.198 -178.062 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.76 -28.63 64.7 Favored Glycine 0 CA--C 1.505 -0.567 0 N-CA-C 111.754 -0.539 . . . . 0.0 111.754 -176.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.453 ' H ' HD23 ' A' ' 19' ' ' LEU . 1.2 pt? -105.78 16.02 25.87 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.223 178.603 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.8 m 66.59 21.69 10.65 Favored 'General case' 0 C--O 1.206 -1.197 0 C-N-CA 123.825 0.85 . . . . 0.0 112.318 -179.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.406 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 2.1 mm? -95.98 19.98 10.74 Favored 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 123.795 0.838 . . . . 0.0 109.129 178.384 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.45 ' HA ' HG23 ' A' ' 25' ' ' VAL . 7.6 p-10 -55.22 -20.66 11.42 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.091 0.956 . . . . 0.0 111.399 175.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -69.14 -22.17 63.96 Favored 'General case' 0 C--N 1.305 -1.353 0 C-N-CA 124.065 0.946 . . . . 0.0 111.033 177.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.534 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 2.6 m-85 -87.5 -20.65 26.23 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.384 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.45 HG23 ' HA ' ' A' ' 22' ' ' ASP . 93.6 t -52.14 -38.18 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -179.365 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 36.7 t -54.01 -41.19 67.71 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 123.455 0.472 . . . . 0.0 111.168 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.533 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 13.1 tp10 -96.56 -31.31 12.83 Favored 'General case' 0 N--CA 1.44 -0.961 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.264 -177.279 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.43 ' CG ' HD11 ' A' ' 16' ' ' LEU . 2.7 m-85 -55.91 -39.86 72.23 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.197 0.522 . . . . 0.0 110.438 175.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.4 m -71.83 -30.78 65.84 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.336 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.11 -35.75 71.91 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.681 -175.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -98.27 2.72 48.49 Favored 'General case' 0 C--N 1.313 -1.012 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.91 -178.799 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 62.66 37.56 12.74 Favored 'General case' 0 CA--C 1.504 -0.792 0 C-N-CA 123.383 0.673 . . . . 0.0 109.553 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 48.7 mm -67.45 110.69 1.85 Allowed 'Isoleucine or valine' 0 N--CA 1.434 -1.246 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.523 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 84.7 p -99.3 -169.79 1.81 Allowed 'General case' 0 N--CA 1.421 -1.886 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.584 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.578 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -66.69 -23.19 72.23 Favored Glycine 0 N--CA 1.436 -1.346 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 179.216 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.53 -46.34 89.16 Favored 'General case' 0 N--CA 1.442 -0.828 0 C-N-CA 124.09 0.956 . . . . 0.0 109.546 178.243 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.421 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -88.76 -19.97 25.36 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.6 -179.802 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.466 HD12 HG23 ' A' ' 12' ' ' VAL . 2.8 tt -62.78 -50.39 71.23 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 124.492 1.117 . . . . 0.0 108.927 178.151 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.0 mt -58.71 -41.53 86.58 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.13 -177.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -97.07 16.17 20.39 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.443 -175.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.478 ' HB2' HD22 ' A' ' 64' ' ' LEU . 34.1 mt -57.42 154.59 10.59 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.69 0.757 . . . . 0.0 112.556 176.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -159.9 168.17 26.38 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -50.78 -40.09 40.69 Favored Glycine 0 C--O 1.204 -1.75 0 O-C-N 123.95 0.781 . . . . 0.0 111.739 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -51.99 -49.02 64.11 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 178.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.439 ' O ' HD23 ' A' ' 49' ' ' LEU . 12.8 mtpp -67.99 -46.86 70.12 Favored 'General case' 0 C--O 1.196 -1.724 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.259 177.577 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 74.1 mt -59.27 -26.49 64.98 Favored 'General case' 0 C--O 1.255 1.381 0 C-N-CA 123.554 0.742 . . . . 0.0 112.271 -177.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.74 ' HA ' HG22 ' A' ' 52' ' ' THR . 57.0 mtpt -79.5 -37.23 37.21 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.735 175.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.98 -9.88 59.2 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.532 0.682 . . . . 0.0 110.682 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.533 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.2 mm? -82.24 0.6 40.53 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.423 -0.808 . . . . 0.0 108.987 173.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 67.78 4.12 31.71 Favored Glycine 0 C--O 1.224 -0.484 0 N-CA-C 114.607 0.603 . . . . 0.0 114.607 174.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.534 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 14.5 tpt -94.76 -48.86 5.86 Favored 'General case' 0 C--N 1.311 -1.108 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.343 -178.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.74 HG22 ' HA ' ' A' ' 47' ' ' LYS . 62.3 p 59.38 2.9 0.34 Allowed 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 126.489 1.916 . . . . 0.0 115.471 174.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.503 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 20.3 m -55.35 123.52 14.11 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 125.191 1.397 . . . . 0.0 113.705 -174.073 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.8 t -61.76 -48.02 82.57 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 -173.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.0 pp0? -64.81 -38.35 90.69 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 122.135 0.969 . . . . 0.0 108.576 -176.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.63 ' O ' HG12 ' A' ' 60' ' ' VAL . 7.5 m-20 -70.24 -47.24 62.21 Favored 'General case' 0 N--CA 1.42 -1.934 0 CA-C-N 113.458 -1.701 . . . . 0.0 109.553 -174.086 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.527 ' HA ' HG12 ' A' ' 60' ' ' VAL . 44.2 mtm180 -68.28 -11.98 60.31 Favored 'General case' 0 C--O 1.213 -0.829 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 179.26 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.69 -30.04 19.42 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 174.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 36.9 tp -86.38 -44.99 11.61 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.478 -176.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.63 HG12 ' O ' ' A' ' 56' ' ' ASP . 5.0 p -61.62 -26.59 40.07 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.134 0 CA-C-O 121.405 0.622 . . . . 0.0 109.538 177.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 54.1 tptt -74.4 -27.0 60.44 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.135 -174.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -82.22 -45.87 14.48 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 113.827 -1.533 . . . . 0.0 108.478 177.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.407 ' HE3' ' CB ' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -67.01 -42.16 85.43 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.513 -175.613 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.521 ' HA ' ' HG2' ' A' ' 67' ' ' MET . 3.7 pp -62.9 -30.6 71.66 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -177.234 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.3 ptmm? -87.13 -11.12 51.01 Favored 'General case' 0 C--N 1.309 -1.165 0 C-N-CA 118.927 -1.109 . . . . 0.0 111.68 -177.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -112.97 7.53 18.21 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 120.939 -0.304 . . . . 0.0 110.313 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.521 ' HG2' ' HA ' ' A' ' 64' ' ' LEU . 92.5 mmm -46.14 -33.35 3.5 Favored 'General case' 0 C--O 1.191 -1.997 0 C-N-CA 123.899 0.88 . . . . 0.0 112.168 -179.179 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 6.7 ptpp? -50.15 -41.0 48.21 Favored 'General case' 0 C--N 1.297 -1.714 0 C-N-CA 124.386 1.074 . . . . 0.0 112.526 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 20.2 ptt? -106.55 -24.11 12.27 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-O 121.435 0.636 . . . . 0.0 109.97 177.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 42.1 m -81.91 -21.58 37.27 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -175.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.4 pp -64.16 -32.62 74.27 Favored 'General case' 0 CA--C 1.499 -1.0 0 CA-C-O 122.126 0.965 . . . . 0.0 109.057 173.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -72.97 -41.02 64.83 Favored 'General case' 0 N--CA 1.411 -2.377 0 CA-C-N 113.912 -1.495 . . . . 0.0 111.736 -177.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 83.1 mttt -89.83 26.76 1.71 Allowed 'General case' 0 C--N 1.311 -1.067 0 CA-C-O 121.927 0.87 . . . . 0.0 111.152 -172.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.282 -2.369 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 177.238 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.492 -1.383 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -126.0 -29.53 3.06 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 64.0 mtt -90.07 149.48 22.49 Favored 'General case' 0 N--CA 1.419 -2.023 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 176.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.648 HG13 ' HB3' ' A' ' 71' ' ' LEU . 3.9 m -67.77 -28.58 42.09 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.112 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -168.095 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.2 p-80 -74.19 -9.77 58.95 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-O 121.179 0.514 . . . . 0.0 111.494 -178.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -90.42 -9.82 46.12 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 178.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.541 ' CD2' ' HA ' ' A' ' 4' ' ' VAL . 48.3 m0 -84.0 135.37 34.47 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.237 -177.047 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.433 ' O ' ' HB3' ' A' ' 34' ' ' SER . 16.1 m -93.3 -69.63 0.74 Allowed 'General case' 0 C--N 1.298 -1.631 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.638 -178.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.54 ' O ' HG12 ' A' ' 12' ' ' VAL . 61.4 t -143.81 -62.33 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 -179.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.35 -37.47 48.05 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 124.667 1.187 . . . . 0.0 111.952 179.217 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -78.57 -20.07 51.41 Favored 'General case' 0 N--CA 1.435 -1.177 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -174.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.54 HG12 ' O ' ' A' ' 9' ' ' VAL . 2.6 p -70.88 -22.36 23.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 CA-C-O 121.707 0.765 . . . . 0.0 109.218 -178.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.492 ' O ' HG23 ' A' ' 17' ' ' VAL . 1.4 m -73.76 -26.49 60.69 Favored 'General case' 0 N--CA 1.423 -1.807 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.363 -176.159 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 53.7 m-70 -60.48 -42.33 96.05 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 123.414 0.446 . . . . 0.0 110.142 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.486 ' O ' HD23 ' A' ' 19' ' ' LEU . 36.0 t90 -63.13 -59.21 5.07 Favored 'General case' 0 N--CA 1.442 -0.831 0 O-C-N 123.825 0.703 . . . . 0.0 109.749 177.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.428 HD11 ' CD2' ' A' ' 28' ' ' PHE . 43.9 mt -47.53 -51.21 21.46 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 124.43 1.081 . . . . 0.0 112.266 -178.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 13' ' ' SER . 78.1 t -61.92 -26.86 41.09 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 CA-C-O 120.822 0.344 . . . . 0.0 111.219 -177.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -71.13 -29.2 69.04 Favored Glycine 0 C--O 1.223 -0.544 0 N-CA-C 111.945 -0.462 . . . . 0.0 111.945 -177.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.488 HD13 ' CB ' ' A' ' 63' ' ' LYS . 0.5 OUTLIER -104.96 16.16 26.43 Favored 'General case' 0 C--N 1.314 -0.94 0 O-C-N 122.334 -0.51 . . . . 0.0 111.04 177.649 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 62.5 m 62.65 34.3 15.02 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 122.326 1.06 . . . . 0.0 111.497 -178.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.531 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -104.02 17.14 24.72 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 125.105 1.362 . . . . 0.0 108.552 176.792 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -54.96 -25.41 29.47 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.561 178.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.531 ' NE2' ' HA ' ' A' ' 21' ' ' LEU . 0.6 OUTLIER -69.36 -20.31 63.84 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 119.996 -0.682 . . . . 0.0 111.853 177.126 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.423 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 3.8 m-85 -82.08 -19.49 40.11 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.153 -179.694 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 97.7 t -56.05 -36.32 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 O-C-N 123.212 0.32 . . . . 0.0 110.506 177.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 39.0 t -50.37 -38.75 44.05 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.246 1.018 . . . . 0.0 111.573 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.655 ' HG2' ' O ' ' A' ' 49' ' ' LEU . 19.0 tp10 -105.12 -32.71 8.56 Favored 'General case' 0 C--N 1.312 -1.058 0 O-C-N 121.962 -0.461 . . . . 0.0 110.917 -178.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.428 ' CD2' HD11 ' A' ' 16' ' ' LEU . 2.1 m-85 -55.17 -40.6 70.86 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-O 121.72 0.771 . . . . 0.0 110.3 176.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 33.8 t -79.03 -21.81 46.37 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.52 -178.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.47 -38.41 62.93 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.0 0.429 . . . . 0.0 110.654 -177.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.448 HE21 ' HG3' ' A' ' 27' ' ' GLU . 1.4 pt20 -101.35 16.35 25.85 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 -179.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 59.03 39.56 23.26 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 121.194 0.521 . . . . 0.0 111.362 174.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.529 HG23 ' HB2' ' A' ' 37' ' ' GLN . 49.9 mm -71.44 111.43 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.385 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.473 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.433 ' HB3' ' O ' ' A' ' 8' ' ' SER . 65.9 p -105.81 -169.85 1.65 Allowed 'General case' 0 N--CA 1.418 -2.051 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.496 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -62.14 -25.8 66.82 Favored Glycine 0 N--CA 1.436 -1.303 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.695 176.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -59.78 -36.74 77.3 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 123.379 0.672 . . . . 0.0 109.621 179.083 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.529 ' HB2' HG23 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -89.96 -40.08 12.58 Favored 'General case' 0 C--O 1.215 -0.747 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.326 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.517 HD12 HG23 ' A' ' 12' ' ' VAL . 3.4 tt -49.7 -48.69 49.63 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.971 1.708 . . . . 0.0 111.268 -174.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 29.5 mt -61.96 -40.73 96.57 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.018 -177.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.413 HE22 ' HD2' ' A' ' 45' ' ' LYS . 5.0 pp0? -97.14 11.37 36.52 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -176.064 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.435 ' HG ' ' HA ' ' A' ' 38' ' ' LEU . 46.8 mt -53.86 150.29 7.77 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 121.446 0.641 . . . . 0.0 112.618 178.427 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.431 ' O ' ' HG ' ' A' ' 46' ' ' LEU . 25.8 t70 -153.82 179.51 8.8 Favored 'General case' 0 C--N 1.295 -1.793 0 N-CA-C 105.707 -1.96 . . . . 0.0 105.707 178.187 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -60.92 -35.98 91.37 Favored Glycine 0 CA--C 1.488 -1.655 0 N-CA-C 110.971 -0.852 . . . . 0.0 110.971 -179.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -52.93 -47.66 67.86 Favored 'General case' 0 CA--C 1.498 -1.036 0 C-N-CA 123.322 0.649 . . . . 0.0 111.453 177.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.431 ' HD3' HD23 ' A' ' 41' ' ' LEU . 13.4 mtpp -68.82 -44.04 74.32 Favored 'General case' 0 C--O 1.192 -1.962 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.063 177.176 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 42' ' ' ASP . 90.0 mt -58.58 -31.0 67.61 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-O 121.702 0.763 . . . . 0.0 111.392 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.733 ' HA ' HG22 ' A' ' 52' ' ' THR . 74.1 mttt -77.71 -26.55 50.18 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.897 177.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.21 -5.48 58.53 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-O 121.691 0.758 . . . . 0.0 110.215 178.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.655 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 4.5 mm? -83.97 -5.49 59.23 Favored 'General case' 0 C--O 1.203 -1.371 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 172.768 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.21 -7.29 8.27 Favored Glycine 0 C--O 1.222 -0.626 0 CA-C-N 116.114 -0.494 . . . . 0.0 113.534 176.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.423 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 14.1 tpt -81.08 -50.42 9.66 Favored 'General case' 0 N--CA 1.432 -1.364 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 -177.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.733 HG22 ' HA ' ' A' ' 47' ' ' LYS . 80.5 p 57.3 14.37 2.1 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.422 1.489 . . . . 0.0 114.507 173.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.404 ' OG ' ' HG3' ' A' ' 51' ' ' MET . 70.9 m -63.26 129.2 39.27 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 123.801 0.84 . . . . 0.0 112.238 -174.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.8 t -61.15 -47.28 86.94 Favored 'General case' 0 C--O 1.241 0.631 0 C-N-CA 124.59 1.156 . . . . 0.0 112.81 -172.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -54.22 -55.48 27.61 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 122.234 1.016 . . . . 0.0 108.983 177.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.771 ' O ' HG12 ' A' ' 60' ' ' VAL . 4.5 m-20 -60.16 -45.89 91.54 Favored 'General case' 0 N--CA 1.417 -2.121 0 CA-C-N 113.161 -1.836 . . . . 0.0 109.425 -175.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -48.52 -34.13 10.76 Favored 'General case' 0 CA--C 1.507 -0.71 0 C-N-CA 124.411 1.084 . . . . 0.0 112.958 178.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -94.47 -40.34 9.94 Favored 'General case' 0 C--N 1.306 -1.314 0 O-C-N 123.714 0.634 . . . . 0.0 110.873 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.7 tp -68.81 -51.99 34.93 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -175.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.771 HG12 ' O ' ' A' ' 56' ' ' ASP . 7.5 p -67.2 -21.84 28.48 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.249 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.9 tmtt? -70.8 -30.34 66.78 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -178.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.659 ' O ' ' HG2' ' A' ' 65' ' ' LYS . 85.8 tttt -83.17 -42.13 17.67 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 114.447 -1.252 . . . . 0.0 109.134 179.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.488 ' CB ' HD13 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -69.54 -28.5 66.07 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.399 -179.396 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.739 ' O ' ' HG3' ' A' ' 67' ' ' MET . 1.9 pp -79.88 -16.71 54.83 Favored 'General case' 0 C--O 1.204 -1.311 0 CA-C-O 120.971 0.415 . . . . 0.0 111.198 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.659 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 14.5 ptmm? -82.65 -17.07 45.91 Favored 'General case' 0 C--N 1.295 -1.8 0 C-N-CA 118.026 -1.47 . . . . 0.0 109.201 175.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -118.38 18.43 13.64 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.913 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.739 ' HG3' ' O ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -55.33 -21.7 16.12 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 -179.557 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -64.65 -28.07 69.36 Favored 'General case' 0 C--N 1.287 -2.132 0 CA-C-N 114.648 -1.16 . . . . 0.0 111.478 178.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.472 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 15.9 ptp -108.45 -18.65 13.69 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.084 -0.647 . . . . 0.0 109.557 174.694 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.517 ' HB2' ' HA ' ' A' ' 67' ' ' MET . 20.9 m -74.18 -29.2 61.64 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 116.614 -0.266 . . . . 0.0 110.824 178.383 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.648 ' HB3' HG13 ' A' ' 4' ' ' VAL . 4.4 pp -57.55 -33.03 67.7 Favored 'General case' 0 CA--C 1.487 -1.453 0 CA-C-O 122.299 1.047 . . . . 0.0 110.602 173.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.495 ' N ' HD12 ' A' ' 71' ' ' LEU . 9.1 tt0 -78.75 -33.74 46.33 Favored 'General case' 0 N--CA 1.383 -3.801 0 CA-C-N 113.497 -1.683 . . . . 0.0 111.262 -177.136 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 69' ' ' MET . 76.7 mttt -72.41 -52.58 15.35 Favored 'General case' 0 N--CA 1.432 -1.341 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 -178.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.958 0 O-C-N 124.817 1.323 . . . . 0.0 110.279 -176.984 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.79 0 N-CA-C 111.58 -0.608 . . . . 0.0 111.58 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -137.71 11.03 2.92 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 117.255 0.527 . . . . 0.0 111.444 -177.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.447 ' HA ' HD13 ' A' ' 71' ' ' LEU . 76.6 mtm -77.77 160.85 28.12 Favored 'General case' 0 N--CA 1.441 -0.911 0 C-N-CA 120.422 -0.511 . . . . 0.0 111.025 -178.661 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.579 HG13 HD22 ' A' ' 71' ' ' LEU . 17.2 m -65.58 -32.71 59.39 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.974 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -170.078 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 11.3 p-80 -73.36 -11.51 60.51 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-O 121.533 0.682 . . . . 0.0 110.749 -178.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -95.42 1.46 54.17 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.133 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.505 ' CH2' HG12 ' A' ' 4' ' ' VAL . 54.5 m0 -85.64 139.85 31.05 Favored 'General case' 0 CA--C 1.492 -1.259 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 176.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.2 m -94.18 -77.48 0.46 Allowed 'General case' 0 N--CA 1.419 -1.991 0 O-C-N 123.698 0.624 . . . . 0.0 110.701 -177.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.488 ' O ' HG12 ' A' ' 12' ' ' VAL . 55.2 t -141.43 -54.23 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-O 121.601 0.715 . . . . 0.0 109.661 -176.415 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.1 pm0 -77.31 -14.9 59.65 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.644 -178.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.408 ' HA ' ' CD2' ' A' ' 14' ' ' HIS . 38.9 mt-30 -83.57 -19.55 35.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.211 179.36 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 9' ' ' VAL . 1.9 p -72.63 -25.39 22.56 Favored 'Isoleucine or valine' 0 C--O 1.242 0.671 0 CA-C-O 121.851 0.834 . . . . 0.0 109.489 -177.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.07 -29.21 65.02 Favored 'General case' 0 N--CA 1.427 -1.623 0 CA-C-N 115.012 -0.994 . . . . 0.0 111.397 -175.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . 0.408 ' CD2' ' HA ' ' A' ' 11' ' ' GLN . 71.5 m-70 -59.91 -36.9 77.96 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 121.417 0.627 . . . . 0.0 109.77 -178.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.502 ' O ' HD23 ' A' ' 19' ' ' LEU . 32.6 t90 -68.04 -59.65 3.09 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.123 177.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.457 HD11 ' CD2' ' A' ' 28' ' ' PHE . 44.1 mt -48.22 -51.01 27.27 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.103 0.961 . . . . 0.0 112.231 -177.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 90.7 t -60.35 -24.54 31.32 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.959 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.317 -178.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.88 -37.67 50.38 Favored Glycine 0 N--CA 1.441 -1.02 0 N-CA-C 111.413 -0.675 . . . . 0.0 111.413 -177.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.502 HD23 ' O ' ' A' ' 15' ' ' TRP . 0.9 OUTLIER -98.13 18.18 16.78 Favored 'General case' 0 C--N 1.32 -0.704 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.672 -179.844 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.8 m 67.89 23.52 8.34 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-O 122.151 0.977 . . . . 0.0 111.466 179.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.429 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 1.3 mm? -99.94 20.06 15.04 Favored 'General case' 0 C--N 1.299 -1.611 0 C-N-CA 124.321 1.048 . . . . 0.0 109.538 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.413 ' HA ' HG23 ' A' ' 25' ' ' VAL . 9.5 p-10 -53.08 -27.0 18.13 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.422 1.089 . . . . 0.0 110.373 174.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -61.46 -21.8 64.49 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 125.414 1.486 . . . . 0.0 111.374 178.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.597 ' CZ ' ' HB3' ' A' ' 51' ' ' MET . 5.3 m-85 -93.35 -21.02 19.8 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 116.031 -0.532 . . . . 0.0 112.152 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.413 HG23 ' HA ' ' A' ' 22' ' ' ASP . 98.4 t -53.14 -39.53 34.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 O-C-N 123.346 0.404 . . . . 0.0 111.843 -179.389 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.2 m -52.46 -38.29 58.98 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 123.76 0.663 . . . . 0.0 112.1 -177.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.471 ' HG3' HD13 ' A' ' 49' ' ' LEU . 15.3 tp10 -103.93 -30.04 10.57 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.565 -177.43 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.457 ' CD2' HD11 ' A' ' 16' ' ' LEU . 1.7 m-85 -56.99 -47.55 80.56 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-O 121.529 0.68 . . . . 0.0 110.541 177.062 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.1 m -81.3 -5.26 57.62 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.351 -178.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -87.85 -41.21 13.39 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.747 178.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -91.5 8.16 37.82 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 120.088 -0.645 . . . . 0.0 110.793 -177.637 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.493 HD22 ' N ' ' A' ' 32' ' ' ASN . 0.7 OUTLIER 64.89 38.06 6.73 Favored 'General case' 0 CA--C 1.507 -0.7 0 O-C-N 124.045 0.841 . . . . 0.0 109.168 179.166 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 49.0 mm -71.64 109.52 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.311 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 -179.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.433 ' HB2' ' O ' ' A' ' 7' ' ' TRP . 97.1 p -103.94 -167.22 1.34 Allowed 'General case' 0 N--CA 1.432 -1.367 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.574 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.535 ' HA3' ' O ' ' A' ' 4' ' ' VAL . . . -63.82 -24.62 68.43 Favored Glycine 0 N--CA 1.436 -1.353 0 N-CA-C 111.685 -0.566 . . . . 0.0 111.685 178.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -60.27 -43.43 96.22 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 177.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.439 ' HA ' HE21 ' A' ' 40' ' ' GLN . 0.0 OUTLIER -91.6 -17.74 25.11 Favored 'General case' 0 N--CA 1.436 -1.132 0 C-N-CA 119.921 -0.711 . . . . 0.0 112.489 179.506 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.442 HD12 HG23 ' A' ' 12' ' ' VAL . 4.2 tt -66.34 -49.99 65.1 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 124.18 0.992 . . . . 0.0 109.48 179.085 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.9 mt -63.9 -34.6 78.33 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.223 0.535 . . . . 0.0 112.0 -177.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.439 HE21 ' HA ' ' A' ' 37' ' ' GLN . 5.0 pp0? -100.47 15.1 29.01 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -177.099 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.455 ' HB2' HD22 ' A' ' 64' ' ' LEU . 40.8 mt -53.11 152.17 4.42 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-O 121.759 0.79 . . . . 0.0 112.976 177.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -155.35 167.48 30.23 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 105.666 -1.975 . . . . 0.0 105.666 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.533 ' O ' ' HG3' ' A' ' 47' ' ' LYS . . . -54.17 -38.8 62.19 Favored Glycine 0 CA--C 1.493 -1.339 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 177.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -50.9 -49.19 59.95 Favored 'General case' 0 CA--C 1.503 -0.844 0 C-N-CA 123.244 0.618 . . . . 0.0 111.843 178.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.434 ' HD3' HD23 ' A' ' 41' ' ' LEU . 13.2 mtpp -64.67 -46.48 82.26 Favored 'General case' 0 C--O 1.196 -1.762 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.119 178.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 93.3 mt -57.22 -35.41 69.63 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-O 121.735 0.779 . . . . 0.0 111.272 -179.106 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.686 ' HA ' HG22 ' A' ' 52' ' ' THR . 55.5 mtpt -71.48 -35.12 70.71 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.315 178.14 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.6 -8.73 58.93 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.254 0.55 . . . . 0.0 110.864 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.471 HD13 ' HG3' ' A' ' 27' ' ' GLU . 4.0 mm? -85.26 -2.51 58.13 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.76 0.791 . . . . 0.0 108.963 174.144 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.84 0.84 57.19 Favored Glycine 0 N--CA 1.445 -0.76 0 CA-C-N 115.202 -0.908 . . . . 0.0 114.846 174.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.597 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . 16.7 tpt -83.65 -56.11 3.9 Favored 'General case' 0 CA--C 1.492 -1.277 0 C-N-CA 119.359 -0.937 . . . . 0.0 109.84 -178.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.686 HG22 ' HA ' ' A' ' 47' ' ' LYS . 76.7 p 53.02 40.73 31.67 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.086 0.954 . . . . 0.0 111.991 175.246 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.605 ' HB3' ' OD1' ' A' ' 56' ' ' ASP . 32.6 t -75.88 -179.77 5.04 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 177.116 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.3 m -107.74 -23.23 12.18 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 174.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -69.52 -42.6 74.47 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.857 -178.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.654 ' O ' HG12 ' A' ' 60' ' ' VAL . 8.9 p-10 -75.14 -41.38 58.44 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.065 -175.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 54.5 mmm-85 -55.55 -19.8 11.19 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.958 0.903 . . . . 0.0 112.357 -176.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -101.19 -35.85 9.15 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.082 175.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 30.6 tp -84.01 -53.97 5.18 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 -174.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.654 HG12 ' O ' ' A' ' 56' ' ' ASP . 8.1 p -64.28 -24.41 35.61 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.239 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -178.693 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -69.53 -30.11 67.86 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 114.423 -1.262 . . . . 0.0 108.906 -176.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.41 ' HB2' ' NZ ' ' A' ' 62' ' ' LYS . 3.8 ttmp? -86.49 -38.52 17.18 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-N 114.026 -1.443 . . . . 0.0 109.353 -178.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.421 ' HG2' HD13 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -71.47 -41.5 69.29 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 114.954 -1.021 . . . . 0.0 111.382 -177.508 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.583 ' HA ' ' HG2' ' A' ' 67' ' ' MET . 3.6 pp -63.49 -31.5 72.69 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.996 -175.551 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -78.84 -26.91 44.15 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 119.841 -0.743 . . . . 0.0 111.644 -177.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -95.3 -1.37 51.52 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.037 -177.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.583 ' HG2' ' HA ' ' A' ' 64' ' ' LEU . 93.1 mmm -45.97 -39.6 9.17 Favored 'General case' 0 C--O 1.192 -1.937 0 CA-C-O 122.118 0.961 . . . . 0.0 112.068 -177.595 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.402 ' H ' ' HG2' ' A' ' 68' ' ' LYS . 20.8 pttp -72.44 -6.36 43.1 Favored 'General case' 0 C--N 1.261 -3.245 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -174.397 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 26.7 ptt? -133.38 5.64 3.77 Favored 'General case' 0 C--N 1.298 -1.668 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 174.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 51.2 m -131.67 -12.25 3.41 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -176.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.579 HD22 HG13 ' A' ' 4' ' ' VAL . 4.0 pp -60.04 -37.19 79.09 Favored 'General case' 0 CA--C 1.503 -0.842 0 CA-C-N 118.557 0.617 . . . . 0.0 111.371 -175.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -62.36 -40.8 97.61 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.421 177.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -87.02 -48.59 7.97 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.954 -173.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.996 0 C-N-CA 125.311 1.444 . . . . 0.0 110.693 -178.09 . . . . . . . . 0 0 . 1 stop_ save_